| 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 | 31.6 | Very low | 29.6 | Very low | 242 Ų | 242 | 160.4 Ų | 160.4 | 100% | 1.192 | 85% | 0.853 | S | S | * | * | 0 | 123.5 | 0 | -88.1 | 163.8 | 146.2 | 0 | 0 | 109.4 | |||||
| 2 | S | 29.2 | Very low | 29.1 | Very low | 110 Ų | 110 | 163.7 Ų | 163.7 | 77% | 0.769 | 86% | 0.86 | S | S | * | * | trans | 43.7 | 106.4 | 162 | 65.9 | 0 | 0 | 0 | 0 | 120.2 | ||||
| 3 | R | 30.5 | Very low | 29.1 | Very low | 252 Ų | 252 | 159.3 Ų | 159.3 | 95% | 0.951 | 85% | 0.852 | S | S | * | * | 65.9 | 116.6 | 84.9 | -86.4 | -170 | 179.7 | 176.8 | 0.7 | 114.6 | |||||
| 4 | S | 26.4 | Very low | 28.8 | Very low | 120 Ų | 120 | 158.9 Ų | 158.9 | 84% | 0.839 | 86% | 0.857 | S | S | * | * | trans | -142.4 | 144.2 | 138.9 | 48.1 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 5 | P | 39.7 | Very low | 28.4 | Very low | 113 Ų | 113 | 152.9 Ų | 152.9 | 73% | 0.734 | 85% | 0.848 | S | S | * | * | trans | -115.1 | 164.6 | -165.1 | 35.6 | -18.6 | 0 | 0 | 0 | 114.8 | ||||
| 6 | L | 29.8 | Very low | 28.5 | Very low | 156 Ų | 156 | 150.8 Ų | 150.8 | 82% | 0.817 | 85% | 0.846 | S | S | * | * | trans | 27.1 | 130.5 | 143.8 | -75 | 139 | 0 | 0 | 0 | 120.1 | ||||
| 7 | N | 25.3 | Very low | 28.4 | Very low | 161 Ų | 161 | 152.8 Ų | 152.8 | 86% | 0.861 | 85% | 0.847 | S | S | * | * | -149.6 | 146.3 | 117.6 | -118 | -5.5 | 0 | 0 | 0 | 112.7 | |||||
| 8 | P | 37 | Very low | 28.6 | Very low | 91 Ų | 91 | 153.7 Ų | 153.7 | 59% | 0.591 | 85% | 0.851 | S | S | * | * | trans | -94.5 | 164 | -169.9 | 39 | -32.9 | 0 | 0 | 0 | 111.3 | ||||
| 9 | N | 24 | Very low | 28.5 | Very low | 173 Ų | 173 | 150.4 Ų | 150.4 | 93% | 0.925 | 85% | 0.845 | S | S | * | * | trans | -140.6 | 129.8 | 155.6 | -103.1 | -19.1 | 0 | 0 | 0 | 111.6 | ||||
| 10 | Q | 26.3 | Very low | 28.6 | Very low | 183 Ų | 183 | 151.9 Ų | 151.9 | 86% | 0.855 | 85% | 0.85 | S | S | * | * | trans | -75.4 | 161.5 | -176.3 | -74.2 | -157.5 | -10.5 | 0 | 0 | 113.2 | ||||
| 11 | L | 25.8 | Very low | 28.6 | Very low | 163 Ų | 163 | 148.6 Ų | 148.6 | 85% | 0.853 | 84% | 0.843 | S | S | * | * | trans | -43 | 141.7 | 169.8 | -78.7 | 77.5 | 0 | 0 | 0 | 114.9 | ||||
| 12 | Q | 24.2 | Very low | 28.4 | Very low | 200 Ų | 200 | 143.1 Ų | 143.1 | 94% | 0.935 | 83% | 0.825 | S | S | * | * | trans | -129.7 | 126.1 | 141.2 | -88.3 | -177.7 | -13.9 | 0 | 0 | 109.2 | ||||
| 13 | S | 28 | Very low | 28.7 | Very low | 107 Ų | 107 | 145.6 Ų | 145.6 | 75% | 0.748 | 83% | 0.829 | S | S | * | * | trans | -91.7 | 132.4 | 169.7 | 61.1 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 14 | V | 25.2 | Very low | 28.8 | Very low | 154 Ų | 154 | 138.8 Ų | 138.8 | 93% | 0.933 | 82% | 0.817 | S | S | * | * | trans | -160.7 | 134.1 | 145.1 | 175.4 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 15 | G | 23.7 | Very low | 29 | Very low | 69 Ų | 69 | 138.6 Ų | 138.6 | 71% | 0.711 | 81% | 0.813 | S | S | * | * | trans | 119.9 | 97.4 | 139.5 | 0 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 16 | S | 28.7 | Very low | 28.6 | Very low | 118 Ų | 118 | 139.1 Ų | 139.1 | 83% | 0.825 | 82% | 0.817 | S | S | * | * | trans | -57.1 | 125.1 | 157.7 | 168 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 17 | Q | 26.9 | Very low | 28.6 | Very low | 185 Ų | 185 | 135.6 Ų | 135.6 | 86% | 0.864 | 81% | 0.81 | S | S | * | * | trans | -145.3 | 123.2 | 152.8 | -74.2 | -167.6 | -5.7 | 0 | 0 | 109.2 | A19 | Q17-A19 PolarHBondContact O-N 3.22Š| ||
| 18 | D | 32.5 | Very low | 28.6 | Very low | 170 Ų | 170 | 133.7 Ų | 133.7 | 91% | 0.909 | 81% | 0.806 | S | S | * | * | trans | -55.2 | 113.2 | 166 | -71.7 | -52.4 | 0 | 0 | 0 | 110.3 | ||||
| 19 | A | 27 | Very low | 28 | Very low | 90 Ų | 90 | 138.5 Ų | 138.5 | 74% | 0.744 | 82% | 0.821 | S | S | * | * | trans | -136.9 | 114.7 | 166.6 | 0 | 0 | 0 | 0 | 0 | 108.8 | Q17 A21 | Q17-A19 PolarHBondContact O-N 3.22Å; A19-A21 PolarHBondContact O-N 3.06Å; A19-A21 VanDerWaalsContact O-N 3.14Å | ||
| 20 | L | 30.6 | Very low | 28 | Very low | 180 Ų | 180 | 136.1 Ų | 136.1 | 94% | 0.942 | 81% | 0.808 | S | S | * | * | trans | -45.8 | 114.2 | 172.7 | -137.3 | 88.7 | 0 | 0 | 0 | 109.9 | ||||
| 21 | A | 28.3 | Very low | 27.8 | Very low | 84 Ų | 84 | 133.6 Ų | 133.6 | 69% | 0.694 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -63.3 | 135.2 | 173.7 | 0 | 0 | 0 | 0 | 0 | 109.6 | A19 L23 | A19-A21 PolarHBondContact O-N 3.06Å; A19-A21 VanDerWaalsContact O-N 3.14Å; A21-L23 PolarHBondContact O-N 3.23Å |
| 22 | P | 28.2 | Very low | 27.8 | Very low | 126 Ų | 126 | 130.2 Ų | 130.2 | 82% | 0.818 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -65.2 | 129.1 | 176.2 | -6.6 | 19.9 | 0 | 0 | 0 | 109 | ||
| 23 | L | 34 | Very low | 27.9 | Very low | 163 Ų | 163 | 126.9 Ų | 126.9 | 85% | 0.853 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -48.4 | 134.5 | 168.4 | -79.6 | 154 | 0 | 0 | 0 | 109.6 | A21 | A21-L23 PolarHBondContact O-N 3.23Š|
| 24 | P | 34.3 | Very low | 28 | Very low | 108 Ų | 108 | 128.2 Ų | 128.2 | 70% | 0.701 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -58.9 | 141.3 | 173 | 24.3 | -31.1 | 0 | 0 | 0 | 109 | ||
| 25 | P | 30.3 | Very low | 28 | Very low | 116 Ų | 116 | 125.8 Ų | 125.8 | 75% | 0.753 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -58.6 | 141.4 | 179.7 | 24.5 | -32.3 | 0 | 0 | 0 | 109.4 | A27 | P25-A27 PolarHBondContact O-N 3.33Š|
| 26 | P | 30.8 | Very low | 28.6 | Very low | 125 Ų | 125 | 129.2 Ų | 129.2 | 81% | 0.812 | 77% | 0.766 | S | S | * | * | P | Polyproline II helix | trans | -57.2 | 129.7 | 176 | 23.4 | -31.4 | 0 | 0 | 0 | 108.7 | ||
| 27 | A | 29.7 | Very low | 29.1 | Very low | 82 Ų | 82 | 130.1 Ų | 130.1 | 68% | 0.678 | 76% | 0.762 | S | S | * | * | P | Polyproline II helix | trans | -51.4 | 139.2 | 175.6 | 0 | 0 | 0 | 0 | 0 | 109.7 | P25 Q29 | P25-A27 PolarHBondContact O-N 3.33Å; A27-Q29 PolarHBondContact O-N 3.14Å |
| 28 | P | 25.5 | Very low | 30 | Very low | 121 Ų | 121 | 123.3 Ų | 123.3 | 79% | 0.786 | 73% | 0.734 | S | S | * | * | P | Polyproline II helix | trans | -55.9 | 119.6 | 178.9 | 21.1 | -30.7 | 0 | 0 | 0 | 109.2 | N30 | P28-N30 PolarHBondContact O-N 3.34Š|
| 29 | Q | 24.9 | Very low | 30.7 | Very low | 191 Ų | 191 | 119.1 Ų | 119.1 | 89% | 0.893 | 71% | 0.711 | S | S | * | * | trans | -63.7 | 102.5 | 172.9 | -69.4 | -178.3 | -6.1 | 0 | 0 | 107.9 | A27 P31 | A27-Q29 PolarHBondContact O-N 3.14Å; Q29-P31 WeakPolarHBondContact O-CD 3.38Å | ||
| 30 | N | 22.5 | Very low | 31.6 | Very low | 124 Ų | 124 | 119.4 Ų | 119.4 | 66% | 0.663 | 71% | 0.707 | S | S | * | * | trans | -66.8 | 120.2 | 171.6 | -105.2 | -17.7 | 0 | 0 | 0 | 108.8 | P28 S32 | P28-N30 PolarHBondContact O-N 3.34Å; N30-S32 PolarHBondContact O-N 3.26Å | ||
| 31 | P | 23.6 | Very low | 32.6 | Very low | 130 Ų | 130 | 113 Ų | 113 | 84% | 0.844 | 68% | 0.684 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.3 | 36.6 | -175.4 | 32.3 | -33.9 | 0 | 0 | 0 | 113.8 | Q29 | Q29-P31 WeakPolarHBondContact O-CD 3.38Š|
| 32 | S | 25.7 | Very low | 34.1 | Very low | 92 Ų | 92 | 114.5 Ų | 114.5 | 64% | 0.643 | 69% | 0.689 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -134 | 11.2 | -175.7 | 70 | 0 | 0 | 0 | 0 | 116.2 | N30 H34 | N30-S32 PolarHBondContact O-N 3.26Å; S32-H34 PolarHBondContact O-N 3.46Å |
| 33 | T | 26.3 | Very low | 36.2 | Very low | 129 Ų | 129 | 109 Ų | 109 | 79% | 0.791 | 65% | 0.653 | S | S | * | * | trans | -81.6 | 66.3 | 169.3 | 40.2 | 0 | 0 | 0 | 0 | 110.6 | S35 | T33-S35 PolarHBondContact O-N 3.07Å; T33-S35 VanDerWaalsContact O-N 3.12Å | ||
| 34 | H | 28.5 | Very low | 38.6 | Very low | 136 Ų | 136 | 105 Ų | 105 | 63% | 0.63 | 64% | 0.636 | S | S | * | * | trans | -67.2 | 107.4 | 153.4 | -80.8 | -71.8 | 0 | 0 | 0 | 106.8 | S32 W36 | S32-H34 PolarHBondContact O-N 3.46Å; H34-W36 HydrophobicContact CB-CD2 4.27Å; H34-W36 VanDerWaalsContact CB-CE2 3.49Å; H34-W36 HydrophobicContact CB-CG 4.48Å; H34-W36 HydrophobicContact CB-CZ2 3.76Å; H34-W36 AromaticContact CG-CZ2 3.93Å; H34-W36 PolarHBondContact O-N 3.04Å | ||
| 35 | S | 26.3 | Very low | 41 | Very low | 103 Ų | 103 | 108.2 Ų | 108.2 | 72% | 0.72 | 64% | 0.635 | S | S | * | * | trans | -62.8 | 88 | 167.6 | 53.9 | 0 | 0 | 0 | 0 | 108.3 | T33 D37 | T33-S35 PolarHBondContact O-N 3.07Å; T33-S35 VanDerWaalsContact O-N 3.12Å; S35-D37 PolarHBondContact O-N 3.01Å | ||
| 36 | W | 35.2 | Very low | 43.7 | Very low | 140 Ų | 140 | 105.1 Ų | 105.1 | 53% | 0.53 | 62% | 0.624 | S | S | . | * | trans | -80.2 | 97.4 | 171.6 | -61.1 | 104.8 | 0 | 0 | 0 | 106.9 | H34 P38 | H34-W36 HydrophobicContact CB-CD2 4.27Å; H34-W36 VanDerWaalsContact CB-CE2 3.49Å; H34-W36 HydrophobicContact CB-CG 4.48Å; H34-W36 HydrophobicContact CB-CZ2 3.76Å; H34-W36 AromaticContact CG-CZ2 3.93Å; H34-W36 PolarHBondContact O-N 3.04Å; W36-P38 WeakPolarHBondContact O-CD 3.34Å | ||
| 37 | D | 39.4 | Very low | 46.3 | Very low | 138 Ų | 138 | 100.4 Ų | 100.4 | 74% | 0.738 | 59% | 0.592 | S | S | * | * | trans | -52.9 | 123 | 165.9 | -76.9 | -33.6 | 0 | 0 | 0 | 107.4 | S35 L39 | S35-D37 PolarHBondContact O-N 3.01Å; D37-L39 PolarHBondContact O-N 2.95Å; D37-L39 VanDerWaalsContact O-N 3.09Å | ||
| 38 | P | 46.1 | Very low | 49.2 | Very low | 41 Ų | 41 | 96.5 Ų | 96.5 | 27% | 0.266 | 56% | 0.559 | S | S | . | * | trans | -52.9 | 125.6 | 174.4 | 16.1 | -25.5 | 0 | 0 | 0 | 107.4 | W36 C40 | W36-P38 WeakPolarHBondContact O-CD 3.34Å; P38-C40 PolarHBondContact O-N 2.96Å | ||
| 39 | L | 48.5 | Very low | 52.4 | Low | 82 Ų | 82 | 93.7 Ų | 93.7 | 43% | 0.429 | 54% | 0.542 | S | S | . | . | trans | -63.3 | 81.1 | 177.7 | -92.5 | 97.8 | 0 | 0 | 0 | 109.1 | D37 L43 | D37-L39 PolarHBondContact O-N 2.95Å; D37-L39 VanDerWaalsContact O-N 3.09Å; L39-L43 HydrophobicContact CB-CD1 4.22Å; L39-L43 HydrophobicContact CD2-CD1 4.17Å | ||
| 40 | C | 45.1 | Very low | 55.6 | Low | 97 Ų | 97 | 88 Ų | 88 | 66% | 0.655 | 52% | 0.518 | S | S | * | . | trans | -91.4 | 11.8 | 176.6 | -139.8 | 0 | 0 | 0 | 0 | 110.6 | P38 | P38-C40 PolarHBondContact O-N 2.96Š| ||
| 41 | G | 51.7 | Low | 58.9 | Low | 45 Ų | 45 | 82.4 Ų | 82.4 | 46% | 0.464 | 49% | 0.488 | S | S | . | . | S | Bend | trans | -87 | 165.9 | 175.3 | 0 | 0 | 0 | 0 | 0 | 113 | L43 | G41-L43 WeakPolarHBondContact O-CD1 3.31Å; G41-L43 PolarHBondContact O-N 3.11Å |
| 42 | S | 59.2 | Low | 62.3 | Low | 115 Ų | 115 | 76.3 Ų | 76.3 | 80% | 0.804 | 45% | 0.448 | S | S | * | . | trans | -63.8 | 103.8 | 174.4 | 55 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 43 | L | 73.4 | Confident | 65.5 | Low | 11 Ų | 11 | 75.2 Ų | 75.2 | 6% | 0.058 | 44% | 0.435 | C | S | . | . | trans | -68.4 | 148.5 | 174 | -95.3 | 69.1 | 0 | 0 | 0 | 110.3 | L39 G41 W45 L47 S48 L51 | L39-L43 HydrophobicContact CB-CD1 4.22Å; L39-L43 HydrophobicContact CD2-CD1 4.17Å; G41-L43 WeakPolarHBondContact O-CD1 3.31Å; G41-L43 PolarHBondContact O-N 3.11Å; L43-W45 PolarHBondContact O-N 3.19Å; L43-L47 HydrophobicContact CD2-CD2 3.59Å; L43-L47 HydrophobicContact CD2-CG 3.96Å; L43-L47 HydrophobicContact CG-CD2 4.01Å; L43-S48 VanDerWaalsContact CB-OG 3.27Å; L43-S48 WeakPolarHBondContact CB-OG 3.45Å; L43-L51 HydrophobicContact CD2-CD1 3.37Å | ||
| 44 | P | 84.1 | Confident | 68.7 | Low | 78 Ų | 78 | 69 Ų | 69 | 51% | 0.506 | 40% | 0.397 | S | S | . | . | trans | -52.4 | 134.5 | 169.8 | -23.7 | 32.6 | 0 | 0 | 0 | 110.7 | G46 L47 S48 | P44-G46 PolarHBondContact O-N 3.29Å; P44-G46 VanDerWaalsContact O-N 3.1Å; P44-L47 PolarHBondContact O-N 3.07Å; P44-S48 PolarHBondContact O-N 2.87Å; P44-S48 PolarHBondContact O-OG 3.17Å | ||
| 45 | W | 84.4 | Confident | 71.8 | Confident | 177 Ų | 177 | 63.1 Ų | 63.1 | 67% | 0.67 | 37% | 0.37 | S | S | * | . | H | α-helix | trans | -50.8 | -40.8 | -175.6 | -80.4 | 100 | 0 | 0 | 0 | 113.8 | L43 L47 S48 C49 L406 | L43-W45 PolarHBondContact O-N 3.19Å; W45-L47 PolarHBondContact O-N 3.19Å; W45-S48 PolarHBondContact O-N 3.25Å; W45-C49 PolarHBondContact O-N 3.39Å; W45-C49 PolarHBondContact O-SG 2.9Å; W45-L406 HydrophobicContact CE3-CD1 4.29Å; W45-L406 HydrophobicContact CZ3-CD1 4.22Å; W45-L406 HydrophobicContact CZ3-CD2 4.14Å; W45-L406 HydrophobicContact CZ3-CG 4.44Å |
| 46 | G | 86.7 | Confident | 75 | Confident | 51 Ų | 51 | 58.3 Ų | 58.3 | 53% | 0.526 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -60.9 | -43.5 | 177.5 | 0 | 0 | 0 | 0 | 0 | 113.3 | P44 C49 L50 | P44-G46 PolarHBondContact O-N 3.29Å; P44-G46 VanDerWaalsContact O-N 3.1Å; G46-C49 PolarHBondContact O-N 3.19Å; G46-L50 WeakPolarHBondContact O-CG 3.28Å; G46-L50 PolarHBondContact O-N 3.19Å; G46-L50 VanDerWaalsContact O-N 3.13Å |
| 47 | L | 86.8 | Confident | 77.6 | Confident | 25 Ų | 25 | 52.4 Ų | 52.4 | 13% | 0.131 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -68.3 | -40.7 | 177 | -177.9 | 65.7 | 0 | 0 | 0 | 111.1 | L43 P44 W45 C49 L50 L51 L267 L272 | L43-L47 HydrophobicContact CD2-CD2 3.59Å; L43-L47 HydrophobicContact CD2-CG 3.96Å; L43-L47 HydrophobicContact CG-CD2 4.01Å; P44-L47 PolarHBondContact O-N 3.07Å; W45-L47 PolarHBondContact O-N 3.19Å; L47-C49 VanDerWaalsContact C-N 3.29Å; L47-C49 PolarHBondContact O-N 3.35Å; L47-L50 PolarHBondContact O-N 3.26Å; L47-L51 HydrophobicContact CG-CD1 4.18Å; L47-L51 WeakPolarHBondContact O-CG 3.49Å; L47-L51 PolarHBondContact O-N 3.18Å; L47-L267 HydrophobicContact CD2-CD2 3.91Å; L47-L272 HydrophobicContact CD1-CD1 4.38Å; L47-L272 HydrophobicContact CD2-CD1 4.1Å |
| 48 | S | 89.8 | Confident | 80.1 | Confident | 0 Ų | 0 | 45.9 Ų | 45.9 | 0% | 0 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -59.7 | -39.8 | 175.4 | -60.1 | 0 | 0 | 0 | 0 | 111.9 | L43 P44 W45 A52 | L43-S48 VanDerWaalsContact CB-OG 3.27Å; L43-S48 WeakPolarHBondContact CB-OG 3.45Å; P44-S48 PolarHBondContact O-N 2.87Å; P44-S48 PolarHBondContact O-OG 3.17Å; W45-S48 PolarHBondContact O-N 3.25Å; S48-A52 VanDerWaalsContact O-CB 3.3Å; S48-A52 WeakPolarHBondContact O-CB 3.3Å; S48-A52 PolarHBondContact O-N 3.12Å |
| 49 | C | 91.8 | Very high | 82.3 | Confident | 63 Ų | 63 | 44 Ų | 44 | 43% | 0.426 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -64.4 | -41.9 | 174 | -71.1 | 0 | 0 | 0 | 0 | 112.6 | W45 G46 L47 A52 L53 | W45-C49 PolarHBondContact O-N 3.39Å; W45-C49 PolarHBondContact O-SG 2.9Å; G46-C49 PolarHBondContact O-N 3.19Å; L47-C49 VanDerWaalsContact C-N 3.29Å; L47-C49 PolarHBondContact O-N 3.35Å; C49-A52 PolarHBondContact O-N 2.81Å; C49-L53 PolarHBondContact O-N 3.35Å |
| 50 | L | 92.6 | Very high | 84.1 | Confident | 72 Ų | 72 | 40.1 Ų | 40.1 | 38% | 0.377 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -65.5 | -42.6 | 176.9 | -68.1 | 172.9 | 0 | 0 | 0 | 111.9 | G46 L47 A52 L53 Q54 L273 L276 | G46-L50 WeakPolarHBondContact O-CG 3.28Å; G46-L50 PolarHBondContact O-N 3.19Å; G46-L50 VanDerWaalsContact O-N 3.13Å; L47-L50 PolarHBondContact O-N 3.26Å; L50-A52 VanDerWaalsContact C-N 3.3Å; L50-A52 PolarHBondContact O-N 3.17Å; L50-L53 WeakPolarHBondContact O-CB 3.17Å; L50-L53 PolarHBondContact O-N 2.92Å; L50-Q54 PolarHBondContact O-N 3.4Å; L50-L273 HydrophobicContact CB-CD2 3.81Å; L50-L273 HydrophobicContact CD1-CD1 4.16Å; L50-L276 HydrophobicContact CB-CD2 4.19Å; L50-L276 HydrophobicContact CD2-CD2 3.95Å |
| 51 | L | 92.3 | Very high | 85.9 | Confident | 6 Ų | 6 | 35.7 Ų | 35.7 | 3% | 0.031 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -64.1 | -37.4 | 175.2 | -71.5 | 171.2 | 0 | 0 | 0 | 111.9 | L43 L47 Q54 H55 L272 L273 K392 I396 V403 | L43-L51 HydrophobicContact CD2-CD1 3.37Å; L47-L51 HydrophobicContact CG-CD1 4.18Å; L47-L51 WeakPolarHBondContact O-CG 3.49Å; L47-L51 PolarHBondContact O-N 3.18Å; L51-Q54 WeakPolarHBondContact O-CB 3.35Å; L51-Q54 PolarHBondContact O-N 3Å; L51-H55 PolarHBondContact O-CD2 3.01Å; L51-H55 VanDerWaalsContact O-CD2 3.3Å; L51-H55 PolarHBondContact O-N 3.34Å; L51-H55 VanDerWaalsContact O-N 3.08Å; L51-L272 HydrophobicContact CD2-CB 4.3Å; L51-L272 WeakPolarHBondContact CD2-O 3.27Å; L51-L273 HydrophobicContact CD2-CD2 4.47Å; L51-K392 PolarHBondContact O-NZ 3.16Å; L51-I396 HydrophobicContact CD2-CD1 4.09Å; L51-V403 HydrophobicContact CB-CG1 3.79Å; L51-V403 HydrophobicContact CB-CG2 4.1Å; L51-V403 HydrophobicContact CD1-CG2 4.14Å |
| 52 | A | 93.9 | Very high | 87.4 | Confident | 2 Ų | 2 | 34.1 Ų | 34.1 | 2% | 0.017 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -64.8 | -46.6 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.1 | S48 C49 L50 Q54 H55 V56 V403 L406 V407 | S48-A52 VanDerWaalsContact O-CB 3.3Å; S48-A52 WeakPolarHBondContact O-CB 3.3Å; S48-A52 PolarHBondContact O-N 3.12Å; C49-A52 PolarHBondContact O-N 2.81Å; L50-A52 VanDerWaalsContact C-N 3.3Å; L50-A52 PolarHBondContact O-N 3.17Å; A52-Q54 PolarHBondContact O-N 3.28Å; A52-H55 WeakPolarHBondContact O-CB 3.46Å; A52-H55 PolarHBondContact O-N 2.9Å; A52-H55 VanDerWaalsContact O-N 3.09Å; A52-V56 WeakPolarHBondContact O-CG2 2.96Å; A52-V56 PolarHBondContact O-N 3.08Å; A52-V403 HydrophobicContact CB-CG1 4.3Å; A52-L406 HydrophobicContact CB-CB 3.71Å; A52-V407 HydrophobicContact CB-CG2 3.75Å |
| 53 | L | 93.3 | Very high | 88.6 | Confident | 68 Ų | 68 | 28.6 Ų | 28.6 | 36% | 0.356 | 16% | 0.16 | S | C | . | . | H | α-helix | trans | -55.7 | -40.7 | 174.4 | -177.1 | 64.7 | 0 | 0 | 0 | 111.5 | C49 L50 V56 L57 L276 L410 | C49-L53 PolarHBondContact O-N 3.35Å; L50-L53 WeakPolarHBondContact O-CB 3.17Å; L50-L53 PolarHBondContact O-N 2.92Å; L53-V56 PolarHBondContact O-N 3.06Å; L53-L57 WeakPolarHBondContact O-CG 3.08Å; L53-L57 PolarHBondContact O-N 3.01Å; L53-L276 HydrophobicContact CD2-CD1 3.89Å; L53-L276 HydrophobicContact CD2-CD2 4.44Å; L53-L276 HydrophobicContact CG-CD1 4.16Å; L53-L410 HydrophobicContact CD1-CD2 4.18Å |
| 54 | Q | 92.9 | Very high | 88.8 | Confident | 0 Ų | 0 | 28.6 Ų | 28.6 | 0% | 0 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -65.6 | -38.6 | 177.3 | -166.7 | 177.6 | -30.3 | 0 | 0 | 113.3 | L50 L51 A52 V56 L57 V58 L272 V275 L276 K392 | L50-Q54 PolarHBondContact O-N 3.4Å; L51-Q54 WeakPolarHBondContact O-CB 3.35Å; L51-Q54 PolarHBondContact O-N 3Å; A52-Q54 PolarHBondContact O-N 3.28Å; Q54-V56 VanDerWaalsContact C-N 3.34Å; Q54-L57 PolarHBondContact O-N 3.49Å; Q54-V58 WeakPolarHBondContact O-CG2 3.44Å; Q54-V58 PolarHBondContact O-N 3.09Å; Q54-L272 PolarHBondContact OE1-O 3.43Å; Q54-L272 VanDerWaalsContact OE1-O 3.07Å; Q54-V275 HydrophobicContact CG-CB 3.65Å; Q54-V275 HydrophobicContact CG-CG1 4.28Å; Q54-V275 HydrophobicContact CG-CG2 4.47Å; Q54-V275 VanDerWaalsContact NE2-CB 3.25Å; Q54-V275 VanDerWaalsContact NE2-N 3.13Å; Q54-L276 HydrophobicContact CB-CB 4.16Å; Q54-L276 HydrophobicContact CG-CB 4.03Å; Q54-K392 HydrophobicContact CG-CD 3.91Å |
| 55 | H | 93.4 | Very high | 88.4 | Confident | 12 Ų | 12 | 25 Ų | 25 | 6% | 0.056 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -63 | -42.2 | 170.6 | -83.5 | -67.8 | 0 | 0 | 0 | 111.6 | L51 A52 L57 V58 M59 V111 N389 K392 V407 | L51-H55 PolarHBondContact O-CD2 3.01Å; L51-H55 VanDerWaalsContact O-CD2 3.3Å; L51-H55 PolarHBondContact O-N 3.34Å; L51-H55 VanDerWaalsContact O-N 3.08Å; A52-H55 WeakPolarHBondContact O-CB 3.46Å; A52-H55 PolarHBondContact O-N 2.9Å; A52-H55 VanDerWaalsContact O-N 3.09Å; H55-L57 VanDerWaalsContact C-N 3.33Å; H55-L57 PolarHBondContact O-N 3.13Å; H55-V58 PolarHBondContact O-N 3.23Å; H55-M59 PolarHBondContact O-N 2.83Å; H55-V111 HydrophobicContact CB-CG2 4.26Å; H55-N389 PolarHBondContact ND1-OD1 3.37Å; H55-N389 PolarHBondContact O-OD1 2.82Å; H55-K392 PolarHBondContact CD2-NZ 2.84Å; H55-K392 WeakPolarHBondContact CE1-CE 3.43Å; H55-K392 PolarHBondContact CE1-NZ 3.04Å; H55-K392 VanDerWaalsContact ND1-CE 3.27Å; H55-K392 WeakPolarHBondContact ND1-CE 3.28Å; H55-K392 PolarHBondContact ND1-NZ 3.49Å; H55-K392 VanDerWaalsContact ND1-NZ 3.13Å; H55-K392 WeakPolarHBondContact NE2-CE 3.46Å; H55-K392 PolarHBondContact NE2-NZ 3.49Å; H55-V407 HydrophobicContact CB-CB 4.47Å; H55-V407 HydrophobicContact CB-CG1 4.17Å; H55-V407 HydrophobicContact CB-CG2 3.41Å; H55-V407 VanDerWaalsContact CB-CG2 3.41Å |
| 56 | V | 93.6 | Very high | 88.1 | Confident | 2 Ų | 2 | 16.6 Ų | 16.6 | 1% | 0.012 | 11% | 0.105 | C | C | . | . | H | α-helix | trans | -62.8 | -39.3 | 177.6 | 172.3 | 0 | 0 | 0 | 0 | 111.4 | A52 L53 Q54 M59 A60 V407 L410 L414 | A52-V56 WeakPolarHBondContact O-CG2 2.96Å; A52-V56 PolarHBondContact O-N 3.08Å; L53-V56 PolarHBondContact O-N 3.06Å; Q54-V56 VanDerWaalsContact C-N 3.34Å; V56-M59 PolarHBondContact O-N 3.29Å; V56-A60 WeakPolarHBondContact O-CB 3.35Å; V56-A60 PolarHBondContact O-N 3.49Å; V56-V407 HydrophobicContact CG2-CG1 4.04Å; V56-L410 HydrophobicContact CB-CD2 4.24Å; V56-L410 HydrophobicContact CG2-CB 4.25Å; V56-L410 HydrophobicContact CG2-CD2 3.73Å; V56-L410 HydrophobicContact CG2-CG 4.09Å; V56-L414 HydrophobicContact CG1-CD1 3.43Å; V56-L414 VanDerWaalsContact CG1-CD1 3.43Å |
| 57 | L | 91.4 | Very high | 87.7 | Confident | 16 Ų | 16 | 14.3 Ų | 14.3 | 8% | 0.084 | 8% | 0.081 | C | C | . | . | H | α-helix | trans | -62.6 | -44.2 | 175 | -72.5 | 171.7 | 0 | 0 | 0 | 112.3 | L53 Q54 H55 A60 S61 L276 V279 L424 I427 | L53-L57 WeakPolarHBondContact O-CG 3.08Å; L53-L57 PolarHBondContact O-N 3.01Å; Q54-L57 PolarHBondContact O-N 3.49Å; H55-L57 VanDerWaalsContact C-N 3.33Å; H55-L57 PolarHBondContact O-N 3.13Å; L57-A60 PolarHBondContact O-N 2.92Å; L57-S61 PolarHBondContact O-N 3.16Å; L57-L276 HydrophobicContact CD1-CD1 3.4Å; L57-V279 HydrophobicContact CD1-CG1 4.22Å; L57-L424 HydrophobicContact CD2-CD2 4.44Å; L57-I427 HydrophobicContact CD2-CD1 3.72Å |
| 58 | V | 91.9 | Very high | 87.1 | Confident | 0 Ų | 0 | 13.9 Ų | 13.9 | 0% | 0 | 8% | 0.079 | C | C | . | . | H | α-helix | trans | -63.8 | -42.7 | 175.4 | 175.7 | 0 | 0 | 0 | 0 | 110.6 | Q54 H55 S61 L62 V275 P388 K392 V435 | Q54-V58 WeakPolarHBondContact O-CG2 3.44Å; Q54-V58 PolarHBondContact O-N 3.09Å; H55-V58 PolarHBondContact O-N 3.23Å; V58-S61 PolarHBondContact O-N 2.88Å; V58-S61 PolarHBondContact O-OG 3.44Å; V58-L62 PolarHBondContact O-N 2.81Å; V58-V275 HydrophobicContact CG2-CG1 4.07Å; V58-P388 HydrophobicContact CG1-CB 3.69Å; V58-K392 HydrophobicContact CG2-CD 4.13Å; V58-V435 HydrophobicContact CG2-CG1 3.86Å |
| 59 | M | 91.2 | Very high | 86.3 | Confident | 1 Ų | 1 | 15.5 Ų | 15.5 | 1% | 0.005 | 9% | 0.087 | C | C | . | . | H | α-helix | trans | -62.3 | -44.9 | 172.9 | -81.2 | -149.3 | -74.1 | 0 | 0 | 113.5 | H55 V56 S61 L62 L63 V111 A113 N389 V407 C411 | H55-M59 PolarHBondContact O-N 2.83Å; V56-M59 PolarHBondContact O-N 3.29Å; M59-S61 PolarHBondContact O-N 2.9Å; M59-L62 PolarHBondContact O-N 3.42Å; M59-L62 VanDerWaalsContact O-N 3.08Å; M59-L63 WeakPolarHBondContact O-CB 3.38Å; M59-L63 PolarHBondContact O-N 3.12Å; M59-V111 HydrophobicContact CE-CG1 3.33Å; M59-V111 HydrophobicContact CG-CG1 3.47Å; M59-V111 VanDerWaalsContact CG-CG1 3.47Å; M59-V111 HydrophobicContact SD-CG1 3.1Å; M59-V111 WeakPolarHBondContact SD-CG1 3.44Å; M59-A113 HydrophobicContact CG-CB 3.9Å; M59-A113 HydrophobicContact SD-CB 3.73Å; M59-N389 WeakPolarHBondContact CG-ND2 3.43Å; M59-V407 HydrophobicContact CE-CG1 3.47Å; M59-V407 VanDerWaalsContact CE-CG1 3.47Å; M59-C411 WeakPolarHBondContact CE-SG 3.47Å |
| 60 | A | 87.1 | Confident | 85.6 | Confident | 1 Ų | 1 | 12.6 Ų | 12.6 | 1% | 0.008 | 7% | 0.067 | C | C | . | . | H | α-helix | trans | -59.9 | -38.5 | -179.5 | 0 | 0 | 0 | 0 | 0 | 110.9 | V56 L57 L62 L63 C64 F91 L424 | V56-A60 WeakPolarHBondContact O-CB 3.35Å; V56-A60 PolarHBondContact O-N 3.49Å; L57-A60 PolarHBondContact O-N 2.92Å; A60-L62 PolarHBondContact O-N 3.5Å; A60-L63 PolarHBondContact O-N 3.47Å; A60-C64 WeakPolarHBondContact O-CB 3.27Å; A60-C64 PolarHBondContact O-N 3.19Å; A60-C64 PolarHBondContact O-SG 3.47Å; A60-F91 HydrophobicContact CB-CE1 4.14Å; A60-F91 HydrophobicContact CB-CZ 3.75Å; A60-L424 HydrophobicContact CB-CB 4.39Å; A60-L424 HydrophobicContact CB-CD1 4.07Å |
| 61 | S | 83.3 | Confident | 84.6 | Confident | 5 Ų | 5 | 10.2 Ų | 10.2 | 4% | 0.035 | 6% | 0.055 | C | C | . | . | H | α-helix | trans | -58.5 | -47.1 | 173.2 | 65.2 | 0 | 0 | 0 | 0 | 112.2 | L57 V58 M59 L63 V65 V432 | L57-S61 PolarHBondContact O-N 3.16Å; V58-S61 PolarHBondContact O-N 2.88Å; V58-S61 PolarHBondContact O-OG 3.44Å; M59-S61 PolarHBondContact O-N 2.9Å; S61-L63 PolarHBondContact O-N 2.94Å; S61-V65 WeakPolarHBondContact O-CB 3.43Å; S61-V65 WeakPolarHBondContact O-CG2 3.34Å; S61-V65 PolarHBondContact O-N 3.35Å; S61-V432 VanDerWaalsContact CB-CG1 3.47Å |
| 62 | L | 82.5 | Confident | 83.5 | Confident | 11 Ų | 11 | 14.3 Ų | 14.3 | 6% | 0.058 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -66.9 | -38.5 | -179.8 | -167.6 | 61.6 | 0 | 0 | 0 | 112.4 | V58 M59 A60 V65 S66 A113 P114 L436 | V58-L62 PolarHBondContact O-N 2.81Å; M59-L62 PolarHBondContact O-N 3.42Å; M59-L62 VanDerWaalsContact O-N 3.08Å; A60-L62 PolarHBondContact O-N 3.5Å; L62-V65 PolarHBondContact O-N 3Å; L62-S66 WeakPolarHBondContact O-CB 3.29Å; L62-S66 PolarHBondContact O-N 3.1Å; L62-S66 PolarHBondContact O-OG 3.31Å; L62-S66 VanDerWaalsContact O-OG 3.14Å; L62-A113 HydrophobicContact CD2-CB 4.17Å; L62-P114 WeakPolarHBondContact CD2-O 3.08Å; L62-P114 WeakPolarHBondContact CG-O 3.29Å; L62-L436 HydrophobicContact CD1-CD2 4.38Å |
| 63 | L | 84.3 | Confident | 82 | Confident | 0 Ų | 0 | 16.5 Ų | 16.5 | 0% | 0 | 10% | 0.098 | C | C | . | . | H | α-helix | trans | -72.3 | -41.6 | -178.9 | -158.3 | 146.9 | 0 | 0 | 0 | 111.5 | M59 A60 S61 V65 S66 H67 L87 F91 P114 | M59-L63 WeakPolarHBondContact O-CB 3.38Å; M59-L63 PolarHBondContact O-N 3.12Å; A60-L63 PolarHBondContact O-N 3.47Å; S61-L63 PolarHBondContact O-N 2.94Å; L63-V65 VanDerWaalsContact C-N 3.34Å; L63-S66 PolarHBondContact O-OG 3.31Å; L63-S66 VanDerWaalsContact O-OG 3.12Å; L63-H67 WeakPolarHBondContact O-CB 3.4Å; L63-H67 PolarHBondContact O-CD2 3.44Å; L63-H67 VanDerWaalsContact O-CD2 3.24Å; L63-H67 PolarHBondContact O-N 3.04Å; L63-L87 HydrophobicContact CD2-CB 4.45Å; L63-L87 HydrophobicContact CD2-CD1 3.17Å; L63-L87 HydrophobicContact CD2-CG 3.52Å; L63-F91 HydrophobicContact CD1-CD1 4.04Å; L63-F91 HydrophobicContact CD1-CE1 4.12Å; L63-F91 HydrophobicContact CD1-CG 4.28Å; L63-F91 HydrophobicContact CD1-CZ 4.44Å; L63-F91 HydrophobicContact CD2-CD2 4.27Å; L63-F91 HydrophobicContact CD2-CE2 4.03Å; L63-F91 HydrophobicContact CD2-CZ 4.27Å; L63-P114 HydrophobicContact CB-CG 3.77Å; L63-P114 HydrophobicContact CD1-CG 3.87Å; L63-P114 HydrophobicContact CG-CG 3.71Å |
| 64 | C | 77.3 | Confident | 80.7 | Confident | 10 Ų | 10 | 13.9 Ų | 13.9 | 7% | 0.068 | 9% | 0.085 | C | C | . | . | H | α-helix | trans | -62.6 | -43.4 | 171.9 | -67.7 | 0 | 0 | 0 | 0 | 110.8 | A60 L68 | A60-C64 WeakPolarHBondContact O-CB 3.27Å; A60-C64 PolarHBondContact O-N 3.19Å; A60-C64 PolarHBondContact O-SG 3.47Å; C64-L68 WeakPolarHBondContact O-CB 3.47Å; C64-L68 WeakPolarHBondContact O-CD1 3.29Å; C64-L68 WeakPolarHBondContact O-CG 3.44Å; C64-L68 PolarHBondContact O-N 3.01Å |
| 65 | V | 75.6 | Confident | 78.7 | Confident | 3 Ų | 3 | 16.6 Ų | 16.6 | 2% | 0.018 | 10% | 0.103 | C | C | . | . | H | α-helix | trans | -61.8 | -48.9 | 178.1 | 161.2 | 0 | 0 | 0 | 0 | 111.9 | S61 L62 L63 L68 L69 F223 V432 L436 | S61-V65 WeakPolarHBondContact O-CB 3.43Å; S61-V65 WeakPolarHBondContact O-CG2 3.34Å; S61-V65 PolarHBondContact O-N 3.35Å; L62-V65 PolarHBondContact O-N 3Å; L63-V65 VanDerWaalsContact C-N 3.34Å; V65-L68 PolarHBondContact O-N 3.17Å; V65-L69 HydrophobicContact CG1-CD1 3.81Å; V65-L69 HydrophobicContact CG1-CG 4.45Å; V65-L69 WeakPolarHBondContact O-CB 3.27Å; V65-L69 VanDerWaalsContact O-CG 3.27Å; V65-L69 WeakPolarHBondContact O-CG 3.37Å; V65-L69 PolarHBondContact O-N 2.92Å; V65-F223 HydrophobicContact CB-CE2 3.93Å; V65-F223 HydrophobicContact CB-CZ 3.95Å; V65-F223 HydrophobicContact CG1-CE2 3.4Å; V65-F223 HydrophobicContact CG1-CZ 3.54Å; V65-F223 HydrophobicContact CG2-CD2 3.8Å; V65-F223 HydrophobicContact CG2-CE1 4.12Å; V65-F223 HydrophobicContact CG2-CE2 3.28Å; V65-F223 HydrophobicContact CG2-CG 4.45Å; V65-F223 HydrophobicContact CG2-CZ 3.49Å; V65-F223 VanDerWaalsContact CG2-CZ 3.49Å; V65-V432 HydrophobicContact CG2-CG1 3.57Å; V65-L436 HydrophobicContact CG2-CD1 4Å |
| 66 | S | 77.6 | Confident | 76.4 | Confident | 1 Ų | 1 | 22.2 Ų | 22.2 | 1% | 0.007 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -66.6 | -42.8 | -177.3 | 61.1 | 0 | 0 | 0 | 0 | 112 | L62 L63 L70 | L62-S66 WeakPolarHBondContact O-CB 3.29Å; L62-S66 PolarHBondContact O-N 3.1Å; L62-S66 PolarHBondContact O-OG 3.31Å; L62-S66 VanDerWaalsContact O-OG 3.14Å; L63-S66 PolarHBondContact O-OG 3.31Å; L63-S66 VanDerWaalsContact O-OG 3.12Å; S66-L70 VanDerWaalsContact O-CB 3.29Å; S66-L70 WeakPolarHBondContact O-CB 3.49Å; S66-L70 PolarHBondContact O-N 3.36Å |
| 67 | H | 79.7 | Confident | 74.3 | Confident | 3 Ų | 3 | 24.2 Ų | 24.2 | 1% | 0.014 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -65.8 | -42.8 | 173.8 | -82.8 | -96.2 | 0 | 0 | 0 | 111.8 | L63 L70 L71 L87 S90 | L63-H67 WeakPolarHBondContact O-CB 3.4Å; L63-H67 PolarHBondContact O-CD2 3.44Å; L63-H67 VanDerWaalsContact O-CD2 3.24Å; L63-H67 PolarHBondContact O-N 3.04Å; H67-L70 PolarHBondContact O-N 3.4Å; H67-L71 WeakPolarHBondContact O-CB 3.39Å; H67-L71 WeakPolarHBondContact O-CD1 3.43Å; H67-L71 WeakPolarHBondContact O-CG 3.48Å; H67-L71 PolarHBondContact O-N 3.39Å; H67-L87 HydrophobicContact CB-CD1 4.34Å; H67-S90 PolarHBondContact CE1-OG 3Å; H67-S90 PolarHBondContact NE2-OG 3.42Å |
| 68 | L | 73.9 | Confident | 72.5 | Confident | 15 Ų | 15 | 26.7 Ų | 26.7 | 8% | 0.079 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -58.6 | -50.4 | 175.4 | -85.3 | 168.5 | 0 | 0 | 0 | 112.3 | C64 V65 L70 L71 C72 P295 L298 | C64-L68 WeakPolarHBondContact O-CB 3.47Å; C64-L68 WeakPolarHBondContact O-CD1 3.29Å; C64-L68 WeakPolarHBondContact O-CG 3.44Å; C64-L68 PolarHBondContact O-N 3.01Å; V65-L68 PolarHBondContact O-N 3.17Å; L68-L70 VanDerWaalsContact C-N 3.33Å; L68-L70 PolarHBondContact O-N 3.39Å; L68-L71 PolarHBondContact O-N 3.38Å; L68-C72 VanDerWaalsContact O-CB 3.3Å; L68-C72 WeakPolarHBondContact O-CB 3.39Å; L68-C72 PolarHBondContact O-N 3.34Å; L68-C72 PolarHBondContact O-SG 3.21Å; L68-P295 HydrophobicContact CD1-CB 4.31Å; L68-P295 HydrophobicContact CD1-CG 4.24Å; L68-P295 HydrophobicContact CD2-CB 3.65Å; L68-P295 HydrophobicContact CD2-CG 4.26Å; L68-L298 HydrophobicContact CD1-CD1 4.29Å; L68-L298 HydrophobicContact CD2-CD1 3.1Å; L68-L298 HydrophobicContact CG-CD1 3.43Å; L68-L298 VanDerWaalsContact CG-CD1 3.43Å |
| 69 | L | 73.8 | Confident | 71 | Confident | 34 Ų | 34 | 28.8 Ų | 28.8 | 18% | 0.178 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -65.3 | -39.2 | -178.1 | -71.3 | 174.5 | 0 | 0 | 0 | 111.5 | V65 S73 L119 E219 F223 | V65-L69 HydrophobicContact CG1-CD1 3.81Å; V65-L69 HydrophobicContact CG1-CG 4.45Å; V65-L69 WeakPolarHBondContact O-CB 3.27Å; V65-L69 VanDerWaalsContact O-CG 3.27Å; V65-L69 WeakPolarHBondContact O-CG 3.37Å; V65-L69 PolarHBondContact O-N 2.92Å; L69-S73 PolarHBondContact O-N 2.98Å; L69-L119 HydrophobicContact CB-CD1 4.45Å; L69-L119 HydrophobicContact CB-CD2 3.9Å; L69-L119 HydrophobicContact CD1-CD2 3.76Å; L69-L119 HydrophobicContact CG-CD2 4.5Å; L69-E219 HydrophobicContact CD1-CG 4.3Å; L69-F223 HydrophobicContact CD1-CZ 4.34Å; L69-F223 HydrophobicContact CD2-CZ 4.43Å; L69-F223 HydrophobicContact CG-CZ 4.31Å |
| 70 | L | 76.3 | Confident | 69.4 | Low | 3 Ų | 3 | 32.5 Ų | 32.5 | 2% | 0.016 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -65.2 | -48.2 | 173.5 | -174.9 | 72.2 | 0 | 0 | 0 | 111.2 | S66 H67 L68 C72 S73 L74 L119 A122 L123 L170 P380 | S66-L70 VanDerWaalsContact O-CB 3.29Å; S66-L70 WeakPolarHBondContact O-CB 3.49Å; S66-L70 PolarHBondContact O-N 3.36Å; H67-L70 PolarHBondContact O-N 3.4Å; L68-L70 VanDerWaalsContact C-N 3.33Å; L68-L70 PolarHBondContact O-N 3.39Å; L70-C72 PolarHBondContact O-N 3.16Å; L70-S73 WeakPolarHBondContact O-CB 3.19Å; L70-S73 PolarHBondContact O-N 3.13Å; L70-S73 VanDerWaalsContact O-N 3.11Å; L70-S73 PolarHBondContact O-OG 2.96Å; L70-L74 WeakPolarHBondContact O-CG 3.32Å; L70-L74 PolarHBondContact O-N 3.13Å; L70-L119 HydrophobicContact CB-CD1 3.94Å; L70-L119 HydrophobicContact CD1-CD1 4.41Å; L70-A122 HydrophobicContact CD1-CB 4.21Å; L70-L123 HydrophobicContact CD1-CD2 4.44Å; L70-L170 HydrophobicContact CD2-CD2 4.16Å; L70-P380 HydrophobicContact CD2-CB 3.31Å; L70-P380 HydrophobicContact CD2-CG 3.43Å; L70-P380 VanDerWaalsContact CD2-CG 3.43Å |
| 71 | L | 72.4 | Confident | 68.5 | Low | 21 Ų | 21 | 33.1 Ų | 33.1 | 11% | 0.11 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -63.6 | -41.7 | -179.6 | -71.5 | 170.4 | 0 | 0 | 0 | 111.9 | H67 L68 S73 L74 L79 P83 | H67-L71 WeakPolarHBondContact O-CB 3.39Å; H67-L71 WeakPolarHBondContact O-CD1 3.43Å; H67-L71 WeakPolarHBondContact O-CG 3.48Å; H67-L71 PolarHBondContact O-N 3.39Å; L68-L71 PolarHBondContact O-N 3.38Å; L71-S73 PolarHBondContact O-N 2.64Å; L71-L74 CarbonylContact O-C 3.34Å; L71-L74 WeakPolarHBondContact O-CA 3.33Å; L71-L74 WeakPolarHBondContact O-CB 3.32Å; L71-L74 PolarHBondContact O-N 2.94Å; L71-L79 HydrophobicContact CD2-CD1 3.37Å; L71-P83 HydrophobicContact CD1-CB 4.23Å |
| 72 | C | 67.6 | Low | 68.1 | Low | 92 Ų | 92 | 34.1 Ų | 34.1 | 62% | 0.622 | 24% | 0.238 | S | C | * | . | H | α-helix | trans | -63.7 | -25.4 | 174.5 | -72.6 | 0 | 0 | 0 | 0 | 113.1 | L68 L70 L74 | L68-C72 VanDerWaalsContact O-CB 3.3Å; L68-C72 WeakPolarHBondContact O-CB 3.39Å; L68-C72 PolarHBondContact O-N 3.34Å; L68-C72 PolarHBondContact O-SG 3.21Å; L70-C72 PolarHBondContact O-N 3.16Å; C72-L74 VanDerWaalsContact C-N 3.28Å |
| 73 | S | 64.1 | Low | 67.9 | Low | 49 Ų | 49 | 34.6 Ų | 34.6 | 34% | 0.343 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -78.2 | -15.8 | 174 | 79.1 | 0 | 0 | 0 | 0 | 113 | L69 L70 L71 L123 | L69-S73 PolarHBondContact O-N 2.98Å; L70-S73 WeakPolarHBondContact O-CB 3.19Å; L70-S73 PolarHBondContact O-N 3.13Å; L70-S73 VanDerWaalsContact O-N 3.11Å; L70-S73 PolarHBondContact O-OG 2.96Å; L71-S73 PolarHBondContact O-N 2.64Å; S73-L123 VanDerWaalsContact CB-CD2 3.45Å; S73-L123 VanDerWaalsContact OG-CD2 3.23Å; S73-L123 WeakPolarHBondContact OG-CD2 3.47Å |
| 74 | L | 65 | Low | 67.7 | Low | 13 Ų | 13 | 35 Ų | 35 | 7% | 0.068 | 25% | 0.245 | C | C | . | . | S | Bend | trans | -93.5 | 128.7 | 174.1 | -58.8 | 169.8 | 0 | 0 | 0 | 108 | L70 L71 C72 W166 L170 | L70-L74 WeakPolarHBondContact O-CG 3.32Å; L70-L74 PolarHBondContact O-N 3.13Å; L71-L74 CarbonylContact O-C 3.34Å; L71-L74 WeakPolarHBondContact O-CA 3.33Å; L71-L74 WeakPolarHBondContact O-CB 3.32Å; L71-L74 PolarHBondContact O-N 2.94Å; C72-L74 VanDerWaalsContact C-N 3.28Å; L74-W166 HydrophobicContact CD2-CE3 3.84Å; L74-W166 HydrophobicContact CD2-CZ3 4.16Å; L74-L170 HydrophobicContact CD1-CD1 4.29Å; L74-L170 HydrophobicContact CD1-CD2 4.08Å; L74-L170 HydrophobicContact CD1-CG 4.15Å |
| 75 | S | 51.8 | Low | 68.2 | Low | 56 Ų | 56 | 36.3 Ų | 36.3 | 39% | 0.392 | 25% | 0.249 | S | C | . | . | trans | -62.1 | 149.8 | -177.5 | 62.4 | 0 | 0 | 0 | 0 | 112 | G77 W166 | S75-G77 PolarHBondContact O-N 3.3Å; S75-W166 VanDerWaalsContact OG-CZ2 3.29Å; S75-W166 WeakPolarHBondContact OG-CZ2 3.42Å | ||
| 76 | P | 45.3 | Very low | 68.6 | Low | 131 Ų | 131 | 36.4 Ų | 36.4 | 85% | 0.851 | 25% | 0.25 | S | S | * | . | S | Bend | trans | -64.8 | 94.4 | 179.1 | 25.6 | -33 | 0 | 0 | 0 | 110.8 | ||
| 77 | G | 49.4 | Very low | 69.1 | Low | 44 Ų | 44 | 36.4 Ų | 36.4 | 45% | 0.454 | 25% | 0.25 | S | C | . | . | S | Bend | trans | -148.2 | 130.6 | 171.9 | 0 | 0 | 0 | 0 | 0 | 106.1 | S75 L79 | S75-G77 PolarHBondContact O-N 3.3Å; G77-L79 PolarHBondContact O-N 3.06Å |
| 78 | G | 53.1 | Low | 69.6 | Low | 68 Ų | 68 | 36.2 Ų | 36.2 | 70% | 0.701 | 25% | 0.249 | S | C | * | . | trans | -52.3 | 104 | -169.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | S80 | G78-S80 PolarHBondContact O-N 3.11Š| ||
| 79 | L | 59.1 | Low | 70.4 | Confident | 44 Ų | 44 | 35.5 Ų | 35.5 | 23% | 0.23 | 25% | 0.245 | C | C | . | . | trans | -52.9 | 139 | 164.1 | -72.4 | 169 | 0 | 0 | 0 | 107.1 | L71 G77 Y81 L170 | L71-L79 HydrophobicContact CD2-CD1 3.37Å; G77-L79 PolarHBondContact O-N 3.06Å; L79-Y81 HydrophobicContact CB-CD2 4.36Å; L79-Y81 HydrophobicContact CD2-CD2 4.28Å; L79-Y81 PolarHBondContact O-N 3.41Å; L79-L170 HydrophobicContact CD2-CD1 3.5Å | ||
| 80 | S | 58.3 | Low | 71.3 | Confident | 78 Ų | 78 | 34 Ų | 34 | 55% | 0.545 | 24% | 0.237 | S | C | . | . | S | Bend | trans | -66.5 | -2.1 | 169.7 | 51.4 | 0 | 0 | 0 | 0 | 112.7 | G78 N167 | G78-S80 PolarHBondContact O-N 3.11Å; S80-N167 PolarHBondContact OG-ND2 3.42Å; S80-N167 PolarHBondContact OG-OD1 3.26Å |
| 81 | Y | 68 | Low | 72.1 | Confident | 14 Ų | 14 | 33.9 Ų | 33.9 | 6% | 0.055 | 24% | 0.237 | C | C | . | . | S | Bend | trans | -112.3 | 136.1 | -171.8 | -41.9 | -52.2 | 0 | 0 | 0 | 109.8 | L79 L86 N167 L170 W315 | L79-Y81 HydrophobicContact CB-CD2 4.36Å; L79-Y81 HydrophobicContact CD2-CD2 4.28Å; L79-Y81 PolarHBondContact O-N 3.41Å; Y81-L86 HydrophobicContact CD2-CD1 4.4Å; Y81-L86 HydrophobicContact CG-CD1 4.46Å; Y81-N167 WeakPolarHBondContact CE2-OD1 3.47Å; Y81-L170 HydrophobicContact CD2-CD1 3.81Å; Y81-L170 HydrophobicContact CE2-CB 4.5Å; Y81-L170 HydrophobicContact CE2-CD1 3.75Å; Y81-W315 HydrophobicContact CD1-CB 3.89Å; Y81-W315 AromaticContact CD1-CD1 3.09Å; Y81-W315 HydrophobicContact CD1-CD2 4.46Å; Y81-W315 AromaticContact CD1-CG 3.53Å; Y81-W315 HydrophobicContact CD1-CG 3.53Å; Y81-W315 AromaticContact CD1-NE1 3.73Å; Y81-W315 HydrophobicContact CE1-CB 3.39Å; Y81-W315 AromaticContact CE1-CD1 3.38Å; Y81-W315 AromaticContact CE1-CG 3.58Å; Y81-W315 HydrophobicContact CE1-CG 3.58Å; Y81-W315 HydrophobicContact CG-CG 4.45Å; Y81-W315 PolarHBondContact OH-O 3.24Å; Y81-W315 VanDerWaalsContact OH-O 3.13Å |
| 82 | S | 75.2 | Confident | 73.2 | Confident | 26 Ų | 26 | 34.2 Ų | 34.2 | 18% | 0.182 | 24% | 0.237 | C | C | . | . | trans | -74.8 | 129.2 | 168 | 72.6 | 0 | 0 | 0 | 0 | 109.3 | S84 Q85 L86 | S82-S84 PolarHBondContact O-N 3.07Å; S82-S84 VanDerWaalsContact O-N 3.11Å; S82-S84 PolarHBondContact OG-OG 3.44Å; S82-Q85 PolarHBondContact O-N 2.78Å; S82-Q85 VanDerWaalsContact OG-CB 3.31Å; S82-Q85 WeakPolarHBondContact OG-CB 3.38Å; S82-Q85 WeakPolarHBondContact OG-CG 3.19Å; S82-Q85 PolarHBondContact OG-N 3.09Å; S82-Q85 PolarHBondContact OG-OE1 3.21Å; S82-L86 PolarHBondContact O-N 2.81Å | ||
| 83 | P | 77.6 | Confident | 74.5 | Confident | 22 Ų | 22 | 29.9 Ų | 29.9 | 14% | 0.143 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -53.5 | -33.6 | 176.8 | -28.6 | 35.5 | 0 | 0 | 0 | 112.8 | L71 L86 L87 L298 | L71-P83 HydrophobicContact CD1-CB 4.23Å; P83-L86 PolarHBondContact O-N 3.46Å; P83-L87 WeakPolarHBondContact O-CB 3.32Å; P83-L87 PolarHBondContact O-N 3.33Å; P83-L298 HydrophobicContact CB-CD2 4.22Å; P83-L298 HydrophobicContact CB-CG 4.17Å |
| 84 | S | 81.6 | Confident | 76 | Confident | 9 Ų | 9 | 27.7 Ų | 27.7 | 6% | 0.063 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -64.2 | -36.5 | 176.1 | 50.2 | 0 | 0 | 0 | 0 | 114.1 | S82 A88 | S82-S84 PolarHBondContact O-N 3.07Å; S82-S84 VanDerWaalsContact O-N 3.11Å; S82-S84 PolarHBondContact OG-OG 3.44Å; S84-A88 VanDerWaalsContact O-CB 3.32Å; S84-A88 WeakPolarHBondContact O-CB 3.3Å; S84-A88 PolarHBondContact O-N 2.82Å |
| 85 | Q | 86.8 | Confident | 77.5 | Confident | 36 Ų | 36 | 27 Ų | 27 | 17% | 0.168 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -75.5 | -37 | 177.4 | -75 | 167.2 | -46.8 | 0 | 0 | 111.7 | S82 L87 A88 S89 W308 W315 P418 | S82-Q85 PolarHBondContact O-N 2.78Å; S82-Q85 VanDerWaalsContact OG-CB 3.31Å; S82-Q85 WeakPolarHBondContact OG-CB 3.38Å; S82-Q85 WeakPolarHBondContact OG-CG 3.19Å; S82-Q85 PolarHBondContact OG-N 3.09Å; S82-Q85 PolarHBondContact OG-OE1 3.21Å; Q85-L87 VanDerWaalsContact C-N 3.31Å; Q85-A88 PolarHBondContact O-N 3.13Å; Q85-S89 PolarHBondContact O-N 3.08Å; Q85-W308 HydrophobicContact CB-CH2 4.4Å; Q85-W308 HydrophobicContact CB-CZ2 4.41Å; Q85-W308 HydrophobicContact CG-CD2 4.36Å; Q85-W315 HydrophobicContact CB-CH2 3.93Å; Q85-W315 HydrophobicContact CB-CZ2 3.59Å; Q85-W315 HydrophobicContact CG-CZ2 4.41Å; Q85-P418 HydrophobicContact CG-CB 4.06Å; Q85-P418 HydrophobicContact CG-CG 3.84Å |
| 86 | L | 84.8 | Confident | 79.6 | Confident | 6 Ų | 6 | 25.9 Ų | 25.9 | 3% | 0.031 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -62.4 | -40.7 | 172.1 | -71.1 | 173.4 | 0 | 0 | 0 | 111.3 | Y81 S82 P83 A88 S89 S90 | Y81-L86 HydrophobicContact CD2-CD1 4.4Å; Y81-L86 HydrophobicContact CG-CD1 4.46Å; S82-L86 PolarHBondContact O-N 2.81Å; P83-L86 PolarHBondContact O-N 3.46Å; L86-A88 VanDerWaalsContact C-N 3.35Å; L86-S89 PolarHBondContact O-N 3.25Å; L86-S89 PolarHBondContact O-OG 3.07Å; L86-S90 PolarHBondContact O-N 3.23Å; L86-S90 VanDerWaalsContact O-N 3.15Å; L86-S90 PolarHBondContact O-OG 3.35Å |
| 87 | L | 87.4 | Confident | 82 | Confident | 0 Ų | 0 | 19.6 Ų | 19.6 | 0% | 0 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -61.3 | -45.3 | 173.7 | -157.1 | 82.3 | 0 | 0 | 0 | 111.1 | L63 H67 P83 Q85 S90 F91 L298 A421 T425 | L63-L87 HydrophobicContact CD2-CB 4.45Å; L63-L87 HydrophobicContact CD2-CD1 3.17Å; L63-L87 HydrophobicContact CD2-CG 3.52Å; H67-L87 HydrophobicContact CB-CD1 4.34Å; P83-L87 WeakPolarHBondContact O-CB 3.32Å; P83-L87 PolarHBondContact O-N 3.33Å; Q85-L87 VanDerWaalsContact C-N 3.31Å; L87-S90 PolarHBondContact O-N 3.47Å; L87-F91 HydrophobicContact CD2-CE2 3.91Å; L87-F91 HydrophobicContact CG-CD2 4.2Å; L87-F91 HydrophobicContact CG-CE2 3.84Å; L87-F91 VanDerWaalsContact O-CD2 3.22Å; L87-F91 WeakPolarHBondContact O-CD2 3.27Å; L87-F91 PolarHBondContact O-N 2.84Å; L87-L298 HydrophobicContact CD1-CD2 4.31Å; L87-A421 HydrophobicContact CB-CB 4.46Å; L87-A421 HydrophobicContact CD2-CB 4.08Å; L87-A421 VanDerWaalsContact CD2-O 3.3Å; L87-A421 WeakPolarHBondContact CD2-O 3.46Å; L87-T425 HydrophobicContact CD2-CG2 3.47Å; L87-T425 VanDerWaalsContact CD2-CG2 3.47Å |
| 88 | A | 90.7 | Very high | 84.2 | Confident | 0 Ų | 0 | 17.5 Ų | 17.5 | 0% | 0 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -64.5 | -42.1 | 179.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | S84 Q85 L86 S90 F91 F92 W308 G415 P418 A421 | S84-A88 VanDerWaalsContact O-CB 3.32Å; S84-A88 WeakPolarHBondContact O-CB 3.3Å; S84-A88 PolarHBondContact O-N 2.82Å; Q85-A88 PolarHBondContact O-N 3.13Å; L86-A88 VanDerWaalsContact C-N 3.35Å; A88-S90 VanDerWaalsContact C-N 3.33Å; A88-S90 PolarHBondContact O-N 3.39Å; A88-F91 PolarHBondContact O-N 3.22Å; A88-F92 PolarHBondContact O-N 3.46Å; A88-W308 HydrophobicContact CB-CE3 4.29Å; A88-W308 HydrophobicContact CB-CZ3 3.96Å; A88-G415 WeakPolarHBondContact CB-O 3.26Å; A88-G415 WeakPolarHBondContact O-CA 3.47Å; A88-P418 HydrophobicContact CB-CB 4.34Å; A88-P418 HydrophobicContact CB-CG 4.08Å; A88-A421 HydrophobicContact CB-CB 4.01Å |
| 89 | S | 91.3 | Very high | 86.2 | Confident | 0 Ų | 0 | 16.4 Ų | 16.4 | 0% | 0 | 10% | 0.095 | C | C | . | . | H | α-helix | trans | -63 | -39.3 | 176.6 | 72.2 | 0 | 0 | 0 | 0 | 112 | Q85 L86 F92 S93 | Q85-S89 PolarHBondContact O-N 3.08Å; L86-S89 PolarHBondContact O-N 3.25Å; L86-S89 PolarHBondContact O-OG 3.07Å; S89-F92 PolarHBondContact O-N 3.25Å; S89-S93 PolarHBondContact O-N 3.36Å; S89-S93 PolarHBondContact O-OG 3.26Å |
| 90 | S | 92.1 | Very high | 87.9 | Confident | 1 Ų | 1 | 16 Ų | 16 | 1% | 0.007 | 9% | 0.093 | C | C | . | . | H | α-helix | trans | -65.3 | -40.9 | 172.6 | -60.5 | 0 | 0 | 0 | 0 | 112.6 | H67 L86 L87 A88 F92 S93 C94 S379 | H67-S90 PolarHBondContact CE1-OG 3Å; H67-S90 PolarHBondContact NE2-OG 3.42Å; L86-S90 PolarHBondContact O-N 3.23Å; L86-S90 VanDerWaalsContact O-N 3.15Å; L86-S90 PolarHBondContact O-OG 3.35Å; L87-S90 PolarHBondContact O-N 3.47Å; A88-S90 VanDerWaalsContact C-N 3.33Å; A88-S90 PolarHBondContact O-N 3.39Å; S90-F92 VanDerWaalsContact C-N 3.32Å; S90-F92 PolarHBondContact O-N 2.88Å; S90-S93 PolarHBondContact O-N 3.36Å; S90-S93 PolarHBondContact O-OG 3.22Å; S90-S93 VanDerWaalsContact O-OG 3.05Å; S90-C94 VanDerWaalsContact O-CB 3.28Å; S90-C94 WeakPolarHBondContact O-CB 3.42Å; S90-C94 PolarHBondContact O-N 2.9Å; S90-C94 PolarHBondContact O-SG 2.92Å; S90-S379 PolarHBondContact OG-OG 3.47Å |
| 91 | F | 93.5 | Very high | 89.6 | Confident | 1 Ų | 1 | 12.3 Ų | 12.3 | 0% | 0.004 | 7% | 0.067 | C | C | . | . | H | α-helix | trans | -61.9 | -41.5 | 174.1 | -84.5 | -61.8 | 0 | 0 | 0 | 111.9 | A60 L63 L87 A88 C94 G95 C411 L414 A421 L424 | A60-F91 HydrophobicContact CB-CE1 4.14Å; A60-F91 HydrophobicContact CB-CZ 3.75Å; L63-F91 HydrophobicContact CD1-CD1 4.04Å; L63-F91 HydrophobicContact CD1-CE1 4.12Å; L63-F91 HydrophobicContact CD1-CG 4.28Å; L63-F91 HydrophobicContact CD1-CZ 4.44Å; L63-F91 HydrophobicContact CD2-CD2 4.27Å; L63-F91 HydrophobicContact CD2-CE2 4.03Å; L63-F91 HydrophobicContact CD2-CZ 4.27Å; L87-F91 HydrophobicContact CD2-CE2 3.91Å; L87-F91 HydrophobicContact CG-CD2 4.2Å; L87-F91 HydrophobicContact CG-CE2 3.84Å; L87-F91 VanDerWaalsContact O-CD2 3.22Å; L87-F91 WeakPolarHBondContact O-CD2 3.27Å; L87-F91 PolarHBondContact O-N 2.84Å; A88-F91 PolarHBondContact O-N 3.22Å; F91-C94 PolarHBondContact O-N 2.96Å; F91-G95 PolarHBondContact O-N 2.72Å; F91-C411 CarbonylContact C-O 3.54Å; F91-L414 HydrophobicContact CB-CB 4.45Å; F91-L414 HydrophobicContact CG-CB 4.44Å; F91-A421 HydrophobicContact CD2-CB 4.13Å; F91-A421 HydrophobicContact CE2-CB 4.34Å; F91-L424 HydrophobicContact CE1-CD1 4.28Å; F91-L424 HydrophobicContact CE2-CD1 3.95Å; F91-L424 HydrophobicContact CZ-CD1 3.61Å |
| 92 | F | 94.7 | Very high | 90.7 | Very high | 29 Ų | 29 | 11.7 Ų | 11.7 | 13% | 0.127 | 6% | 0.064 | C | C | . | . | H | α-helix | trans | -62 | -50.4 | 178.2 | -171.4 | -96.1 | 0 | 0 | 0 | 111.4 | A88 S89 S90 C94 G95 V96 P310 L377 M412 L416 | A88-F92 PolarHBondContact O-N 3.46Å; S89-F92 PolarHBondContact O-N 3.25Å; S90-F92 VanDerWaalsContact C-N 3.32Å; S90-F92 PolarHBondContact O-N 2.88Å; F92-C94 PolarHBondContact O-N 3.2Å; F92-G95 PolarHBondContact O-N 3.42Å; F92-V96 HydrophobicContact CD1-CG2 4.29Å; F92-V96 HydrophobicContact CE1-CG2 3.98Å; F92-V96 HydrophobicContact CZ-CG2 4.3Å; F92-V96 WeakPolarHBondContact O-CG2 3.2Å; F92-V96 PolarHBondContact O-N 3.32Å; F92-P310 HydrophobicContact CB-CG 3.76Å; F92-P310 HydrophobicContact CD1-CG 3.64Å; F92-P310 HydrophobicContact CD2-CG 3.91Å; F92-P310 HydrophobicContact CE1-CG 4.17Å; F92-P310 HydrophobicContact CE2-CG 4.42Å; F92-P310 HydrophobicContact CG-CG 3.48Å; F92-P310 VanDerWaalsContact CG-CG 3.48Å; F92-L377 HydrophobicContact CD1-CD1 3.76Å; F92-L377 HydrophobicContact CE1-CD1 4.41Å; F92-M412 HydrophobicContact CD2-CB 4.43Å; F92-M412 HydrophobicContact CE2-CE 4.11Å; F92-M412 HydrophobicContact CZ-CE 4.26Å; F92-L416 HydrophobicContact CD2-CD2 4.2Å; F92-L416 HydrophobicContact CD2-CG 4.31Å; F92-L416 HydrophobicContact CE2-CD2 3.91Å; F92-L416 HydrophobicContact CE2-CG 4.24Å |
| 93 | S | 94.9 | Very high | 91.2 | Very high | 1 Ų | 1 | 15.9 Ų | 15.9 | 1% | 0.007 | 8% | 0.076 | C | C | . | . | H | α-helix | trans | -64.3 | -40 | 179.2 | 65.1 | 0 | 0 | 0 | 0 | 112.4 | S89 S90 G95 V96 S97 A374 | S89-S93 PolarHBondContact O-N 3.36Å; S89-S93 PolarHBondContact O-OG 3.26Å; S90-S93 PolarHBondContact O-N 3.36Å; S90-S93 PolarHBondContact O-OG 3.22Å; S90-S93 VanDerWaalsContact O-OG 3.05Å; S93-G95 VanDerWaalsContact C-N 3.33Å; S93-G95 PolarHBondContact O-N 3.19Å; S93-V96 PolarHBondContact O-N 3.37Å; S93-S97 WeakPolarHBondContact O-CB 3.37Å; S93-S97 PolarHBondContact O-N 3.4Å; S93-A374 WeakPolarHBondContact OG-CB 3.25Å |
| 94 | C | 95.1 | Very high | 91.7 | Very high | 2 Ų | 2 | 17.3 Ų | 17.3 | 1% | 0.014 | 8% | 0.082 | C | C | . | . | H | α-helix | trans | -62.7 | -38.9 | 173.8 | -69.5 | 0 | 0 | 0 | 0 | 112.2 | S90 F91 F92 T98 Q112 P114 | S90-C94 VanDerWaalsContact O-CB 3.28Å; S90-C94 WeakPolarHBondContact O-CB 3.42Å; S90-C94 PolarHBondContact O-N 2.9Å; S90-C94 PolarHBondContact O-SG 2.92Å; F91-C94 PolarHBondContact O-N 2.96Å; F92-C94 PolarHBondContact O-N 3.2Å; C94-T98 VanDerWaalsContact O-CB 3.29Å; C94-T98 WeakPolarHBondContact O-CB 3.3Å; C94-T98 PolarHBondContact O-N 2.9Å; C94-T98 PolarHBondContact O-OG1 3.34Å; C94-Q112 WeakPolarHBondContact CB-O 3.24Å; C94-P114 VanDerWaalsContact SG-CD 3.59Å |
| 95 | G | 96.1 | Very high | 92.1 | Very high | 0 Ų | 0 | 16.9 Ų | 16.9 | 0% | 0 | 8% | 0.079 | C | C | . | . | H | α-helix | trans | -63.1 | -50.6 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | F91 F92 S93 S97 T98 I99 G408 | F91-G95 PolarHBondContact O-N 2.72Å; F92-G95 PolarHBondContact O-N 3.42Å; S93-G95 VanDerWaalsContact C-N 3.33Å; S93-G95 PolarHBondContact O-N 3.19Å; G95-S97 PolarHBondContact O-N 3.02Å; G95-T98 PolarHBondContact O-N 3.42Å; G95-I99 WeakPolarHBondContact O-CG1 3.47Å; G95-I99 PolarHBondContact O-N 3.08Å; G95-I99 VanDerWaalsContact O-N 3.07Å; G95-G408 WeakPolarHBondContact CA-O 3.4Å |
| 96 | V | 95.8 | Very high | 92.2 | Very high | 31 Ų | 31 | 15.2 Ų | 15.2 | 19% | 0.188 | 7% | 0.071 | C | C | . | . | H | α-helix | trans | -59.9 | -47.6 | 175.8 | 175.5 | 0 | 0 | 0 | 0 | 110.9 | F92 S93 T98 I99 L100 L373 M412 | F92-V96 HydrophobicContact CD1-CG2 4.29Å; F92-V96 HydrophobicContact CE1-CG2 3.98Å; F92-V96 HydrophobicContact CZ-CG2 4.3Å; F92-V96 WeakPolarHBondContact O-CG2 3.2Å; F92-V96 PolarHBondContact O-N 3.32Å; S93-V96 PolarHBondContact O-N 3.37Å; V96-T98 VanDerWaalsContact C-N 3.34Å; V96-T98 PolarHBondContact O-N 2.75Å; V96-I99 PolarHBondContact O-N 3.35Å; V96-L100 HydrophobicContact CG1-CD1 3.96Å; V96-L100 HydrophobicContact CG1-CG 4.41Å; V96-L100 WeakPolarHBondContact O-CG 3.37Å; V96-L100 PolarHBondContact O-N 3.01Å; V96-L373 HydrophobicContact CB-CD2 3.89Å; V96-L373 HydrophobicContact CG1-CD2 3.75Å; V96-L373 HydrophobicContact CG2-CD2 4.14Å; V96-M412 HydrophobicContact CG2-CE 4Å; V96-M412 HydrophobicContact CG2-CG 4.06Å; V96-M412 HydrophobicContact CG2-SD 3.95Å |
| 97 | S | 95.8 | Very high | 92.4 | Very high | 0 Ų | 0 | 16.6 Ų | 16.6 | 0% | 0 | 8% | 0.076 | C | C | . | . | H | α-helix | trans | -61.1 | -40.9 | 178.9 | -170.1 | 0 | 0 | 0 | 0 | 111.9 | S93 G95 I99 L100 Q101 Q112 T383 | S93-S97 WeakPolarHBondContact O-CB 3.37Å; S93-S97 PolarHBondContact O-N 3.4Å; G95-S97 PolarHBondContact O-N 3.02Å; S97-I99 PolarHBondContact O-N 3.3Å; S97-L100 PolarHBondContact O-N 2.95Å; S97-Q101 VanDerWaalsContact O-CB 3.26Å; S97-Q101 WeakPolarHBondContact O-CB 3.38Å; S97-Q101 PolarHBondContact O-N 3.31Å; S97-Q112 WeakPolarHBondContact OG-CG 3.45Å; S97-T383 PolarHBondContact OG-OG1 3.18Å |
| 98 | T | 96.6 | Very high | 92.6 | Very high | 0 Ų | 0 | 16.6 Ų | 16.6 | 0% | 0 | 8% | 0.076 | C | C | . | . | H | α-helix | trans | -62.9 | -43.4 | 176.3 | -61.4 | 0 | 0 | 0 | 0 | 111.9 | C94 G95 V96 Q101 T102 Q112 A404 V407 | C94-T98 VanDerWaalsContact O-CB 3.29Å; C94-T98 WeakPolarHBondContact O-CB 3.3Å; C94-T98 PolarHBondContact O-N 2.9Å; C94-T98 PolarHBondContact O-OG1 3.34Å; G95-T98 PolarHBondContact O-N 3.42Å; V96-T98 VanDerWaalsContact C-N 3.34Å; V96-T98 PolarHBondContact O-N 2.75Å; T98-Q101 PolarHBondContact O-N 3.38Å; T98-T102 HydrophobicContact CG2-CG2 4.47Å; T98-T102 WeakPolarHBondContact O-CB 3.24Å; T98-T102 VanDerWaalsContact O-CG2 3.32Å; T98-T102 WeakPolarHBondContact O-CG2 3.27Å; T98-T102 PolarHBondContact O-N 3.41Å; T98-T102 PolarHBondContact O-OG1 2.9Å; T98-Q112 WeakPolarHBondContact OG1-CB 3.5Å; T98-Q112 PolarHBondContact OG1-N 3.4Å; T98-Q112 PolarHBondContact OG1-O 3.47Å; T98-A404 WeakPolarHBondContact CG2-O 3.22Å; T98-V407 HydrophobicContact CG2-CG1 4.49Å |
| 99 | I | 95.6 | Very high | 92.6 | Very high | 44 Ų | 44 | 17.2 Ų | 17.2 | 23% | 0.226 | 8% | 0.08 | C | C | . | . | H | α-helix | trans | -64 | -47.2 | 176.5 | -65.4 | 172.1 | 0 | 0 | 0 | 110.2 | G95 V96 S97 Q101 T102 W103 L409 M412 | G95-I99 WeakPolarHBondContact O-CG1 3.47Å; G95-I99 PolarHBondContact O-N 3.08Å; G95-I99 VanDerWaalsContact O-N 3.07Å; V96-I99 PolarHBondContact O-N 3.35Å; S97-I99 PolarHBondContact O-N 3.3Å; I99-Q101 VanDerWaalsContact C-N 3.3Å; I99-Q101 PolarHBondContact O-N 3.43Å; I99-T102 PolarHBondContact O-N 3.01Å; I99-T102 PolarHBondContact O-OG1 3.32Å; I99-T102 VanDerWaalsContact O-OG1 3.11Å; I99-W103 WeakPolarHBondContact O-CB 3.31Å; I99-W103 PolarHBondContact O-N 2.94Å; I99-L409 HydrophobicContact CD1-CD2 3.95Å; I99-L409 HydrophobicContact CD1-CG 4.28Å; I99-M412 HydrophobicContact CD1-SD 3.47Å; I99-M412 WeakPolarHBondContact CD1-SD 3.5Å |
| 100 | L | 93.8 | Very high | 92.7 | Very high | 37 Ų | 37 | 17.2 Ų | 17.2 | 19% | 0.194 | 8% | 0.08 | C | C | . | . | H | α-helix | trans | -58.2 | -45.8 | 177.6 | -72.1 | 172 | 0 | 0 | 0 | 111 | V96 S97 T102 M104 G105 L366 L369 | V96-L100 HydrophobicContact CG1-CD1 3.96Å; V96-L100 HydrophobicContact CG1-CG 4.41Å; V96-L100 WeakPolarHBondContact O-CG 3.37Å; V96-L100 PolarHBondContact O-N 3.01Å; S97-L100 PolarHBondContact O-N 2.95Å; L100-T102 VanDerWaalsContact C-N 3.34Å; L100-T102 PolarHBondContact O-N 3.41Å; L100-M104 CarbonylContact O-C 3.38Å; L100-M104 PolarHBondContact O-N 3.28Å; L100-G105 PolarHBondContact O-N 3.13Å; L100-L366 HydrophobicContact CB-CB 4.28Å; L100-L366 HydrophobicContact CB-CD1 4.23Å; L100-L366 WeakPolarHBondContact O-CD1 3.43Å; L100-L369 HydrophobicContact CD1-CD2 4.09Å |
| 101 | Q | 94.1 | Very high | 92.8 | Very high | 0 Ų | 0 | 17.3 Ų | 17.3 | 0% | 0 | 8% | 0.081 | C | C | . | . | H | α-helix | trans | -62.2 | -40.8 | -177.9 | -178 | 67.4 | -14.4 | 0 | 0 | 113.4 | S97 T98 I99 G105 S106 R107 L110 Q112 Y343 G363 | S97-Q101 VanDerWaalsContact O-CB 3.26Å; S97-Q101 WeakPolarHBondContact O-CB 3.38Å; S97-Q101 PolarHBondContact O-N 3.31Å; T98-Q101 PolarHBondContact O-N 3.38Å; I99-Q101 VanDerWaalsContact C-N 3.3Å; I99-Q101 PolarHBondContact O-N 3.43Å; Q101-G105 CarbonylContact O-C 3.45Å; Q101-G105 WeakPolarHBondContact O-CA 3.46Å; Q101-G105 PolarHBondContact O-N 3.02Å; Q101-G105 VanDerWaalsContact O-N 3.08Å; Q101-S106 PolarHBondContact NE2-OG 3.45Å; Q101-S106 PolarHBondContact O-N 3.23Å; Q101-R107 PolarHBondContact O-N 3.45Å; Q101-L110 HydrophobicContact CG-CB 4.28Å; Q101-Q112 HydrophobicContact CB-CG 3.99Å; Q101-Q112 HydrophobicContact CG-CG 4.37Å; Q101-Y343 VanDerWaalsContact NE2-CE1 3.34Å; Q101-Y343 VanDerWaalsContact NE2-CZ 3.3Å; Q101-Y343 PolarHBondContact NE2-OH 2.98Å; Q101-G363 VanDerWaalsContact OE1-CA 3.23Å; Q101-G363 PolarHBondContact OE1-O 3.41Å; Q101-G363 VanDerWaalsContact OE1-O 3.04Å |
| 102 | T | 90.8 | Very high | 92.9 | Very high | 0 Ų | 0 | 17.2 Ų | 17.2 | 0% | 0 | 8% | 0.08 | C | C | . | . | H | α-helix | trans | -84.6 | -33.9 | -176.2 | 49 | 0 | 0 | 0 | 0 | 112 | T98 I99 L100 R107 A404 H405 | T98-T102 HydrophobicContact CG2-CG2 4.47Å; T98-T102 WeakPolarHBondContact O-CB 3.24Å; T98-T102 VanDerWaalsContact O-CG2 3.32Å; T98-T102 WeakPolarHBondContact O-CG2 3.27Å; T98-T102 PolarHBondContact O-N 3.41Å; T98-T102 PolarHBondContact O-OG1 2.9Å; I99-T102 PolarHBondContact O-N 3.01Å; I99-T102 PolarHBondContact O-OG1 3.32Å; I99-T102 VanDerWaalsContact O-OG1 3.11Å; L100-T102 VanDerWaalsContact C-N 3.34Å; L100-T102 PolarHBondContact O-N 3.41Å; T102-R107 WeakPolarHBondContact O-CD 3.29Å; T102-A404 HydrophobicContact CG2-CB 3.5Å; T102-H405 PolarHBondContact OG1-CD2 2.82Å; T102-H405 PolarHBondContact OG1-NE2 3.2Å |
| 103 | W | 87.1 | Confident | 92.7 | Very high | 114 Ų | 114 | 15.9 Ų | 15.9 | 43% | 0.432 | 7% | 0.074 | S | C | . | . | H | α-helix | trans | -79 | -50.2 | 179.5 | -175 | 58.3 | 0 | 0 | 0 | 112.5 | I99 R107 I561 | I99-W103 WeakPolarHBondContact O-CB 3.31Å; I99-W103 PolarHBondContact O-N 2.94Å; W103-R107 WeakPolarHBondContact O-CD 3.26Å; W103-R107 PolarHBondContact O-NH1 3.42Å; W103-I561 HydrophobicContact CH2-CD1 3.92Å; W103-I561 HydrophobicContact CZ2-CD1 4Å; W103-I561 HydrophobicContact CZ3-CD1 4.48Å |
| 104 | M | 87.9 | Confident | 92.2 | Very high | 53 Ų | 53 | 15.9 Ų | 15.9 | 26% | 0.261 | 8% | 0.075 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -121.6 | -18.6 | -175.6 | -81.4 | -179 | 71.5 | 0 | 0 | 114 | L100 R362 L366 L557 I561 | L100-M104 CarbonylContact O-C 3.38Å; L100-M104 PolarHBondContact O-N 3.28Å; M104-R362 WeakPolarHBondContact O-CD 3.28Å; M104-R362 WeakPolarHBondContact O-CG 3.42Å; M104-R362 PolarHBondContact O-NE 3.04Å; M104-L366 VanDerWaalsContact C-CD1 3.42Å; M104-L366 HydrophobicContact CB-CD1 3.49Å; M104-L366 VanDerWaalsContact CB-CD1 3.49Å; M104-L557 HydrophobicContact CG-CD2 4.49Å; M104-I561 HydrophobicContact CE-CD1 4.06Å; M104-I561 HydrophobicContact CE-CG2 4.47Å; M104-I561 HydrophobicContact CG-CD1 3.72Å; M104-I561 HydrophobicContact SD-CD1 3.69Å |
| 105 | G | 90.1 | Very high | 91.6 | Very high | 0 Ų | 0 | 16.1 Ų | 16.1 | 0% | 0 | 8% | 0.076 | C | C | . | . | S | Bend | trans | -77.5 | -125.9 | -172.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | L100 Q101 R107 R362 | L100-G105 PolarHBondContact O-N 3.13Å; Q101-G105 CarbonylContact O-C 3.45Å; Q101-G105 WeakPolarHBondContact O-CA 3.46Å; Q101-G105 PolarHBondContact O-N 3.02Å; Q101-G105 VanDerWaalsContact O-N 3.08Å; G105-R107 PolarHBondContact O-N 3.08Å; G105-R362 PolarHBondContact O-NE 2.94Å; G105-R362 PolarHBondContact O-NH2 3.42Å |
| 106 | S | 89.3 | Confident | 91 | Very high | 1 Ų | 1 | 17.9 Ų | 17.9 | 1% | 0.007 | 9% | 0.085 | C | C | . | . | S | Bend | trans | -66.1 | -16.9 | 176 | 59.6 | 0 | 0 | 0 | 0 | 113.7 | Q101 L108 Y555 | Q101-S106 PolarHBondContact NE2-OG 3.45Å; Q101-S106 PolarHBondContact O-N 3.23Å; S106-L108 PolarHBondContact O-N 2.97Å; S106-L108 VanDerWaalsContact O-N 3.09Å; S106-Y555 WeakPolarHBondContact O-CD1 3.37Å |
| 107 | R | 88.9 | Confident | 90.7 | Very high | 34 Ų | 34 | 16.8 Ų | 16.8 | 13% | 0.128 | 8% | 0.078 | C | C | . | . | trans | 65.5 | -2.2 | -174 | -54.4 | -82.9 | -95.6 | 167.7 | 0.8 | 114.2 | Q101 T102 W103 G105 Q401 V554 R556 | Q101-R107 PolarHBondContact O-N 3.45Å; T102-R107 WeakPolarHBondContact O-CD 3.29Å; W103-R107 WeakPolarHBondContact O-CD 3.26Å; W103-R107 PolarHBondContact O-NH1 3.42Å; G105-R107 PolarHBondContact O-N 3.08Å; R107-Q401 PolarHBondContact O-NE2 2.65Å; R107-V554 VanDerWaalsContact CB-O 3.31Å; R107-V554 WeakPolarHBondContact CB-O 3.1Å; R107-R556 PolarHBondContact NE-O 3.14Å; R107-R556 PolarHBondContact NH2-O 3.21Å | ||
| 108 | L | 89.9 | Confident | 90.5 | Very high | 0 Ų | 0 | 16.8 Ų | 16.8 | 0% | 0 | 8% | 0.078 | C | C | . | . | S | Bend | trans | -69.4 | 151.6 | 168.7 | -68.8 | 171.7 | 0 | 0 | 0 | 109.4 | S106 L110 C346 L352 Y555 | S106-L108 PolarHBondContact O-N 2.97Å; S106-L108 VanDerWaalsContact O-N 3.09Å; L108-L110 HydrophobicContact CB-CD1 3.72Å; L108-L110 HydrophobicContact CB-CG 3.68Å; L108-L110 HydrophobicContact CD1-CD1 4.04Å; L108-L110 PolarHBondContact O-N 3.15Å; L108-C346 HydrophobicContact CD1-CB 4.48Å; L108-L352 HydrophobicContact CD2-CD1 3.63Å; L108-Y555 HydrophobicContact CD1-CE1 4.21Å; L108-Y555 HydrophobicContact CD2-CE1 3.8Å; L108-Y555 HydrophobicContact CG-CE1 3.82Å |
| 109 | P | 91.2 | Very high | 90.1 | Very high | 14 Ų | 14 | 17.1 Ų | 17.1 | 9% | 0.091 | 8% | 0.08 | C | C | . | . | trans | -73.5 | 58.2 | 174.9 | 33.2 | -36.3 | 0 | 0 | 0 | 110.9 | L350 A404 | P109-L350 HydrophobicContact CG-CD1 3.49Å; P109-L350 VanDerWaalsContact CG-CD1 3.49Å; P109-A404 HydrophobicContact CB-CB 4.05Å | ||
| 110 | L | 93.2 | Very high | 89.8 | Confident | 0 Ų | 0 | 16.2 Ų | 16.2 | 0% | 0 | 8% | 0.075 | C | C | . | . | P | Polyproline II helix | trans | -95.4 | 123.5 | -177.5 | -71.1 | 170.5 | 0 | 0 | 0 | 110.1 | Q101 L108 C342 Y343 C346 V390 | Q101-L110 HydrophobicContact CG-CB 4.28Å; L108-L110 HydrophobicContact CB-CD1 3.72Å; L108-L110 HydrophobicContact CB-CG 3.68Å; L108-L110 HydrophobicContact CD1-CD1 4.04Å; L108-L110 PolarHBondContact O-N 3.15Å; L110-C342 HydrophobicContact CD2-CB 4.46Å; L110-Y343 HydrophobicContact CD1-CD1 3.14Å; L110-Y343 HydrophobicContact CD1-CE1 3.42Å; L110-Y343 VanDerWaalsContact CD1-CE1 3.42Å; L110-Y343 HydrophobicContact CD1-CG 4.16Å; L110-C346 HydrophobicContact CD2-CB 3.61Å; L110-C346 HydrophobicContact CG-CB 4.42Å; L110-V390 HydrophobicContact CD2-CG2 3.59Å |
| 111 | V | 94.3 | Very high | 89.7 | Confident | 2 Ų | 2 | 14.4 Ų | 14.4 | 1% | 0.012 | 7% | 0.066 | C | C | . | . | P | Polyproline II helix | trans | -89.1 | 124 | 177.4 | 173.6 | 0 | 0 | 0 | 0 | 108.9 | H55 M59 S386 N389 V407 | H55-V111 HydrophobicContact CB-CG2 4.26Å; M59-V111 HydrophobicContact CE-CG1 3.33Å; M59-V111 HydrophobicContact CG-CG1 3.47Å; M59-V111 VanDerWaalsContact CG-CG1 3.47Å; M59-V111 HydrophobicContact SD-CG1 3.1Å; M59-V111 WeakPolarHBondContact SD-CG1 3.44Å; V111-S386 WeakPolarHBondContact O-CB 3.5Å; V111-S386 PolarHBondContact O-N 3.04Å; V111-N389 HydrophobicContact CB-CB 4.06Å; V111-V407 HydrophobicContact CG1-CG1 3.93Å; V111-V407 HydrophobicContact CG2-CB 4.47Å; V111-V407 HydrophobicContact CG2-CG1 4.02Å; V111-V407 HydrophobicContact CG2-CG2 4.45Å |
| 112 | Q | 94.9 | Very high | 89.5 | Confident | 0 Ų | 0 | 14.4 Ų | 14.4 | 0% | 0 | 7% | 0.066 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -87.1 | 125.1 | 179.1 | -61.4 | -59.3 | -48.6 | 0 | 0 | 109.7 | C94 S97 T98 Q101 E367 A384 S385 | C94-Q112 WeakPolarHBondContact CB-O 3.24Å; S97-Q112 WeakPolarHBondContact OG-CG 3.45Å; T98-Q112 WeakPolarHBondContact OG1-CB 3.5Å; T98-Q112 PolarHBondContact OG1-N 3.4Å; T98-Q112 PolarHBondContact OG1-O 3.47Å; Q101-Q112 HydrophobicContact CB-CG 3.99Å; Q101-Q112 HydrophobicContact CG-CG 4.37Å; Q112-E367 PolarHBondContact OE1-OE2 3.07Å; Q112-A384 CarbonylContact C-O 3.5Å; Q112-A384 WeakPolarHBondContact CA-O 3.36Å; Q112-A384 PolarHBondContact OE1-O 3.36Å; Q112-S385 PolarHBondContact NE2-OG 3.03Å |
| 113 | A | 91.1 | Very high | 89.3 | Confident | 0 Ų | 0 | 17 Ų | 17 | 0% | 0 | 8% | 0.08 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -137.5 | 162.8 | -176.8 | 0 | 0 | 0 | 0 | 0 | 110 | M59 L62 A384 | M59-A113 HydrophobicContact CG-CB 3.9Å; M59-A113 HydrophobicContact SD-CB 3.73Å; L62-A113 HydrophobicContact CD2-CB 4.17Å; A113-A384 PolarHBondContact N-O 3.14Å; A113-A384 PolarHBondContact O-N 2.9Å |
| 114 | P | 83.8 | Confident | 89.2 | Confident | 2 Ų | 2 | 12 Ų | 12 | 1% | 0.013 | 6% | 0.061 | C | C | . | . | trans | -61.7 | 143.4 | 164.9 | 30.8 | -38 | 0 | 0 | 0 | 109.3 | L62 L63 C94 M381 G382 | L62-P114 WeakPolarHBondContact CD2-O 3.08Å; L62-P114 WeakPolarHBondContact CG-O 3.29Å; L63-P114 HydrophobicContact CB-CG 3.77Å; L63-P114 HydrophobicContact CD1-CG 3.87Å; L63-P114 HydrophobicContact CG-CG 3.71Å; C94-P114 VanDerWaalsContact SG-CD 3.59Å; P114-M381 HydrophobicContact CB-CB 3.61Å; P114-M381 HydrophobicContact CB-CG 4.06Å; P114-G382 WeakPolarHBondContact CA-O 3.49Å | ||
| 115 | S | 84.4 | Confident | 89.2 | Confident | 7 Ų | 7 | 9.6 Ų | 9.6 | 5% | 0.049 | 5% | 0.049 | C | C | . | . | trans | -121.6 | 154.1 | -173.4 | 86.1 | 0 | 0 | 0 | 0 | 110.9 | E117 F118 L119 | S115-E117 WeakPolarHBondContact CB-OE2 3.16Å; S115-E117 PolarHBondContact O-N 3.49Å; S115-E117 PolarHBondContact OG-OE2 3.48Å; S115-F118 PolarHBondContact O-N 3.49Å; S115-F118 WeakPolarHBondContact OG-CD2 3.32Å; S115-L119 PolarHBondContact O-N 3.4Å | ||
| 116 | L | 82.6 | Confident | 88.7 | Confident | 36 Ų | 36 | 10.2 Ų | 10.2 | 19% | 0.188 | 5% | 0.054 | C | C | . | . | H | α-helix | trans | -64.6 | -22.2 | -177.7 | -69.9 | 174.4 | 0 | 0 | 0 | 111.7 | L119 I120 | L116-L119 HydrophobicContact CD2-CD2 4.02Å; L116-L119 WeakPolarHBondContact O-CB 3.34Å; L116-L119 PolarHBondContact O-N 2.94Å; L116-L119 VanDerWaalsContact O-N 3.16Å; L116-I120 WeakPolarHBondContact O-CG1 3.31Å; L116-I120 PolarHBondContact O-N 2.98Å |
| 117 | E | 89.4 | Confident | 87.8 | Confident | 8 Ų | 8 | 13.2 Ų | 13.2 | 4% | 0.037 | 7% | 0.074 | C | C | . | . | H | α-helix | trans | -62.9 | -41.3 | 176.5 | -58.9 | 81.6 | 174.4 | 0 | 0 | 111.3 | S115 L119 A334 A335 S338 Q503 I505 | S115-E117 WeakPolarHBondContact CB-OE2 3.16Å; S115-E117 PolarHBondContact O-N 3.49Å; S115-E117 PolarHBondContact OG-OE2 3.48Å; E117-L119 VanDerWaalsContact C-N 3.35Å; E117-A334 HydrophobicContact CB-CB 3.92Å; E117-A334 HydrophobicContact CG-CB 4.1Å; E117-A335 HydrophobicContact CB-CB 4.5Å; E117-S338 WeakPolarHBondContact OE1-CB 3.28Å; E117-S338 PolarHBondContact OE1-OG 3.04Å; E117-Q503 VanDerWaalsContact CA-OE1 3.28Å; E117-Q503 PolarHBondContact O-NE2 2.94Å; E117-I505 VanDerWaalsContact OE1-CD1 3.29Å; E117-I505 WeakPolarHBondContact OE1-CD1 3.36Å |
| 118 | F | 91.8 | Very high | 86.3 | Confident | 0 Ų | 0 | 14.5 Ų | 14.5 | 0% | 0 | 8% | 0.082 | C | C | . | . | H | α-helix | trans | -66.7 | -39.3 | 172.4 | -68.6 | -81.3 | 0 | 0 | 0 | 111.5 | S115 A122 V177 S180 M331 A335 M381 A384 | S115-F118 PolarHBondContact O-N 3.49Å; S115-F118 WeakPolarHBondContact OG-CD2 3.32Å; F118-A122 VanDerWaalsContact O-CB 3.25Å; F118-A122 WeakPolarHBondContact O-CB 3.05Å; F118-A122 PolarHBondContact O-N 2.87Å; F118-V177 HydrophobicContact CD1-CG2 4.36Å; F118-S180 WeakPolarHBondContact CE1-OG 3.42Å; F118-M331 HydrophobicContact CD1-CB 3.8Å; F118-M331 HydrophobicContact CD1-CG 3.93Å; F118-M331 HydrophobicContact CD1-SD 3.79Å; F118-M331 HydrophobicContact CE1-CB 3.94Å; F118-A335 HydrophobicContact CE2-CB 3.74Å; F118-A335 HydrophobicContact CZ-CB 3.85Å; F118-M381 HydrophobicContact CB-CE 4.17Å; F118-M381 HydrophobicContact CB-SD 4.17Å; F118-A384 HydrophobicContact CE2-CB 3.95Å |
| 119 | L | 88.9 | Confident | 84.3 | Confident | 7 Ų | 7 | 17.2 Ų | 17.2 | 4% | 0.037 | 9% | 0.094 | C | C | . | . | H | α-helix | trans | -63.2 | -46.7 | -179.3 | -177.7 | 64.8 | 0 | 0 | 0 | 112.5 | L69 L70 S115 L116 E117 S121 A122 L123 M381 | L69-L119 HydrophobicContact CB-CD1 4.45Å; L69-L119 HydrophobicContact CB-CD2 3.9Å; L69-L119 HydrophobicContact CD1-CD2 3.76Å; L69-L119 HydrophobicContact CG-CD2 4.5Å; L70-L119 HydrophobicContact CB-CD1 3.94Å; L70-L119 HydrophobicContact CD1-CD1 4.41Å; S115-L119 PolarHBondContact O-N 3.4Å; L116-L119 HydrophobicContact CD2-CD2 4.02Å; L116-L119 WeakPolarHBondContact O-CB 3.34Å; L116-L119 PolarHBondContact O-N 2.94Å; L116-L119 VanDerWaalsContact O-N 3.16Å; E117-L119 VanDerWaalsContact C-N 3.35Å; L119-S121 PolarHBondContact O-N 3.35Å; L119-A122 PolarHBondContact O-N 3.43Å; L119-L123 HydrophobicContact CD1-CD1 4.17Å; L119-L123 HydrophobicContact CD1-CG 4.11Å; L119-L123 HydrophobicContact CG-CD1 3.96Å; L119-L123 HydrophobicContact CG-CG 4.31Å; L119-L123 WeakPolarHBondContact O-CB 3.46Å; L119-L123 VanDerWaalsContact O-CG 3.28Å; L119-L123 WeakPolarHBondContact O-CG 3.46Å; L119-L123 PolarHBondContact O-N 3.23Å; L119-M381 HydrophobicContact CB-CE 4.34Å; L119-M381 HydrophobicContact CB-SD 3.91Å; L119-M381 HydrophobicContact CD1-CE 4.29Å; L119-M381 HydrophobicContact CD1-SD 4.25Å |
| 120 | I | 88.9 | Confident | 81.7 | Confident | 25 Ų | 25 | 21.3 Ų | 21.3 | 13% | 0.128 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -58.2 | -50.8 | -178.4 | -70.2 | 163.4 | 0 | 0 | 0 | 110.6 | L116 A122 L123 V124 T502 Q503 | L116-I120 WeakPolarHBondContact O-CG1 3.31Å; L116-I120 PolarHBondContact O-N 2.98Å; I120-A122 VanDerWaalsContact C-N 3.34Å; I120-A122 PolarHBondContact O-N 3.11Å; I120-L123 PolarHBondContact O-N 3.32Å; I120-V124 WeakPolarHBondContact O-CG2 3.32Å; I120-V124 PolarHBondContact O-N 3.44Å; I120-T502 HydrophobicContact CG2-CG2 3.68Å; I120-Q503 HydrophobicContact CG2-CG 4.49Å |
| 121 | S | 91.3 | Very high | 78.6 | Confident | 0 Ų | 0 | 26.4 Ų | 26.4 | 0% | 0 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -68.9 | -33.3 | -179.6 | -56.4 | 0 | 0 | 0 | 0 | 112.3 | L119 V124 L125 S330 Q503 | L119-S121 PolarHBondContact O-N 3.35Å; S121-V124 PolarHBondContact O-N 3.27Å; S121-L125 WeakPolarHBondContact O-CB 3.49Å; S121-L125 PolarHBondContact O-N 3.39Å; S121-S330 PolarHBondContact OG-OG 3.22Å; S121-Q503 PolarHBondContact OG-NE2 3.29Å |
| 122 | A | 89.7 | Confident | 75.6 | Confident | 0 Ų | 0 | 33.8 Ų | 33.8 | 0% | 0 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -63.3 | -43.7 | 173.3 | 0 | 0 | 0 | 0 | 0 | 111.5 | L70 F118 L119 I120 L125 T126 V173 M331 M381 | L70-A122 HydrophobicContact CD1-CB 4.21Å; F118-A122 VanDerWaalsContact O-CB 3.25Å; F118-A122 WeakPolarHBondContact O-CB 3.05Å; F118-A122 PolarHBondContact O-N 2.87Å; L119-A122 PolarHBondContact O-N 3.43Å; I120-A122 VanDerWaalsContact C-N 3.34Å; I120-A122 PolarHBondContact O-N 3.11Å; A122-L125 PolarHBondContact O-N 3.06Å; A122-T126 WeakPolarHBondContact O-CG2 2.95Å; A122-T126 PolarHBondContact O-N 3.04Å; A122-T126 PolarHBondContact O-OG1 3.39Å; A122-V173 HydrophobicContact CB-CG1 3.75Å; A122-V173 HydrophobicContact CB-CG2 4.2Å; A122-M331 HydrophobicContact CB-CE 3.94Å; A122-M381 HydrophobicContact CB-CE 3.92Å |
| 123 | L | 86.1 | Confident | 72.3 | Confident | 55 Ų | 55 | 37.9 Ų | 37.9 | 29% | 0.288 | 22% | 0.22 | S | C | . | . | H | α-helix | trans | -65.3 | -37.4 | 176.7 | -69.4 | 173.7 | 0 | 0 | 0 | 112.3 | L70 S73 L119 I120 T126 S127 | L70-L123 HydrophobicContact CD1-CD2 4.44Å; S73-L123 VanDerWaalsContact CB-CD2 3.45Å; S73-L123 VanDerWaalsContact OG-CD2 3.23Å; S73-L123 WeakPolarHBondContact OG-CD2 3.47Å; L119-L123 HydrophobicContact CD1-CD1 4.17Å; L119-L123 HydrophobicContact CD1-CG 4.11Å; L119-L123 HydrophobicContact CG-CD1 3.96Å; L119-L123 HydrophobicContact CG-CG 4.31Å; L119-L123 WeakPolarHBondContact O-CB 3.46Å; L119-L123 VanDerWaalsContact O-CG 3.28Å; L119-L123 WeakPolarHBondContact O-CG 3.46Å; L119-L123 PolarHBondContact O-N 3.23Å; I120-L123 PolarHBondContact O-N 3.32Å; L123-T126 WeakPolarHBondContact CA-OG1 3.5Å; L123-T126 PolarHBondContact O-N 3.48Å; L123-T126 PolarHBondContact O-OG1 3.32Å; L123-S127 WeakPolarHBondContact O-CB 3.47Å; L123-S127 PolarHBondContact O-N 3.46Å; L123-S127 PolarHBondContact O-OG 2.94Å |
| 124 | V | 86.6 | Confident | 69.4 | Low | 8 Ų | 8 | 44.5 Ų | 44.5 | 5% | 0.048 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -63.8 | -43.5 | 173.8 | 171 | 0 | 0 | 0 | 0 | 110.8 | I120 S121 T126 S127 Q128 H498 S499 | I120-V124 WeakPolarHBondContact O-CG2 3.32Å; I120-V124 PolarHBondContact O-N 3.44Å; S121-V124 PolarHBondContact O-N 3.27Å; V124-T126 PolarHBondContact O-N 3.27Å; V124-S127 PolarHBondContact O-OG 3.37Å; V124-Q128 PolarHBondContact O-N 3.03Å; V124-H498 HydrophobicContact CG1-CB 4.12Å; V124-H498 WeakPolarHBondContact CG1-ND1 3.19Å; V124-S499 WeakPolarHBondContact CG1-OG 3.48Å |
| 125 | L | 86.1 | Confident | 66.8 | Low | 2 Ų | 2 | 52 Ų | 52 | 1% | 0.01 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -63.7 | -39.7 | 178.5 | -178.2 | 62 | 0 | 0 | 0 | 112.5 | S121 A122 E172 V173 A176 R323 A327 V495 | S121-L125 WeakPolarHBondContact O-CB 3.49Å; S121-L125 PolarHBondContact O-N 3.39Å; A122-L125 PolarHBondContact O-N 3.06Å; L125-E172 HydrophobicContact CD2-CB 4.36Å; L125-V173 HydrophobicContact CD2-CG2 4.06Å; L125-A176 HydrophobicContact CD2-CB 4.26Å; L125-R323 HydrophobicContact CD1-CB 3.64Å; L125-A327 HydrophobicContact CB-CB 4.18Å; L125-A327 HydrophobicContact CD1-CB 4.37Å; L125-A327 HydrophobicContact CD2-CB 3.95Å; L125-A327 HydrophobicContact CG-CB 4.41Å; L125-V495 HydrophobicContact CD1-CG1 4.41Å |
| 126 | T | 80.1 | Confident | 64 | Low | 14 Ų | 14 | 57.1 Ų | 57.1 | 9% | 0.086 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -81.1 | -37.3 | -179.2 | 57.1 | 0 | 0 | 0 | 0 | 113.1 | A122 L123 V124 Q128 K129 V173 | A122-T126 WeakPolarHBondContact O-CG2 2.95Å; A122-T126 PolarHBondContact O-N 3.04Å; A122-T126 PolarHBondContact O-OG1 3.39Å; L123-T126 WeakPolarHBondContact CA-OG1 3.5Å; L123-T126 PolarHBondContact O-N 3.48Å; L123-T126 PolarHBondContact O-OG1 3.32Å; V124-T126 PolarHBondContact O-N 3.27Å; T126-Q128 PolarHBondContact O-N 3.14Å; T126-K129 WeakPolarHBondContact O-CB 3.31Å; T126-K129 PolarHBondContact O-N 3.01Å; T126-K129 VanDerWaalsContact O-N 3.14Å; T126-V173 HydrophobicContact CG2-CG2 3.81Å |
| 127 | S | 71.1 | Confident | 61.6 | Low | 64 Ų | 64 | 62 Ų | 62 | 45% | 0.448 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -66.1 | -33.6 | -178.1 | 57.2 | 0 | 0 | 0 | 0 | 113.6 | L123 V124 K129 L130 | L123-S127 WeakPolarHBondContact O-CB 3.47Å; L123-S127 PolarHBondContact O-N 3.46Å; L123-S127 PolarHBondContact O-OG 2.94Å; V124-S127 PolarHBondContact O-OG 3.37Å; S127-K129 PolarHBondContact O-N 3.1Å; S127-L130 WeakPolarHBondContact O-CB 3.42Å; S127-L130 PolarHBondContact O-N 3.42Å; S127-L130 VanDerWaalsContact O-N 3.09Å |
| 128 | Q | 57.2 | Low | 58.6 | Low | 61 Ų | 61 | 64.9 Ų | 64.9 | 29% | 0.285 | 39% | 0.385 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -68.9 | -11.2 | 175 | -73.7 | -167.9 | -11.4 | 0 | 0 | 114.2 | V124 T126 L485 | V124-Q128 PolarHBondContact O-N 3.03Å; T126-Q128 PolarHBondContact O-N 3.14Å; Q128-L485 HydrophobicContact CG-CD2 4.08Å |
| 129 | K | 47.7 | Very low | 55.4 | Low | 56 Ų | 56 | 73 Ų | 73 | 24% | 0.243 | 43% | 0.428 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -89.7 | -11.9 | 172.1 | -73.9 | 179.3 | 165.7 | -177.8 | 0 | 113.2 | T126 S127 S169 E172 R323 | T126-K129 WeakPolarHBondContact O-CB 3.31Å; T126-K129 PolarHBondContact O-N 3.01Å; T126-K129 VanDerWaalsContact O-N 3.14Å; S127-K129 PolarHBondContact O-N 3.1Å; K129-S169 WeakPolarHBondContact CD-OG 3.04Å; K129-S169 PolarHBondContact NZ-OG 3.38Å; K129-E172 WeakPolarHBondContact CE-OE2 3.28Å; K129-E172 IonicContact NZ-OE1 3.08Å; K129-E172 PolarHBondContact NZ-OE1 2.92Å; K129-E172 IonicContact NZ-OE2 3.3Å; K129-E172 PolarHBondContact NZ-OE2 3.27Å; K129-R323 VanDerWaalsContact CE-NH2 3.29Å |
| 130 | L | 37.4 | Very low | 52.8 | Low | 101 Ų | 101 | 78 Ų | 78 | 53% | 0.529 | 46% | 0.463 | S | S | . | . | S | Bend | trans | -71.7 | 123.7 | 177 | -150.3 | 72.6 | 0 | 0 | 0 | 107.6 | S127 L132 W166 | S127-L130 WeakPolarHBondContact O-CB 3.42Å; S127-L130 PolarHBondContact O-N 3.42Å; S127-L130 VanDerWaalsContact O-N 3.09Å; L130-L132 PolarHBondContact O-N 2.93Å; L130-W166 HydrophobicContact CD1-CH2 3.87Å |
| 131 | P | 28 | Very low | 49.9 | Very low | 107 Ų | 107 | 85.6 Ų | 85.6 | 70% | 0.695 | 50% | 0.498 | S | S | * | . | trans | -58.4 | 122 | 176.6 | 22.5 | -29.7 | 0 | 0 | 0 | 107.9 | A133 | P131-A133 PolarHBondContact O-N 3.34Š| ||
| 132 | L | 31.5 | Very low | 46.9 | Very low | 157 Ų | 157 | 93.2 Ų | 93.2 | 82% | 0.822 | 53% | 0.533 | S | S | * | . | trans | -55.5 | 81.5 | 160.2 | -92 | 141.4 | 0 | 0 | 0 | 107.8 | L130 I134 | L130-L132 PolarHBondContact O-N 2.93Å; L132-I134 PolarHBondContact O-N 3.19Å; L132-I134 VanDerWaalsContact O-N 3.12Å | ||
| 133 | A | 25.7 | Very low | 44.2 | Very low | 85 Ų | 85 | 103 Ų | 103 | 70% | 0.702 | 57% | 0.57 | S | S | * | * | trans | -78.2 | 99.5 | 172.8 | 0 | 0 | 0 | 0 | 0 | 107.8 | P131 | P131-A133 PolarHBondContact O-N 3.34Š| ||
| 134 | I | 30 | Very low | 41.6 | Very low | 140 Ų | 140 | 107.2 Ų | 107.2 | 72% | 0.718 | 60% | 0.599 | S | S | * | * | trans | 82.6 | 86.8 | 156 | -47.1 | 167.6 | 0 | 0 | 0 | 115 | L132 T136 | L132-I134 PolarHBondContact O-N 3.19Å; L132-I134 VanDerWaalsContact O-N 3.12Å; I134-T136 HydrophobicContact CG2-CG2 4.22Å | ||
| 135 | Q | 28.5 | Very low | 38.7 | Very low | 160 Ų | 160 | 116.5 Ų | 116.5 | 75% | 0.748 | 63% | 0.633 | S | S | * | * | trans | -76.1 | 115.9 | 139.6 | -78.3 | -179.5 | -2 | 0 | 0 | 108.4 | ||||
| 136 | T | 24.8 | Very low | 35.9 | Very low | 113 Ų | 113 | 118.8 Ų | 118.8 | 69% | 0.693 | 65% | 0.652 | S | S | * | * | trans | -129.9 | 136.8 | 144.9 | 48.2 | 0 | 0 | 0 | 0 | 108 | I134 G138 | I134-T136 HydrophobicContact CG2-CG2 4.22Å; T136-G138 PolarHBondContact O-N 2.72Å | ||
| 137 | P | 33.6 | Very low | 33.6 | Very low | 139 Ų | 139 | 128.9 Ų | 128.9 | 90% | 0.903 | 69% | 0.689 | S | S | * | * | trans | -80 | 113.6 | 177.9 | 31 | -28.4 | 0 | 0 | 0 | 108.7 | ||||
| 138 | G | 25.8 | Very low | 31.5 | Very low | 69 Ų | 69 | 130.5 Ų | 130.5 | 71% | 0.711 | 71% | 0.706 | S | S | * | * | trans | -175.7 | 110.1 | 175.9 | 0 | 0 | 0 | 0 | 0 | 113.7 | T136 | T136-G138 PolarHBondContact O-N 2.72Š| ||
| 139 | N | 25.1 | Very low | 30 | Very low | 169 Ų | 169 | 131.3 Ų | 131.3 | 90% | 0.904 | 72% | 0.718 | S | S | * | * | trans | 52.1 | 105.8 | 163.3 | -77.8 | 11.8 | 0 | 0 | 0 | 120.7 | ||||
| 140 | C | 33.1 | Very low | 29.1 | Very low | 112 Ų | 112 | 136.3 Ų | 136.3 | 76% | 0.757 | 75% | 0.746 | S | S | * | * | trans | -66.4 | 118.5 | 152.6 | -72.4 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 141 | E | 29.2 | Very low | 28.9 | Very low | 186 Ų | 186 | 139.3 Ų | 139.3 | 87% | 0.869 | 76% | 0.76 | S | S | * | * | trans | -170.1 | -6.1 | 144 | -111.2 | 176.6 | 167.6 | 0 | 0 | 115.7 | ||||
| 142 | H | 26.9 | Very low | 29 | Very low | 159 Ų | 159 | 141.7 Ų | 141.7 | 74% | 0.736 | 76% | 0.764 | S | S | * | * | trans | -112.2 | 39.2 | -177.5 | -96.6 | -62.8 | 0 | 0 | 0 | 115.7 | ||||
| 143 | R | 33.8 | Very low | 28.7 | Very low | 205 Ų | 205 | 143.7 Ų | 143.7 | 77% | 0.774 | 77% | 0.768 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.8 | -0.1 | -167.5 | -167.1 | 166.8 | -88.2 | 179.5 | -4.2 | 117.3 | ||
| 144 | T | 30.9 | Very low | 29 | Very low | 145 Ų | 145 | 146.7 Ų | 146.7 | 89% | 0.89 | 77% | 0.772 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -103 | -5 | -177.8 | 34.1 | 0 | 0 | 0 | 0 | 116.1 | ||
| 145 | R | 26.6 | Very low | 29.3 | Very low | 202 Ų | 202 | 145.5 Ų | 145.5 | 76% | 0.762 | 78% | 0.775 | S | S | * | * | S | Bend | trans | -111.5 | -13 | -179.6 | -135.9 | 175 | -74.1 | 133.4 | -4.2 | 115.1 | ||
| 146 | A | 28 | Very low | 29.3 | Very low | 51 Ų | 51 | 150 Ų | 150 | 42% | 0.421 | 79% | 0.785 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -89.1 | -5.9 | -174.7 | 0 | 0 | 0 | 0 | 0 | 115.7 | A148 S149 | A146-A148 VanDerWaalsContact C-N 3.34Å; A146-S149 WeakPolarHBondContact CA-OG 3.2Å; A146-S149 PolarHBondContact O-OG 2.85Å |
| 147 | R | 30.4 | Very low | 29.6 | Very low | 226 Ų | 226 | 146.4 Ų | 146.4 | 85% | 0.853 | 77% | 0.77 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.2 | -20.8 | 174.5 | -85.3 | -176.9 | 175.8 | 142.2 | -2.4 | 113.3 | ||
| 148 | A | 27.4 | Very low | 29.3 | Very low | 97 Ų | 97 | 146.6 Ų | 146.6 | 80% | 0.802 | 77% | 0.772 | S | S | * | * | S | Bend | trans | -88.3 | -12.5 | 175.7 | 0 | 0 | 0 | 0 | 0 | 113.3 | A146 | A146-A148 VanDerWaalsContact C-N 3.34Š|
| 149 | S | 24.8 | Very low | 29.6 | Very low | 78 Ų | 78 | 148.7 Ų | 148.7 | 55% | 0.545 | 78% | 0.775 | S | S | . | * | S | Bend | trans | -106.1 | 12.5 | -176.9 | 60.3 | 0 | 0 | 0 | 0 | 113.9 | A146 M151 | A146-S149 WeakPolarHBondContact CA-OG 3.2Å; A146-S149 PolarHBondContact O-OG 2.85Å; S149-M151 VanDerWaalsContact C-N 3.27Å; S149-M151 PolarHBondContact O-N 3.07Å |
| 150 | L | 30.6 | Very low | 30.4 | Very low | 161 Ų | 161 | 144.3 Ų | 144.3 | 84% | 0.843 | 76% | 0.757 | S | S | * | * | trans | -93.7 | 25 | 176 | -132.6 | 116.6 | 0 | 0 | 0 | 112.7 | ||||
| 151 | M | 33 | Very low | 30.3 | Very low | 164 Ų | 164 | 147 Ų | 147 | 81% | 0.808 | 76% | 0.758 | S | S | * | * | S | Bend | trans | -96.9 | 128.8 | 150.6 | -91.9 | -174.8 | 73.4 | 0 | 0 | 107.5 | S149 | S149-M151 VanDerWaalsContact C-N 3.27Å; S149-M151 PolarHBondContact O-N 3.07Å |
| 152 | M | 30.2 | Very low | 31 | Very low | 158 Ų | 158 | 140 Ų | 140 | 78% | 0.778 | 74% | 0.736 | S | S | * | * | trans | 71.7 | 86.3 | 177.1 | -73.1 | -158 | -90.2 | 0 | 0 | 117.6 | ||||
| 153 | H | 24.7 | Very low | 31.8 | Very low | 198 Ų | 198 | 139.1 Ų | 139.1 | 92% | 0.917 | 74% | 0.736 | S | S | * | * | -135.9 | 100.5 | 127.1 | -100 | -70.9 | 0 | 0 | 0 | 109.6 | C155 | H153-C155 PolarHBondContact O-N 3.15Š| |||
| 154 | L | 31.7 | Very low | 32.4 | Very low | 149 Ų | 149 | 139.7 Ų | 139.7 | 78% | 0.78 | 74% | 0.738 | S | S | * | * | trans | -58.3 | 128.9 | 168.7 | -107 | 72.9 | 0 | 0 | 0 | 109.6 | R156 | L154-R156 PolarHBondContact O-N 3.02Š| ||
| 155 | C | 35.9 | Very low | 33.6 | Very low | 115 Ų | 115 | 138.2 Ų | 138.2 | 78% | 0.777 | 72% | 0.721 | S | S | * | * | trans | -63.7 | 100.5 | 163.3 | -113.2 | 0 | 0 | 0 | 0 | 108.8 | H153 | H153-C155 PolarHBondContact O-N 3.15Š| ||
| 156 | R | 28.4 | Very low | 35.5 | Very low | 253 Ų | 253 | 131.2 Ų | 131.2 | 96% | 0.955 | 70% | 0.695 | S | S | * | * | trans | -105.1 | 73 | 177.8 | -163.2 | 177.2 | -166.5 | 165.1 | 3.1 | 109.1 | L154 | L154-R156 PolarHBondContact O-N 3.02Š| ||
| 157 | G | 31 | Very low | 37.7 | Very low | 38 Ų | 38 | 130.5 Ų | 130.5 | 39% | 0.392 | 68% | 0.684 | S | S | . | * | trans | -133.5 | 146.2 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.2 | S159 | G157-S159 PolarHBondContact O-N 3.45Š| ||
| 158 | P | 29.1 | Very low | 40.1 | Very low | 144 Ų | 144 | 121.7 Ų | 121.7 | 94% | 0.935 | 66% | 0.655 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.8 | 0.7 | -175.5 | 22 | -23.4 | 0 | 0 | 0 | 114.7 | ||
| 159 | S | 30.8 | Very low | 42.6 | Very low | 112 Ų | 112 | 117.3 Ų | 117.3 | 78% | 0.783 | 62% | 0.619 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -113.2 | 28.4 | -177.1 | -39.6 | 0 | 0 | 0 | 0 | 113.4 | G157 H161 | G157-S159 PolarHBondContact O-N 3.45Å; S159-H161 PolarHBondContact O-N 3.47Å |
| 160 | C | 41.9 | Very low | 45.4 | Very low | 77 Ų | 77 | 114.4 Ų | 114.4 | 52% | 0.52 | 60% | 0.597 | S | S | . | * | trans | -91.8 | 93.5 | 174.6 | -81.5 | 0 | 0 | 0 | 0 | 111.4 | G162 | C160-G162 PolarHBondContact O-N 3.41Š| ||
| 161 | H | 32 | Very low | 48.1 | Very low | 168 Ų | 168 | 108.3 Ų | 108.3 | 78% | 0.778 | 56% | 0.564 | S | S | * | * | trans | -72 | 65.4 | 164.6 | -84.2 | -69.1 | 0 | 0 | 0 | 110.9 | S159 H165 | S159-H161 PolarHBondContact O-N 3.47Å; H161-H165 PolarHBondContact O-CE1 3.35Å; H161-H165 PolarHBondContact O-ND1 3.1Å | ||
| 162 | G | 43.4 | Very low | 50.9 | Low | 40 Ų | 40 | 101.1 Ų | 101.1 | 41% | 0.412 | 53% | 0.529 | S | S | . | . | trans | -84.9 | -21.4 | -161.5 | 0 | 0 | 0 | 0 | 0 | 118 | C160 W166 | C160-G162 PolarHBondContact O-N 3.41Å; G162-W166 PolarHBondContact O-NE1 3.47Å | ||
| 163 | L | 42.6 | Very low | 53.8 | Low | 140 Ų | 140 | 93.6 Ų | 93.6 | 73% | 0.733 | 49% | 0.492 | S | S | * | . | S | Bend | trans | -91 | -28.3 | -173 | -84.1 | 106.5 | 0 | 0 | 0 | 115.1 | H165 | L163-H165 PolarHBondContact O-N 3.34Š|
| 164 | R | 46.5 | Very low | 57 | Low | 218 Ų | 218 | 84.5 Ų | 84.5 | 82% | 0.823 | 45% | 0.45 | S | S | * | . | H | α-helix | trans | -78.5 | -16.3 | -172.6 | -154.3 | 174.8 | -176.1 | -172.8 | 1 | 113.9 | T168 | R164-T168 WeakPolarHBondContact O-CG2 3.3Å; R164-T168 PolarHBondContact O-OG1 2.98Å |
| 165 | H | 57.8 | Low | 60 | Low | 113 Ų | 113 | 77.4 Ų | 77.4 | 52% | 0.523 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -87.2 | -17.2 | -171 | -70.5 | 90.3 | 0 | 0 | 0 | 114.8 | H161 L163 T168 S169 | H161-H165 PolarHBondContact O-CE1 3.35Å; H161-H165 PolarHBondContact O-ND1 3.1Å; L163-H165 PolarHBondContact O-N 3.34Å; H165-T168 WeakPolarHBondContact CA-OG1 3.48Å; H165-T168 PolarHBondContact O-OG1 2.85Å; H165-S169 PolarHBondContact O-N 3.45Å; H165-S169 PolarHBondContact O-OG 2.83Å |
| 166 | W | 65.9 | Low | 62.8 | Low | 55 Ų | 55 | 71.9 Ų | 71.9 | 21% | 0.208 | 38% | 0.376 | C | S | . | . | H | α-helix | trans | -98.2 | -38.1 | -173.1 | -58.4 | 112.3 | 0 | 0 | 0 | 113.3 | L74 S75 L130 G162 T168 S169 L170 | L74-W166 HydrophobicContact CD2-CE3 3.84Å; L74-W166 HydrophobicContact CD2-CZ3 4.16Å; S75-W166 VanDerWaalsContact OG-CZ2 3.29Å; S75-W166 WeakPolarHBondContact OG-CZ2 3.42Å; L130-W166 HydrophobicContact CD1-CH2 3.87Å; G162-W166 PolarHBondContact O-NE1 3.47Å; W166-T168 PolarHBondContact O-N 3.16Å; W166-S169 WeakPolarHBondContact O-CB 3.49Å; W166-S169 PolarHBondContact O-N 3.05Å; W166-S169 VanDerWaalsContact O-N 3.08Å; W166-L170 PolarHBondContact O-N 2.91Å |
| 167 | N | 73.4 | Confident | 66 | Low | 37 Ų | 37 | 59.9 Ų | 59.9 | 20% | 0.198 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -58.1 | -38.7 | 168.4 | -80.3 | 3.5 | 0 | 0 | 0 | 111.5 | S80 Y81 S169 L170 Q171 | S80-N167 PolarHBondContact OG-ND2 3.42Å; S80-N167 PolarHBondContact OG-OD1 3.26Å; Y81-N167 WeakPolarHBondContact CE2-OD1 3.47Å; N167-S169 VanDerWaalsContact C-N 3.34Å; N167-L170 PolarHBondContact O-N 2.97Å; N167-Q171 WeakPolarHBondContact O-CB 3.43Å; N167-Q171 WeakPolarHBondContact O-CG 3.38Å; N167-Q171 PolarHBondContact O-N 3.31Å |
| 168 | T | 80.1 | Confident | 69.1 | Low | 41 Ų | 41 | 58.7 Ų | 58.7 | 25% | 0.252 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -67.9 | -34 | 176 | 51.4 | 0 | 0 | 0 | 0 | 112 | R164 H165 W166 Q171 E172 | R164-T168 WeakPolarHBondContact O-CG2 3.3Å; R164-T168 PolarHBondContact O-OG1 2.98Å; H165-T168 WeakPolarHBondContact CA-OG1 3.48Å; H165-T168 PolarHBondContact O-OG1 2.85Å; W166-T168 PolarHBondContact O-N 3.16Å; T168-Q171 PolarHBondContact O-N 2.95Å; T168-E172 WeakPolarHBondContact O-CB 3.25Å; T168-E172 WeakPolarHBondContact O-CG 3.26Å; T168-E172 PolarHBondContact O-N 3.08Å |
| 169 | S | 82 | Confident | 72.4 | Confident | 5 Ų | 5 | 52.8 Ų | 52.8 | 4% | 0.035 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -67.5 | -42.9 | 174.9 | -62 | 0 | 0 | 0 | 0 | 112.1 | K129 H165 W166 N167 E172 V173 | K129-S169 WeakPolarHBondContact CD-OG 3.04Å; K129-S169 PolarHBondContact NZ-OG 3.38Å; H165-S169 PolarHBondContact O-N 3.45Å; H165-S169 PolarHBondContact O-OG 2.83Å; W166-S169 WeakPolarHBondContact O-CB 3.49Å; W166-S169 PolarHBondContact O-N 3.05Å; W166-S169 VanDerWaalsContact O-N 3.08Å; N167-S169 VanDerWaalsContact C-N 3.34Å; S169-E172 PolarHBondContact O-N 3.46Å; S169-V173 WeakPolarHBondContact O-CG2 3.44Å; S169-V173 PolarHBondContact O-N 3.15Å |
| 170 | L | 82.8 | Confident | 75.6 | Confident | 17 Ų | 17 | 47.4 Ų | 47.4 | 9% | 0.089 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -65.8 | -39.9 | 172.6 | -79 | 170.2 | 0 | 0 | 0 | 112.5 | L70 L74 L79 Y81 W166 N167 E172 V173 S174 P380 | L70-L170 HydrophobicContact CD2-CD2 4.16Å; L74-L170 HydrophobicContact CD1-CD1 4.29Å; L74-L170 HydrophobicContact CD1-CD2 4.08Å; L74-L170 HydrophobicContact CD1-CG 4.15Å; L79-L170 HydrophobicContact CD2-CD1 3.5Å; Y81-L170 HydrophobicContact CD2-CD1 3.81Å; Y81-L170 HydrophobicContact CE2-CB 4.5Å; Y81-L170 HydrophobicContact CE2-CD1 3.75Å; W166-L170 PolarHBondContact O-N 2.91Å; N167-L170 PolarHBondContact O-N 2.97Å; L170-E172 VanDerWaalsContact C-N 3.32Å; L170-E172 PolarHBondContact O-N 3.11Å; L170-V173 PolarHBondContact O-N 2.73Å; L170-S174 WeakPolarHBondContact O-CB 3.49Å; L170-S174 PolarHBondContact O-N 2.79Å; L170-P380 HydrophobicContact CD2-CB 4.11Å |
| 171 | Q | 88 | Confident | 78.2 | Confident | 33 Ų | 33 | 43.8 Ų | 43.8 | 15% | 0.154 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -61.9 | -38.8 | 174.2 | -74 | 163.9 | 9.9 | 0 | 0 | 112.2 | N167 T168 S174 G175 N316 L319 | N167-Q171 WeakPolarHBondContact O-CB 3.43Å; N167-Q171 WeakPolarHBondContact O-CG 3.38Å; N167-Q171 PolarHBondContact O-N 3.31Å; T168-Q171 PolarHBondContact O-N 2.95Å; Q171-S174 PolarHBondContact O-N 3.15Å; Q171-G175 PolarHBondContact O-N 3.24Å; Q171-N316 HydrophobicContact CG-CB 4.46Å; Q171-N316 VanDerWaalsContact NE2-CB 3.29Å; Q171-N316 PolarHBondContact NE2-ND2 3.37Å; Q171-N316 VanDerWaalsContact NE2-ND2 3.15Å; Q171-L319 HydrophobicContact CB-CB 3.9Å; Q171-L319 PolarHBondContact O-N 3.42Å |
| 172 | E | 90 | Very high | 81.3 | Confident | 13 Ų | 13 | 40.6 Ų | 40.6 | 6% | 0.061 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -67.5 | -41.8 | 174.9 | -78.5 | -179.3 | -151.5 | 0 | 0 | 112.3 | L125 K129 T168 S169 L170 S174 G175 A176 L319 T321 A324 | L125-E172 HydrophobicContact CD2-CB 4.36Å; K129-E172 WeakPolarHBondContact CE-OE2 3.28Å; K129-E172 IonicContact NZ-OE1 3.08Å; K129-E172 PolarHBondContact NZ-OE1 2.92Å; K129-E172 IonicContact NZ-OE2 3.3Å; K129-E172 PolarHBondContact NZ-OE2 3.27Å; T168-E172 WeakPolarHBondContact O-CB 3.25Å; T168-E172 WeakPolarHBondContact O-CG 3.26Å; T168-E172 PolarHBondContact O-N 3.08Å; S169-E172 PolarHBondContact O-N 3.46Å; L170-E172 VanDerWaalsContact C-N 3.32Å; L170-E172 PolarHBondContact O-N 3.11Å; E172-S174 VanDerWaalsContact C-N 3.35Å; E172-G175 PolarHBondContact O-N 3.32Å; E172-A176 PolarHBondContact O-N 2.54Å; E172-L319 HydrophobicContact CG-CB 4.13Å; E172-L319 HydrophobicContact CG-CD2 3.83Å; E172-L319 HydrophobicContact CG-CG 4.14Å; E172-T321 HydrophobicContact CG-CG2 3.85Å; E172-A324 HydrophobicContact CB-CB 4.43Å; E172-A324 WeakPolarHBondContact O-CB 3.43Å |
| 173 | V | 90.9 | Very high | 83.9 | Confident | 0 Ų | 0 | 41 Ų | 41 | 0% | 0 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -62.5 | -44.5 | 173.8 | 172.1 | 0 | 0 | 0 | 0 | 110.3 | A122 L125 T126 S169 L170 G175 A176 V177 P380 | A122-V173 HydrophobicContact CB-CG1 3.75Å; A122-V173 HydrophobicContact CB-CG2 4.2Å; L125-V173 HydrophobicContact CD2-CG2 4.06Å; T126-V173 HydrophobicContact CG2-CG2 3.81Å; S169-V173 WeakPolarHBondContact O-CG2 3.44Å; S169-V173 PolarHBondContact O-N 3.15Å; L170-V173 PolarHBondContact O-N 2.73Å; V173-G175 VanDerWaalsContact C-N 3.28Å; V173-G175 PolarHBondContact O-N 3.43Å; V173-A176 WeakPolarHBondContact O-CB 3.28Å; V173-A176 PolarHBondContact O-N 3.29Å; V173-A176 VanDerWaalsContact O-N 3.1Å; V173-V177 WeakPolarHBondContact O-CG2 3.49Å; V173-V177 PolarHBondContact O-N 3.48Å; V173-P380 HydrophobicContact CG1-CB 3.94Å; V173-P380 WeakPolarHBondContact CG1-O 2.87Å |
| 174 | S | 91.9 | Very high | 86.4 | Confident | 6 Ų | 6 | 34.4 Ų | 34.4 | 4% | 0.042 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -58.9 | -40.1 | 174.3 | -148.2 | 0 | 0 | 0 | 0 | 111.7 | L170 Q171 E172 V177 V178 G375 G378 | L170-S174 WeakPolarHBondContact O-CB 3.49Å; L170-S174 PolarHBondContact O-N 2.79Å; Q171-S174 PolarHBondContact O-N 3.15Å; E172-S174 VanDerWaalsContact C-N 3.35Å; S174-V177 PolarHBondContact O-N 3.01Å; S174-V178 WeakPolarHBondContact O-CG2 3.28Å; S174-V178 PolarHBondContact O-N 3.19Å; S174-G375 PolarHBondContact OG-O 2.85Å; S174-G378 WeakPolarHBondContact OG-CA 2.94Å |
| 175 | G | 94.5 | Very high | 88.7 | Confident | 0 Ų | 0 | 24.5 Ų | 24.5 | 0% | 0 | 13% | 0.127 | C | C | . | . | H | α-helix | trans | -63.2 | -41.9 | 172.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | Q171 E172 V173 V177 V178 V179 | Q171-G175 PolarHBondContact O-N 3.24Å; E172-G175 PolarHBondContact O-N 3.32Å; V173-G175 VanDerWaalsContact C-N 3.28Å; V173-G175 PolarHBondContact O-N 3.43Å; G175-V177 VanDerWaalsContact C-N 3.31Å; G175-V177 PolarHBondContact O-N 3.31Å; G175-V178 PolarHBondContact O-N 2.72Å; G175-V179 WeakPolarHBondContact O-CG2 3.45Å; G175-V179 PolarHBondContact O-N 3.2Å |
| 176 | A | 95.7 | Very high | 90.4 | Very high | 0 Ų | 0 | 22.2 Ų | 22.2 | 0% | 0 | 12% | 0.121 | C | C | . | . | H | α-helix | trans | -61.4 | -39.6 | 173.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | L125 E172 V173 V179 S180 A324 A327 G328 M331 | L125-A176 HydrophobicContact CD2-CB 4.26Å; E172-A176 PolarHBondContact O-N 2.54Å; V173-A176 WeakPolarHBondContact O-CB 3.28Å; V173-A176 PolarHBondContact O-N 3.29Å; V173-A176 VanDerWaalsContact O-N 3.1Å; A176-V179 PolarHBondContact O-N 3.44Å; A176-S180 WeakPolarHBondContact O-CB 3.43Å; A176-S180 PolarHBondContact O-N 3.47Å; A176-A324 WeakPolarHBondContact CA-O 3.18Å; A176-A324 HydrophobicContact CB-CB 4.3Å; A176-A324 VanDerWaalsContact CB-O 3.25Å; A176-A324 WeakPolarHBondContact CB-O 3.42Å; A176-A327 HydrophobicContact CB-CB 4Å; A176-G328 WeakPolarHBondContact O-CA 3.12Å; A176-M331 HydrophobicContact CB-CE 4Å; A176-M331 HydrophobicContact CB-SD 3.99Å |
| 177 | V | 95.8 | Very high | 91.7 | Very high | 0 Ų | 0 | 21.7 Ų | 21.7 | 0% | 0 | 12% | 0.121 | C | C | . | . | H | α-helix | trans | -64.7 | -42.6 | 175.2 | 173.1 | 0 | 0 | 0 | 0 | 111.6 | F118 V173 S174 G175 S180 G181 M331 S371 A374 P380 | F118-V177 HydrophobicContact CD1-CG2 4.36Å; V173-V177 WeakPolarHBondContact O-CG2 3.49Å; V173-V177 PolarHBondContact O-N 3.48Å; S174-V177 PolarHBondContact O-N 3.01Å; G175-V177 VanDerWaalsContact C-N 3.31Å; G175-V177 PolarHBondContact O-N 3.31Å; V177-S180 WeakPolarHBondContact O-CB 3.46Å; V177-S180 PolarHBondContact O-N 3.22Å; V177-G181 PolarHBondContact O-N 2.84Å; V177-M331 HydrophobicContact CG2-SD 4.21Å; V177-S371 WeakPolarHBondContact CG1-O 3.4Å; V177-A374 HydrophobicContact CG1-CB 4.49Å; V177-P380 WeakPolarHBondContact CG2-O 3.12Å |
| 178 | V | 96.9 | Very high | 92.6 | Very high | 14 Ų | 14 | 19.9 Ų | 19.9 | 9% | 0.085 | 11% | 0.112 | C | C | . | . | H | α-helix | trans | -61.4 | -47.3 | 174.7 | 172.4 | 0 | 0 | 0 | 0 | 111.1 | S174 G175 S180 G181 L182 P318 L376 | S174-V178 WeakPolarHBondContact O-CG2 3.28Å; S174-V178 PolarHBondContact O-N 3.19Å; G175-V178 PolarHBondContact O-N 2.72Å; V178-S180 PolarHBondContact O-N 3.01Å; V178-G181 PolarHBondContact O-N 2.76Å; V178-L182 HydrophobicContact CG1-CD1 4.09Å; V178-L182 HydrophobicContact CG1-CG 4.42Å; V178-L182 WeakPolarHBondContact O-CG 3.44Å; V178-L182 PolarHBondContact O-N 2.74Å; V178-P318 HydrophobicContact CG2-CB 4.28Å; V178-P318 HydrophobicContact CG2-CG 4.05Å; V178-L376 HydrophobicContact CG2-CD2 4.26Å; V178-L376 HydrophobicContact CG2-CG 4.31Å |
| 179 | V | 97.5 | Very high | 93 | Very high | 19 Ų | 19 | 21.2 Ų | 21.2 | 12% | 0.115 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -56.3 | -44.3 | 174.8 | 166.3 | 0 | 0 | 0 | 0 | 110.6 | G175 A176 L182 L183 L320 L325 | G175-V179 WeakPolarHBondContact O-CG2 3.45Å; G175-V179 PolarHBondContact O-N 3.2Å; A176-V179 PolarHBondContact O-N 3.44Å; V179-L182 PolarHBondContact O-N 2.88Å; V179-L183 WeakPolarHBondContact O-CB 3.32Å; V179-L183 PolarHBondContact O-N 3.41Å; V179-L320 HydrophobicContact CG2-CD2 3.67Å; V179-L325 HydrophobicContact CG1-CD1 3.7Å; V179-L325 HydrophobicContact CG2-CD1 4.17Å |
| 180 | S | 97.4 | Very high | 93.4 | Very high | 0 Ų | 0 | 26.6 Ų | 26.6 | 0% | 0 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -60.6 | -47.7 | 179.7 | -178 | 0 | 0 | 0 | 0 | 111.8 | F118 A176 V177 V178 L183 Q184 G328 M331 A332 | F118-S180 WeakPolarHBondContact CE1-OG 3.42Å; A176-S180 WeakPolarHBondContact O-CB 3.43Å; A176-S180 PolarHBondContact O-N 3.47Å; V177-S180 WeakPolarHBondContact O-CB 3.46Å; V177-S180 PolarHBondContact O-N 3.22Å; V178-S180 PolarHBondContact O-N 3.01Å; S180-L183 PolarHBondContact O-N 3.09Å; S180-Q184 WeakPolarHBondContact O-CB 3.44Å; S180-Q184 WeakPolarHBondContact O-CG 3.36Å; S180-Q184 PolarHBondContact O-N 3.47Å; S180-G328 WeakPolarHBondContact CA-O 3.4Å; S180-G328 WeakPolarHBondContact CB-O 3.4Å; S180-M331 WeakPolarHBondContact OG-CB 3.27Å; S180-A332 WeakPolarHBondContact OG-CA 3.49Å; S180-A332 PolarHBondContact OG-N 2.92Å |
| 181 | G | 97.1 | Very high | 93.6 | Very high | 0 Ų | 0 | 26 Ų | 26 | 0% | 0 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -64.2 | -39.4 | 177.8 | 0 | 0 | 0 | 0 | 0 | 113.4 | V177 V178 G185 G368 V372 | V177-G181 PolarHBondContact O-N 2.84Å; V178-G181 PolarHBondContact O-N 2.76Å; G181-G185 PolarHBondContact O-N 3.07Å; G181-G368 CarbonylContact C-O 3.57Å; G181-G368 WeakPolarHBondContact CA-O 3.3Å; G181-G368 CarbonylContact O-C 3.53Å; G181-G368 WeakPolarHBondContact O-CA 3.33Å; G181-V372 VanDerWaalsContact C-CG2 3.49Å |
| 182 | L | 97.6 | Very high | 93.6 | Very high | 101 Ų | 101 | 26 Ų | 26 | 53% | 0.529 | 15% | 0.146 | S | C | . | . | H | α-helix | trans | -63.2 | -42.5 | 173.9 | -71.2 | 173.9 | 0 | 0 | 0 | 111.3 | V178 V179 G185 T186 V372 | V178-L182 HydrophobicContact CG1-CD1 4.09Å; V178-L182 HydrophobicContact CG1-CG 4.42Å; V178-L182 WeakPolarHBondContact O-CG 3.44Å; V178-L182 PolarHBondContact O-N 2.74Å; V179-L182 PolarHBondContact O-N 2.88Å; L182-G185 PolarHBondContact O-N 3.44Å; L182-T186 WeakPolarHBondContact O-CB 3.4Å; L182-T186 VanDerWaalsContact O-CG2 3.27Å; L182-T186 WeakPolarHBondContact O-CG2 3.16Å; L182-T186 PolarHBondContact O-N 3.09Å; L182-T186 PolarHBondContact O-OG1 3.27Å; L182-V372 HydrophobicContact CD2-CG2 3.97Å; L182-V372 HydrophobicContact CG-CG2 3.94Å |
| 183 | L | 96.9 | Very high | 93.4 | Very high | 50 Ų | 50 | 25.6 Ų | 25.6 | 26% | 0.262 | 14% | 0.144 | S | C | . | . | H | α-helix | trans | -68.7 | -43.6 | 179 | -176.3 | 57.1 | 0 | 0 | 0 | 111.9 | V179 S180 T186 M187 I329 A332 | V179-L183 WeakPolarHBondContact O-CB 3.32Å; V179-L183 PolarHBondContact O-N 3.41Å; S180-L183 PolarHBondContact O-N 3.09Å; L183-T186 WeakPolarHBondContact CA-OG1 3.44Å; L183-T186 PolarHBondContact O-N 3.2Å; L183-T186 PolarHBondContact O-OG1 2.88Å; L183-M187 HydrophobicContact CD1-CG 4.31Å; L183-M187 HydrophobicContact CD1-SD 4.4Å; L183-M187 HydrophobicContact CG-SD 4.14Å; L183-M187 WeakPolarHBondContact O-CB 3.34Å; L183-M187 WeakPolarHBondContact O-CG 3.14Å; L183-M187 PolarHBondContact O-N 3.42Å; L183-I329 HydrophobicContact CD2-CB 4.23Å; L183-I329 HydrophobicContact CD2-CG1 4.03Å; L183-I329 HydrophobicContact CD2-CG2 4.13Å; L183-A332 HydrophobicContact CB-CB 3.87Å; L183-A332 HydrophobicContact CD2-CB 3.66Å; L183-A332 HydrophobicContact CG-CB 3.88Å |
| 184 | Q | 95.6 | Very high | 92.9 | Very high | 0 Ų | 0 | 26 Ų | 26 | 0% | 0 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -61.4 | -44.6 | 172.9 | -74.3 | 175.5 | -8.1 | 0 | 0 | 112 | S180 M187 G188 A332 A335 L364 | S180-Q184 WeakPolarHBondContact O-CB 3.44Å; S180-Q184 WeakPolarHBondContact O-CG 3.36Å; S180-Q184 PolarHBondContact O-N 3.47Å; Q184-M187 PolarHBondContact O-N 3.33Å; Q184-G188 PolarHBondContact O-N 2.88Å; Q184-A332 HydrophobicContact CG-CB 4.02Å; Q184-A332 PolarHBondContact NE2-O 3.18Å; Q184-A335 VanDerWaalsContact NE2-CB 3.25Å; Q184-L364 HydrophobicContact CB-CD1 4.47Å; Q184-L364 HydrophobicContact CB-CG 4.4Å; Q184-L364 HydrophobicContact CG-CD1 4.4Å |
| 185 | G | 94.7 | Very high | 92.6 | Very high | 11 Ų | 11 | 34 Ų | 34 | 11% | 0.113 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -53.4 | -57.3 | 174.6 | 0 | 0 | 0 | 0 | 0 | 110.8 | G181 L182 M187 G188 L189 | G181-G185 PolarHBondContact O-N 3.07Å; L182-G185 PolarHBondContact O-N 3.44Å; G185-M187 PolarHBondContact O-N 2.89Å; G185-G188 PolarHBondContact O-N 3.18Å; G185-L189 VanDerWaalsContact O-CG 3.26Å; G185-L189 WeakPolarHBondContact O-CG 3.44Å; G185-L189 PolarHBondContact O-N 2.74Å |
| 186 | T | 93.6 | Very high | 92.2 | Very high | 65 Ų | 65 | 37.2 Ų | 37.2 | 40% | 0.399 | 20% | 0.197 | S | C | . | . | H | α-helix | trans | -60.8 | -44.8 | 179.1 | 52.8 | 0 | 0 | 0 | 0 | 112.3 | L182 L183 G188 L189 L190 | L182-T186 WeakPolarHBondContact O-CB 3.4Å; L182-T186 VanDerWaalsContact O-CG2 3.27Å; L182-T186 WeakPolarHBondContact O-CG2 3.16Å; L182-T186 PolarHBondContact O-N 3.09Å; L182-T186 PolarHBondContact O-OG1 3.27Å; L183-T186 WeakPolarHBondContact CA-OG1 3.44Å; L183-T186 PolarHBondContact O-N 3.2Å; L183-T186 PolarHBondContact O-OG1 2.88Å; T186-G188 VanDerWaalsContact C-N 3.33Å; T186-G188 PolarHBondContact O-N 3.09Å; T186-L189 PolarHBondContact O-N 2.88Å; T186-L190 WeakPolarHBondContact O-CB 3.5Å; T186-L190 WeakPolarHBondContact O-CD1 3.41Å; T186-L190 PolarHBondContact O-N 2.91Å |
| 187 | M | 93.1 | Very high | 91.6 | Very high | 43 Ų | 43 | 38.1 Ų | 38.1 | 21% | 0.212 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -55.6 | -47.1 | 174.4 | -76.9 | 176.1 | 66.6 | 0 | 0 | 112.1 | L183 Q184 G185 L190 G191 S192 P193 L333 L364 | L183-M187 HydrophobicContact CD1-CG 4.31Å; L183-M187 HydrophobicContact CD1-SD 4.4Å; L183-M187 HydrophobicContact CG-SD 4.14Å; L183-M187 WeakPolarHBondContact O-CB 3.34Å; L183-M187 WeakPolarHBondContact O-CG 3.14Å; L183-M187 PolarHBondContact O-N 3.42Å; Q184-M187 PolarHBondContact O-N 3.33Å; G185-M187 PolarHBondContact O-N 2.89Å; M187-L190 PolarHBondContact O-N 3.2Å; M187-G191 PolarHBondContact O-N 3.17Å; M187-S192 WeakPolarHBondContact CB-OG 3.27Å; M187-S192 PolarHBondContact O-N 3.2Å; M187-S192 VanDerWaalsContact O-N 3.1Å; M187-S192 PolarHBondContact O-OG 2.95Å; M187-P193 WeakPolarHBondContact O-CD 3.44Å; M187-L333 HydrophobicContact CE-CD2 4.33Å; M187-L333 HydrophobicContact SD-CD2 4.35Å; M187-L364 HydrophobicContact CB-CD2 4.24Å |
| 188 | G | 91.7 | Very high | 90.9 | Very high | 0 Ų | 0 | 41.5 Ų | 41.5 | 0% | 0 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -61.7 | -47.2 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | Q184 G185 T186 L190 G191 S361 | Q184-G188 PolarHBondContact O-N 2.88Å; G185-G188 PolarHBondContact O-N 3.18Å; T186-G188 VanDerWaalsContact C-N 3.33Å; T186-G188 PolarHBondContact O-N 3.09Å; G188-L190 VanDerWaalsContact C-N 3.34Å; G188-L190 PolarHBondContact O-N 3.29Å; G188-G191 PolarHBondContact O-N 3.26Å; G188-G191 VanDerWaalsContact O-N 3.11Å; G188-S361 CarbonylContact C-O 3.6Å; G188-S361 VanDerWaalsContact CA-O 3.23Å; G188-S361 WeakPolarHBondContact CA-O 3.48Å; G188-S361 WeakPolarHBondContact O-CB 3.36Å |
| 189 | L | 90.1 | Very high | 90.4 | Very high | 68 Ų | 68 | 45.9 Ų | 45.9 | 36% | 0.356 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -62.2 | -38.8 | 177.9 | -64.8 | 178.7 | 0 | 0 | 0 | 112.3 | G185 T186 G191 L572 L575 | G185-L189 VanDerWaalsContact O-CG 3.26Å; G185-L189 WeakPolarHBondContact O-CG 3.44Å; G185-L189 PolarHBondContact O-N 2.74Å; T186-L189 PolarHBondContact O-N 2.88Å; L189-G191 PolarHBondContact O-N 3.15Å; L189-L572 HydrophobicContact CB-CD2 3.91Å; L189-L572 HydrophobicContact CD1-CD2 4.37Å; L189-L572 HydrophobicContact CD2-CD2 3.76Å; L189-L572 HydrophobicContact CG-CD2 4.19Å; L189-L575 HydrophobicContact CD2-CD1 3.66Å |
| 190 | L | 90.4 | Very high | 89.8 | Confident | 119 Ų | 119 | 46.1 Ų | 46.1 | 62% | 0.623 | 25% | 0.245 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -71.8 | -6.1 | 177.4 | -92 | 75.4 | 0 | 0 | 0 | 113.6 | T186 M187 G188 S192 | T186-L190 WeakPolarHBondContact O-CB 3.5Å; T186-L190 WeakPolarHBondContact O-CD1 3.41Å; T186-L190 PolarHBondContact O-N 2.91Å; M187-L190 PolarHBondContact O-N 3.2Å; G188-L190 VanDerWaalsContact C-N 3.34Å; G188-L190 PolarHBondContact O-N 3.29Å; L190-S192 VanDerWaalsContact C-N 3.28Å; L190-S192 PolarHBondContact O-N 3.48Å |
| 191 | G | 86.4 | Confident | 89.3 | Confident | 3 Ų | 3 | 46.2 Ų | 46.2 | 3% | 0.031 | 25% | 0.246 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 76.2 | 12.4 | -177.9 | 0 | 0 | 0 | 0 | 0 | 114.1 | M187 G188 L189 P193 G194 R195 S361 | M187-G191 PolarHBondContact O-N 3.17Å; G188-G191 PolarHBondContact O-N 3.26Å; G188-G191 VanDerWaalsContact O-N 3.11Å; L189-G191 PolarHBondContact O-N 3.15Å; G191-P193 VanDerWaalsContact C-CD 3.49Å; G191-G194 PolarHBondContact O-N 3.46Å; G191-R195 PolarHBondContact O-N 3.29Å; G191-S361 VanDerWaalsContact CA-OG 3.31Å; G191-S361 WeakPolarHBondContact CA-OG 3.35Å |
| 192 | S | 88.9 | Confident | 89 | Confident | 34 Ų | 34 | 46.8 Ų | 46.8 | 24% | 0.238 | 25% | 0.25 | C | C | . | . | H | α-helix | trans | -60.7 | -40.5 | -174.9 | 78.9 | 0 | 0 | 0 | 0 | 113.5 | M187 L190 G194 R195 V196 | M187-S192 WeakPolarHBondContact CB-OG 3.27Å; M187-S192 PolarHBondContact O-N 3.2Å; M187-S192 VanDerWaalsContact O-N 3.1Å; M187-S192 PolarHBondContact O-OG 2.95Å; L190-S192 VanDerWaalsContact C-N 3.28Å; L190-S192 PolarHBondContact O-N 3.48Å; S192-G194 VanDerWaalsContact C-N 3.32Å; S192-G194 PolarHBondContact O-N 3.07Å; S192-R195 PolarHBondContact O-N 2.88Å; S192-R195 VanDerWaalsContact O-N 3.17Å; S192-V196 WeakPolarHBondContact O-CG2 3.48Å; S192-V196 PolarHBondContact O-N 3.38Å; S192-V196 VanDerWaalsContact O-N 3.07Å |
| 193 | P | 85.4 | Confident | 88.7 | Confident | 4 Ų | 4 | 42 Ų | 42 | 3% | 0.026 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -65.3 | -38 | 177.3 | -19.9 | 34.3 | 0 | 0 | 0 | 111.6 | M187 G191 R195 V196 F197 L340 C360 L364 | M187-P193 WeakPolarHBondContact O-CD 3.44Å; G191-P193 VanDerWaalsContact C-CD 3.49Å; P193-R195 PolarHBondContact O-N 3.01Å; P193-V196 PolarHBondContact O-N 2.87Å; P193-F197 WeakPolarHBondContact O-CB 3.34Å; P193-F197 PolarHBondContact O-N 3.48Å; P193-L340 HydrophobicContact CB-CD1 4.24Å; P193-L340 HydrophobicContact CB-CD2 4Å; P193-C360 HydrophobicContact CB-CB 4.26Å; P193-L364 HydrophobicContact CB-CD2 4.38Å; P193-L364 HydrophobicContact CG-CB 4.08Å; P193-L364 HydrophobicContact CG-CD2 3.33Å; P193-L364 HydrophobicContact CG-CG 4.34Å |
| 194 | G | 80.1 | Confident | 88.6 | Confident | 9 Ų | 9 | 39.8 Ų | 39.8 | 9% | 0.093 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -63.7 | -26 | 176.5 | 0 | 0 | 0 | 0 | 0 | 114.2 | G191 S192 P198 P357 S361 | G191-G194 PolarHBondContact O-N 3.46Å; S192-G194 VanDerWaalsContact C-N 3.32Å; S192-G194 PolarHBondContact O-N 3.07Å; G194-P198 WeakPolarHBondContact O-CD 3.33Å; G194-P198 VanDerWaalsContact O-CG 3.29Å; G194-P198 WeakPolarHBondContact O-CG 3.49Å; G194-P357 WeakPolarHBondContact O-CB 3.39Å; G194-S361 PolarHBondContact N-OG 3.35Å |
| 195 | R | 84.8 | Confident | 88.5 | Confident | 173 Ų | 173 | 41.4 Ų | 41.4 | 65% | 0.653 | 22% | 0.222 | S | C | * | . | H | α-helix | trans | -83.9 | -38.7 | 175 | -64.5 | 179.2 | -172 | 170.3 | 3.9 | 112.6 | G191 S192 P193 H199 | G191-R195 PolarHBondContact O-N 3.29Å; S192-R195 PolarHBondContact O-N 2.88Å; S192-R195 VanDerWaalsContact O-N 3.17Å; P193-R195 PolarHBondContact O-N 3.01Å; R195-H199 PolarHBondContact O-CE1 3.33Å; R195-H199 PolarHBondContact O-ND1 3.15Å |
| 196 | V | 85.9 | Confident | 88.4 | Confident | 68 Ų | 68 | 40.9 Ų | 40.9 | 41% | 0.412 | 22% | 0.216 | S | C | . | . | H | α-helix | trans | -80.1 | -43.2 | -176.6 | 176.9 | 0 | 0 | 0 | 0 | 111.6 | S192 P193 H199 C200 F513 | S192-V196 WeakPolarHBondContact O-CG2 3.48Å; S192-V196 PolarHBondContact O-N 3.38Å; S192-V196 VanDerWaalsContact O-N 3.07Å; P193-V196 PolarHBondContact O-N 2.87Å; V196-H199 WeakPolarHBondContact O-CA 3.28Å; V196-H199 WeakPolarHBondContact O-CB 3.47Å; V196-H199 PolarHBondContact O-N 3.07Å; V196-C200 PolarHBondContact O-N 3.29Å; V196-F513 HydrophobicContact CG1-CE2 4.18Å |
| 197 | F | 84.4 | Confident | 88.5 | Confident | 19 Ų | 19 | 37.8 Ų | 37.8 | 8% | 0.083 | 20% | 0.197 | C | C | . | . | G | 310 helix | trans | -57.9 | -38.7 | -172 | -172.8 | -101.9 | 0 | 0 | 0 | 114.9 | P193 H199 C200 L205 L340 A344 P355 | P193-F197 WeakPolarHBondContact O-CB 3.34Å; P193-F197 PolarHBondContact O-N 3.48Å; F197-H199 PolarHBondContact O-N 3.46Å; F197-C200 WeakPolarHBondContact O-CB 3.36Å; F197-C200 PolarHBondContact O-N 3.04Å; F197-L205 HydrophobicContact CE2-CD2 4.4Å; F197-L340 HydrophobicContact CD2-CB 4.06Å; F197-L340 HydrophobicContact CD2-CD1 4.49Å; F197-L340 HydrophobicContact CD2-CD2 4.01Å; F197-L340 HydrophobicContact CD2-CG 4.41Å; F197-L340 HydrophobicContact CE2-CB 4.26Å; F197-A344 HydrophobicContact CE2-CB 4.14Å; F197-A344 HydrophobicContact CZ-CB 3.89Å; F197-P355 HydrophobicContact CE1-CG 3.64Å; F197-P355 HydrophobicContact CZ-CG 3.74Å |
| 198 | P | 81.5 | Confident | 88.7 | Confident | 72 Ų | 72 | 36.1 Ų | 36.1 | 47% | 0.468 | 19% | 0.19 | S | C | . | . | G | 310 helix | trans | -60.9 | -23.5 | 174 | -25.3 | 36 | 0 | 0 | 0 | 114.3 | G194 P357 | G194-P198 WeakPolarHBondContact O-CD 3.33Å; G194-P198 VanDerWaalsContact O-CG 3.29Å; G194-P198 WeakPolarHBondContact O-CG 3.49Å; P198-P357 HydrophobicContact CG-CG 4.18Å |
| 199 | H | 84.4 | Confident | 88.8 | Confident | 106 Ų | 106 | 36.3 Ų | 36.3 | 49% | 0.491 | 19% | 0.191 | S | C | . | . | G | 310 helix | trans | -88.3 | -5.5 | 176.5 | -57.9 | 87.4 | 0 | 0 | 0 | 112.4 | R195 V196 F197 G201 F513 | R195-H199 PolarHBondContact O-CE1 3.33Å; R195-H199 PolarHBondContact O-ND1 3.15Å; V196-H199 WeakPolarHBondContact O-CA 3.28Å; V196-H199 WeakPolarHBondContact O-CB 3.47Å; V196-H199 PolarHBondContact O-N 3.07Å; F197-H199 PolarHBondContact O-N 3.46Å; H199-G201 PolarHBondContact O-N 3.43Å; H199-F513 HydrophobicContact CB-CE2 3.89Å |
| 200 | C | 86.4 | Confident | 89.1 | Confident | 23 Ų | 23 | 33.1 Ų | 33.1 | 16% | 0.155 | 17% | 0.174 | C | C | . | . | trans | -87.6 | 81.2 | 174.5 | -62.4 | 0 | 0 | 0 | 0 | 109.9 | V196 F197 V204 L205 | V196-C200 PolarHBondContact O-N 3.29Å; F197-C200 WeakPolarHBondContact O-CB 3.36Å; F197-C200 PolarHBondContact O-N 3.04Å; C200-V204 HydrophobicContact CB-CB 4.36Å; C200-V204 HydrophobicContact CB-CG1 4.36Å; C200-L205 HydrophobicContact CB-CD2 4.42Å; C200-L205 HydrophobicContact CB-CG 4.45Å; C200-L205 WeakPolarHBondContact O-CD1 3.48Å | ||
| 201 | G | 87.1 | Confident | 89.4 | Confident | 2 Ų | 2 | 27.5 Ų | 27.5 | 2% | 0.021 | 15% | 0.145 | C | C | . | . | trans | -66.1 | 178 | 175.2 | 0 | 0 | 0 | 0 | 0 | 114 | H199 L203 V204 L205 | H199-G201 PolarHBondContact O-N 3.43Å; G201-L203 PolarHBondContact O-N 2.8Å; G201-L203 VanDerWaalsContact O-N 3.13Å; G201-V204 PolarHBondContact O-N 2.66Å; G201-L205 PolarHBondContact O-N 3.37Å; G201-L205 VanDerWaalsContact O-N 3.15Å | ||
| 202 | P | 90.3 | Very high | 89.8 | Confident | 12 Ų | 12 | 27.4 Ų | 27.4 | 8% | 0.078 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -52.1 | -35.2 | 176.4 | -26.5 | 33.9 | 0 | 0 | 0 | 113.6 | V204 L205 A206 L453 A454 R526 | P202-V204 PolarHBondContact O-N 3.33Å; P202-L205 PolarHBondContact O-N 3.13Å; P202-A206 WeakPolarHBondContact O-CB 3.42Å; P202-A206 PolarHBondContact O-N 3.29Å; P202-L453 HydrophobicContact CB-CB 4.01Å; P202-L453 HydrophobicContact CG-CB 3.78Å; P202-L453 HydrophobicContact CG-CD1 4.26Å; P202-A454 HydrophobicContact CB-CB 4.39Å; P202-R526 WeakPolarHBondContact CD-O 3.3Å |
| 203 | L | 91.9 | Very high | 89.9 | Confident | 0 Ų | 0 | 26.2 Ų | 26.2 | 0% | 0 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -72.1 | -13 | -179.8 | -63.8 | 168.4 | 0 | 0 | 0 | 114.1 | G201 P207 A454 N461 I464 V465 E516 | G201-L203 PolarHBondContact O-N 2.8Å; G201-L203 VanDerWaalsContact O-N 3.13Å; L203-P207 WeakPolarHBondContact O-CD 3.46Å; L203-P207 WeakPolarHBondContact O-CG 3.3Å; L203-A454 HydrophobicContact CD1-CB 4.36Å; L203-A454 HydrophobicContact CD2-CB 3.95Å; L203-A454 HydrophobicContact CG-CB 4.02Å; L203-N461 HydrophobicContact CD1-CB 4.28Å; L203-N461 VanDerWaalsContact CD1-CG 3.45Å; L203-N461 WeakPolarHBondContact CD1-OD1 3.19Å; L203-N461 HydrophobicContact CD2-CB 4Å; L203-I464 HydrophobicContact CB-CG2 4.48Å; L203-V465 HydrophobicContact CD2-CG2 3.74Å; L203-E516 HydrophobicContact CB-CG 4.48Å; L203-E516 WeakPolarHBondContact CB-OE2 3.14Å; L203-E516 WeakPolarHBondContact CD1-OE2 3.25Å |
| 204 | V | 93.9 | Very high | 90.3 | Very high | 5 Ų | 5 | 28.9 Ų | 28.9 | 3% | 0.03 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -95.3 | -45.5 | 171.3 | -175.2 | 0 | 0 | 0 | 0 | 110.4 | C200 G201 P202 S208 G509 F513 E516 | C200-V204 HydrophobicContact CB-CB 4.36Å; C200-V204 HydrophobicContact CB-CG1 4.36Å; G201-V204 PolarHBondContact O-N 2.66Å; P202-V204 PolarHBondContact O-N 3.33Å; V204-S208 WeakPolarHBondContact O-CB 3.08Å; V204-S208 PolarHBondContact O-N 2.91Å; V204-S208 PolarHBondContact O-OG 3.25Å; V204-G509 WeakPolarHBondContact CG1-O 3.48Å; V204-F513 HydrophobicContact CG1-CB 4.05Å; V204-F513 HydrophobicContact CG2-CB 4.35Å; V204-E516 HydrophobicContact CG2-CB 3.97Å; V204-E516 HydrophobicContact CG2-CG 4.16Å |
| 205 | L | 92.6 | Very high | 90.8 | Very high | 33 Ų | 33 | 29.7 Ų | 29.7 | 17% | 0.173 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -69.8 | -44.9 | -175.9 | -66.4 | 172.3 | 0 | 0 | 0 | 111.7 | F197 C200 G201 P202 S208 L209 A344 | F197-L205 HydrophobicContact CE2-CD2 4.4Å; C200-L205 HydrophobicContact CB-CD2 4.42Å; C200-L205 HydrophobicContact CB-CG 4.45Å; C200-L205 WeakPolarHBondContact O-CD1 3.48Å; G201-L205 PolarHBondContact O-N 3.37Å; G201-L205 VanDerWaalsContact O-N 3.15Å; P202-L205 PolarHBondContact O-N 3.13Å; L205-S208 WeakPolarHBondContact O-CB 3.47Å; L205-S208 PolarHBondContact O-N 3.47Å; L205-L209 VanDerWaalsContact O-CG 3.3Å; L205-L209 WeakPolarHBondContact O-CG 3Å; L205-L209 PolarHBondContact O-N 2.76Å; L205-A344 HydrophobicContact CD1-CB 3.96Å; L205-A344 HydrophobicContact CD2-CB 4.15Å |
| 206 | A | 94.1 | Very high | 90.9 | Very high | 0 Ų | 0 | 21.7 Ų | 21.7 | 0% | 0 | 13% | 0.126 | C | C | . | . | H | α-helix | trans | -63.5 | -49 | -175.1 | 0 | 0 | 0 | 0 | 0 | 113.1 | P202 S208 L209 V210 S450 F451 | P202-A206 WeakPolarHBondContact O-CB 3.42Å; P202-A206 PolarHBondContact O-N 3.29Å; A206-S208 VanDerWaalsContact C-N 3.3Å; A206-S208 PolarHBondContact O-N 3.36Å; A206-L209 PolarHBondContact O-N 3.01Å; A206-V210 WeakPolarHBondContact O-CG2 3.41Å; A206-V210 PolarHBondContact O-N 3.29Å; A206-S450 VanDerWaalsContact CB-CB 3.46Å; A206-F451 HydrophobicContact CB-CD1 3.48Å; A206-F451 VanDerWaalsContact CB-CD1 3.48Å; A206-F451 HydrophobicContact CB-CE1 3.2Å; A206-F451 HydrophobicContact CB-CE2 4.29Å; A206-F451 HydrophobicContact CB-CG 4.13Å; A206-F451 HydrophobicContact CB-CZ 3.63Å |
| 207 | P | 96.1 | Very high | 91 | Very high | 0 Ų | 0 | 24.7 Ų | 24.7 | 0% | 0 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -59 | -39.7 | 173.1 | -28.4 | 40.2 | 0 | 0 | 0 | 113.1 | L203 L209 V210 V211 F451 V465 I469 | L203-P207 WeakPolarHBondContact O-CD 3.46Å; L203-P207 WeakPolarHBondContact O-CG 3.3Å; P207-L209 VanDerWaalsContact C-N 3.34Å; P207-L209 PolarHBondContact O-N 3.11Å; P207-V210 PolarHBondContact O-N 3.27Å; P207-V211 WeakPolarHBondContact O-CB 3.48Å; P207-V211 VanDerWaalsContact O-CG2 3.31Å; P207-V211 WeakPolarHBondContact O-CG2 3.37Å; P207-V211 PolarHBondContact O-N 2.94Å; P207-F451 HydrophobicContact CG-CE1 4.04Å; P207-F451 HydrophobicContact CG-CZ 4.25Å; P207-V465 HydrophobicContact CG-CG1 4.45Å; P207-V465 HydrophobicContact CG-CG2 4.24Å; P207-I469 HydrophobicContact CB-CD1 4.47Å; P207-I469 HydrophobicContact CB-CG1 3.84Å |
| 208 | S | 95.5 | Very high | 91.1 | Very high | 8 Ų | 8 | 30.1 Ų | 30.1 | 6% | 0.056 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -61.7 | -42.1 | 178.7 | -57.6 | 0 | 0 | 0 | 0 | 111.9 | V204 L205 A206 A212 G509 | V204-S208 WeakPolarHBondContact O-CB 3.08Å; V204-S208 PolarHBondContact O-N 2.91Å; V204-S208 PolarHBondContact O-OG 3.25Å; L205-S208 WeakPolarHBondContact O-CB 3.47Å; L205-S208 PolarHBondContact O-N 3.47Å; A206-S208 VanDerWaalsContact C-N 3.3Å; A206-S208 PolarHBondContact O-N 3.36Å; S208-A212 WeakPolarHBondContact O-CB 3.31Å; S208-A212 PolarHBondContact O-N 3.43Å; S208-G509 WeakPolarHBondContact OG-CA 3.46Å; S208-G509 PolarHBondContact OG-N 3.19Å |
| 209 | L | 95 | Very high | 91.2 | Very high | 4 Ų | 4 | 28.1 Ų | 28.1 | 2% | 0.021 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -69.1 | -41 | 176.4 | -67.2 | 178.5 | 0 | 0 | 0 | 112.6 | L205 A206 P207 V211 A212 G213 L345 F387 V443 | L205-L209 VanDerWaalsContact O-CG 3.3Å; L205-L209 WeakPolarHBondContact O-CG 3Å; L205-L209 PolarHBondContact O-N 2.76Å; A206-L209 PolarHBondContact O-N 3.01Å; P207-L209 VanDerWaalsContact C-N 3.34Å; P207-L209 PolarHBondContact O-N 3.11Å; L209-V211 VanDerWaalsContact C-N 3.33Å; L209-V211 PolarHBondContact O-N 2.84Å; L209-A212 WeakPolarHBondContact O-CB 3.18Å; L209-A212 PolarHBondContact O-N 3.45Å; L209-G213 PolarHBondContact O-N 3.02Å; L209-G213 VanDerWaalsContact O-N 3.08Å; L209-L345 HydrophobicContact CD1-CB 4.39Å; L209-L345 HydrophobicContact CD1-CD1 4.15Å; L209-L345 HydrophobicContact CD2-CB 4.16Å; L209-L345 HydrophobicContact CD2-CD2 4.07Å; L209-F387 HydrophobicContact CD2-CD1 4.25Å; L209-F387 HydrophobicContact CD2-CE1 3.35Å; L209-F387 HydrophobicContact CD2-CZ 3.94Å; L209-V443 HydrophobicContact CD2-CG1 4.45Å |
| 210 | V | 96.8 | Very high | 91.4 | Very high | 2 Ų | 2 | 24.2 Ų | 24.2 | 1% | 0.012 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -59.7 | -47.1 | 174.6 | 167.2 | 0 | 0 | 0 | 0 | 110.3 | A206 P207 G213 L214 L444 F448 F451 I469 | A206-V210 WeakPolarHBondContact O-CG2 3.41Å; A206-V210 PolarHBondContact O-N 3.29Å; P207-V210 PolarHBondContact O-N 3.27Å; V210-G213 PolarHBondContact O-N 3.45Å; V210-L214 HydrophobicContact CG1-CD1 3.76Å; V210-L214 HydrophobicContact CG1-CG 4.42Å; V210-L214 WeakPolarHBondContact O-CB 3.13Å; V210-L214 WeakPolarHBondContact O-CG 3.22Å; V210-L214 PolarHBondContact O-N 3.39Å; V210-L444 HydrophobicContact CB-CD1 4.03Å; V210-L444 HydrophobicContact CG1-CD1 3.67Å; V210-L444 HydrophobicContact CG2-CD1 4.16Å; V210-L444 WeakPolarHBondContact O-CD1 3.34Å; V210-F448 HydrophobicContact CG1-CE1 4.05Å; V210-F448 HydrophobicContact CG1-CZ 4.29Å; V210-F448 HydrophobicContact CG2-CD1 3.77Å; V210-F448 HydrophobicContact CG2-CE1 3.74Å; V210-F448 HydrophobicContact CG2-CG 4.43Å; V210-F448 HydrophobicContact CG2-CZ 4.41Å; V210-F451 HydrophobicContact CG2-CE2 4Å; V210-F451 HydrophobicContact CG2-CZ 4.26Å; V210-I469 HydrophobicContact CB-CD1 4.27Å; V210-I469 HydrophobicContact CG1-CD1 3.86Å; V210-I469 HydrophobicContact CG1-CG1 4.3Å; V210-I469 HydrophobicContact CG1-CG2 4.29Å |
| 211 | V | 96.5 | Very high | 91.6 | Very high | 0 Ų | 0 | 25.2 Ų | 25.2 | 0% | 0 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -68.2 | -36 | 177.9 | 171.4 | 0 | 0 | 0 | 0 | 111.7 | P207 L209 G213 L214 S215 I469 A472 L473 P504 A508 | P207-V211 WeakPolarHBondContact O-CB 3.48Å; P207-V211 VanDerWaalsContact O-CG2 3.31Å; P207-V211 WeakPolarHBondContact O-CG2 3.37Å; P207-V211 PolarHBondContact O-N 2.94Å; L209-V211 VanDerWaalsContact C-N 3.33Å; L209-V211 PolarHBondContact O-N 2.84Å; V211-G213 VanDerWaalsContact C-N 3.34Å; V211-G213 PolarHBondContact O-N 3.09Å; V211-L214 PolarHBondContact O-N 2.85Å; V211-S215 WeakPolarHBondContact O-CB 3.5Å; V211-S215 PolarHBondContact O-N 3.48Å; V211-S215 PolarHBondContact O-OG 2.98Å; V211-I469 HydrophobicContact CG2-CB 4.3Å; V211-I469 HydrophobicContact CG2-CG1 4.29Å; V211-I469 HydrophobicContact CG2-CG2 4.08Å; V211-A472 HydrophobicContact CG1-CB 4.05Å; V211-A472 HydrophobicContact CG2-CB 3.94Å; V211-L473 HydrophobicContact CG1-CD2 4.26Å; V211-P504 HydrophobicContact CG1-CB 3.65Å; V211-A508 HydrophobicContact CB-CB 3.9Å; V211-A508 HydrophobicContact CG1-CB 4.17Å; V211-A508 HydrophobicContact CG2-CB 3.85Å |
| 212 | A | 93.3 | Very high | 91.6 | Very high | 2 Ų | 2 | 30 Ų | 30 | 2% | 0.017 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -56.9 | -48.1 | 174.1 | 0 | 0 | 0 | 0 | 0 | 111.4 | S208 L209 S215 F387 V443 I505 | S208-A212 WeakPolarHBondContact O-CB 3.31Å; S208-A212 PolarHBondContact O-N 3.43Å; L209-A212 WeakPolarHBondContact O-CB 3.18Å; L209-A212 PolarHBondContact O-N 3.45Å; A212-S215 PolarHBondContact O-OG 3.05Å; A212-S215 VanDerWaalsContact O-OG 3.13Å; A212-F387 HydrophobicContact CB-CD2 3.92Å; A212-F387 HydrophobicContact CB-CE2 3.77Å; A212-F387 HydrophobicContact CB-CG 4.33Å; A212-F387 HydrophobicContact CB-CZ 4.11Å; A212-V443 HydrophobicContact CB-CG1 4.39Å; A212-I505 HydrophobicContact CB-CD1 3.7Å; A212-I505 HydrophobicContact CB-CG1 3.88Å |
| 213 | G | 92.2 | Very high | 91.4 | Very high | 8 Ų | 8 | 29.8 Ų | 29.8 | 8% | 0.082 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -69.1 | -43.3 | 176.8 | 0 | 0 | 0 | 0 | 0 | 113.7 | L209 V210 V211 | L209-G213 PolarHBondContact O-N 3.02Å; L209-G213 VanDerWaalsContact O-N 3.08Å; V210-G213 PolarHBondContact O-N 3.45Å; V211-G213 VanDerWaalsContact C-N 3.34Å; V211-G213 PolarHBondContact O-N 3.09Å |
| 214 | L | 93.6 | Very high | 91.4 | Very high | 60 Ų | 60 | 30 Ų | 30 | 31% | 0.314 | 15% | 0.154 | S | C | . | . | H | α-helix | trans | -69.4 | -35.9 | -179.8 | -73.8 | 175 | 0 | 0 | 0 | 112.8 | V210 V211 A216 H217 L444 L473 | V210-L214 HydrophobicContact CG1-CD1 3.76Å; V210-L214 HydrophobicContact CG1-CG 4.42Å; V210-L214 WeakPolarHBondContact O-CB 3.13Å; V210-L214 WeakPolarHBondContact O-CG 3.22Å; V210-L214 PolarHBondContact O-N 3.39Å; V211-L214 PolarHBondContact O-N 2.85Å; L214-A216 PolarHBondContact O-N 3.07Å; L214-H217 WeakPolarHBondContact O-CB 2.98Å; L214-H217 PolarHBondContact O-N 3.21Å; L214-H217 PolarHBondContact O-ND1 2.92Å; L214-L444 HydrophobicContact CD1-CD1 4.4Å; L214-L444 HydrophobicContact CD2-CD1 4.36Å; L214-L444 HydrophobicContact CD2-CD2 3.86Å; L214-L444 HydrophobicContact CG-CD1 3.9Å; L214-L444 HydrophobicContact CG-CD2 4.24Å; L214-L473 HydrophobicContact CB-CD2 4.28Å; L214-L473 HydrophobicContact CD1-CD1 4Å |
| 215 | S | 90.7 | Very high | 91.2 | Very high | 26 Ų | 26 | 32.9 Ų | 32.9 | 18% | 0.182 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -65.5 | -24.7 | -173.4 | 63.5 | 0 | 0 | 0 | 0 | 114 | V211 A212 H217 | V211-S215 WeakPolarHBondContact O-CB 3.5Å; V211-S215 PolarHBondContact O-N 3.48Å; V211-S215 PolarHBondContact O-OG 2.98Å; A212-S215 PolarHBondContact O-OG 3.05Å; A212-S215 VanDerWaalsContact O-OG 3.13Å; S215-H217 VanDerWaalsContact C-N 3.32Å; S215-H217 PolarHBondContact O-N 2.96Å |
| 216 | A | 86.3 | Confident | 91 | Very high | 6 Ų | 6 | 33 Ų | 33 | 5% | 0.05 | 18% | 0.18 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -82.4 | -1.9 | -179.5 | 0 | 0 | 0 | 0 | 0 | 114.5 | L214 R218 E219 V220 Q440 | L214-A216 PolarHBondContact O-N 3.07Å; A216-R218 VanDerWaalsContact C-N 3.29Å; A216-R218 PolarHBondContact O-N 3.5Å; A216-E219 WeakPolarHBondContact CA-OE2 3.2Å; A216-E219 PolarHBondContact O-N 3.2Å; A216-V220 WeakPolarHBondContact O-CB 3.21Å; A216-V220 VanDerWaalsContact O-CG2 3.28Å; A216-V220 WeakPolarHBondContact O-CG2 3.31Å; A216-V220 PolarHBondContact O-N 2.9Å; A216-Q440 HydrophobicContact CB-CG 4.07Å |
| 217 | H | 88.8 | Confident | 90.9 | Very high | 131 Ų | 131 | 36.2 Ų | 36.2 | 61% | 0.606 | 20% | 0.195 | S | C | * | . | H | α-helix | trans | -60 | -36.3 | -172.8 | 71.6 | -81.2 | 0 | 0 | 0 | 113.5 | L214 S215 A221 | L214-H217 WeakPolarHBondContact O-CB 2.98Å; L214-H217 PolarHBondContact O-N 3.21Å; L214-H217 PolarHBondContact O-ND1 2.92Å; S215-H217 VanDerWaalsContact C-N 3.32Å; S215-H217 PolarHBondContact O-N 2.96Å; H217-A221 VanDerWaalsContact O-CB 3.28Å; H217-A221 WeakPolarHBondContact O-CB 3.42Å; H217-A221 PolarHBondContact O-N 3.08Å |
| 218 | R | 85.8 | Confident | 90.7 | Very high | 133 Ų | 133 | 43.2 Ų | 43.2 | 50% | 0.502 | 22% | 0.221 | S | C | . | . | H | α-helix | trans | -69.1 | -46 | -176.9 | 177 | 179.1 | 172.9 | 166.9 | -1.5 | 110.7 | A216 A221 Q222 | A216-R218 VanDerWaalsContact C-N 3.29Å; A216-R218 PolarHBondContact O-N 3.5Å; R218-A221 PolarHBondContact O-N 3.29Å; R218-Q222 WeakPolarHBondContact O-CB 3.28Å; R218-Q222 PolarHBondContact O-N 3.26Å |
| 219 | E | 83.8 | Confident | 90.6 | Very high | 30 Ų | 30 | 45.5 Ų | 45.5 | 14% | 0.14 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -65.3 | -45.8 | 179.7 | -64 | 71.7 | -160 | 0 | 0 | 109.5 | L69 A216 A221 Q222 F223 R480 | L69-E219 HydrophobicContact CD1-CG 4.3Å; A216-E219 WeakPolarHBondContact CA-OE2 3.2Å; A216-E219 PolarHBondContact O-N 3.2Å; E219-A221 PolarHBondContact O-N 3.5Å; E219-Q222 PolarHBondContact O-N 2.85Å; E219-F223 HydrophobicContact CB-CE2 4.17Å; E219-F223 WeakPolarHBondContact O-CD2 3.35Å; E219-F223 WeakPolarHBondContact O-CE2 3.2Å; E219-F223 PolarHBondContact O-N 3.32Å; E219-F223 VanDerWaalsContact O-N 3.1Å; E219-R480 IonicContact OE1-NH1 2.73Å |
| 220 | V | 89.6 | Confident | 90.5 | Very high | 24 Ų | 24 | 46 Ų | 46 | 15% | 0.145 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -56.5 | -48.4 | 173.5 | 169.9 | 0 | 0 | 0 | 0 | 111.3 | A216 Q222 F223 C224 L436 | A216-V220 WeakPolarHBondContact O-CB 3.21Å; A216-V220 VanDerWaalsContact O-CG2 3.28Å; A216-V220 WeakPolarHBondContact O-CG2 3.31Å; A216-V220 PolarHBondContact O-N 2.9Å; V220-Q222 VanDerWaalsContact C-N 3.31Å; V220-Q222 PolarHBondContact O-N 3.41Å; V220-F223 PolarHBondContact O-N 3.5Å; V220-C224 WeakPolarHBondContact O-CB 3.42Å; V220-C224 PolarHBondContact O-N 2.97Å; V220-C224 PolarHBondContact O-SG 3.42Å; V220-L436 HydrophobicContact CG2-CB 4.1Å |
| 221 | A | 90.3 | Very high | 90.4 | Very high | 43 Ų | 43 | 45.9 Ų | 45.9 | 36% | 0.355 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -62.2 | -38.5 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | H217 R218 E219 F223 C224 S225 | H217-A221 VanDerWaalsContact O-CB 3.28Å; H217-A221 WeakPolarHBondContact O-CB 3.42Å; H217-A221 PolarHBondContact O-N 3.08Å; R218-A221 PolarHBondContact O-N 3.29Å; E219-A221 PolarHBondContact O-N 3.5Å; A221-F223 VanDerWaalsContact C-N 3.33Å; A221-F223 PolarHBondContact O-N 3.13Å; A221-C224 PolarHBondContact O-N 3.19Å; A221-S225 VanDerWaalsContact O-CB 3.3Å; A221-S225 WeakPolarHBondContact O-CB 3.44Å; A221-S225 PolarHBondContact O-N 3.02Å; A221-S225 PolarHBondContact O-OG 2.99Å |
| 222 | Q | 87.5 | Confident | 90.4 | Very high | 102 Ų | 102 | 51 Ų | 51 | 48% | 0.477 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -65.4 | -33.3 | 177.6 | -176.4 | 174.7 | -12.7 | 0 | 0 | 112.8 | R218 E219 V220 S225 | R218-Q222 WeakPolarHBondContact O-CB 3.28Å; R218-Q222 PolarHBondContact O-N 3.26Å; E219-Q222 PolarHBondContact O-N 2.85Å; V220-Q222 VanDerWaalsContact C-N 3.31Å; V220-Q222 PolarHBondContact O-N 3.41Å; Q222-S225 PolarHBondContact O-OG 3.43Å |
| 223 | F | 86.1 | Confident | 90.5 | Very high | 8 Ų | 8 | 54.3 Ų | 54.3 | 4% | 0.035 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -80.9 | -39.3 | 176.3 | -62.2 | -51.9 | 0 | 0 | 0 | 112.6 | V65 L69 E219 V220 A221 S225 A226 L429 | V65-F223 HydrophobicContact CB-CE2 3.93Å; V65-F223 HydrophobicContact CB-CZ 3.95Å; V65-F223 HydrophobicContact CG1-CE2 3.4Å; V65-F223 HydrophobicContact CG1-CZ 3.54Å; V65-F223 HydrophobicContact CG2-CD2 3.8Å; V65-F223 HydrophobicContact CG2-CE1 4.12Å; V65-F223 HydrophobicContact CG2-CE2 3.28Å; V65-F223 HydrophobicContact CG2-CG 4.45Å; V65-F223 HydrophobicContact CG2-CZ 3.49Å; V65-F223 VanDerWaalsContact CG2-CZ 3.49Å; L69-F223 HydrophobicContact CD1-CZ 4.34Å; L69-F223 HydrophobicContact CD2-CZ 4.43Å; L69-F223 HydrophobicContact CG-CZ 4.31Å; E219-F223 HydrophobicContact CB-CE2 4.17Å; E219-F223 WeakPolarHBondContact O-CD2 3.35Å; E219-F223 WeakPolarHBondContact O-CE2 3.2Å; E219-F223 PolarHBondContact O-N 3.32Å; E219-F223 VanDerWaalsContact O-N 3.1Å; V220-F223 PolarHBondContact O-N 3.5Å; A221-F223 VanDerWaalsContact C-N 3.33Å; A221-F223 PolarHBondContact O-N 3.13Å; F223-S225 PolarHBondContact O-N 3.15Å; F223-A226 WeakPolarHBondContact O-CB 3.06Å; F223-A226 PolarHBondContact O-N 3.14Å; F223-L429 HydrophobicContact CD1-CB 4.48Å; F223-L429 HydrophobicContact CD1-CD2 3.97Å; F223-L429 HydrophobicContact CD1-CG 4.15Å; F223-L429 HydrophobicContact CE1-CD2 4.43Å |
| 224 | C | 90.9 | Very high | 90.6 | Very high | 4 Ų | 4 | 54 Ų | 54 | 3% | 0.027 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -63.8 | -32.2 | 174.9 | -68.5 | 0 | 0 | 0 | 0 | 112.2 | V220 A221 A226 H227 W228 A231 | V220-C224 WeakPolarHBondContact O-CB 3.42Å; V220-C224 PolarHBondContact O-N 2.97Å; V220-C224 PolarHBondContact O-SG 3.42Å; A221-C224 PolarHBondContact O-N 3.19Å; C224-A226 PolarHBondContact O-N 3.21Å; C224-H227 CarbonylContact O-C 3.58Å; C224-H227 VanDerWaalsContact O-C 3.24Å; C224-H227 PolarHBondContact O-N 3.19Å; C224-W228 HydrophobicContact CB-CE3 3.91Å; C224-W228 HydrophobicContact CB-CH2 3.91Å; C224-W228 HydrophobicContact CB-CZ3 3.57Å; C224-W228 PolarHBondContact O-N 2.83Å; C224-A231 HydrophobicContact CB-CB 3.86Å |
| 225 | S | 90.3 | Very high | 90.7 | Very high | 66 Ų | 66 | 53.6 Ų | 53.6 | 46% | 0.462 | 29% | 0.286 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -66.9 | -14.5 | -179.1 | 70.9 | 0 | 0 | 0 | 0 | 114.4 | A221 Q222 F223 H227 | A221-S225 VanDerWaalsContact O-CB 3.3Å; A221-S225 WeakPolarHBondContact O-CB 3.44Å; A221-S225 PolarHBondContact O-N 3.02Å; A221-S225 PolarHBondContact O-OG 2.99Å; Q222-S225 PolarHBondContact O-OG 3.43Å; F223-S225 PolarHBondContact O-N 3.15Å; S225-H227 VanDerWaalsContact C-N 3.34Å |
| 226 | A | 88.4 | Confident | 91 | Very high | 35 Ų | 35 | 57.7 Ų | 57.7 | 29% | 0.289 | 31% | 0.305 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -60 | -44.2 | 171.6 | 0 | 0 | 0 | 0 | 0 | 111.4 | F223 C224 L429 P430 | F223-A226 WeakPolarHBondContact O-CB 3.06Å; F223-A226 PolarHBondContact O-N 3.14Å; C224-A226 PolarHBondContact O-N 3.21Å; A226-L429 HydrophobicContact CB-CB 4.3Å; A226-P430 HydrophobicContact CB-CG 3.92Å |
| 227 | H | 91.1 | Very high | 91.4 | Very high | 69 Ų | 69 | 59.7 Ų | 59.7 | 32% | 0.319 | 32% | 0.315 | S | S | . | . | trans | -157.6 | 98.4 | 170 | -72.1 | -67.9 | 0 | 0 | 0 | 111.2 | C224 S225 G229 L230 A231 V293 P430 | C224-H227 CarbonylContact O-C 3.58Å; C224-H227 VanDerWaalsContact O-C 3.24Å; C224-H227 PolarHBondContact O-N 3.19Å; S225-H227 VanDerWaalsContact C-N 3.34Å; H227-G229 VanDerWaalsContact C-N 3.25Å; H227-G229 PolarHBondContact O-N 3.12Å; H227-L230 HydrophobicContact CB-CB 4.37Å; H227-L230 HydrophobicContact CB-CD1 4.25Å; H227-L230 HydrophobicContact CB-CG 4.42Å; H227-L230 PolarHBondContact O-N 3.33Å; H227-A231 PolarHBondContact O-N 3.39Å; H227-A231 VanDerWaalsContact O-N 3.12Å; H227-V293 VanDerWaalsContact CD2-CG2 3.48Å; H227-V293 WeakPolarHBondContact CD2-CG2 3.46Å; H227-V293 WeakPolarHBondContact NE2-CG2 3.34Å; H227-P430 HydrophobicContact CB-CB 4.47Å; H227-P430 HydrophobicContact CB-CG 3.79Å | ||
| 228 | W | 92.6 | Very high | 91.7 | Very high | 146 Ų | 146 | 53.5 Ų | 53.5 | 55% | 0.553 | 29% | 0.286 | S | S | * | . | H | α-helix | trans | -57.1 | -34 | -179.8 | -72.5 | 106.6 | 0 | 0 | 0 | 114.1 | C224 A231 L232 | C224-W228 HydrophobicContact CB-CE3 3.91Å; C224-W228 HydrophobicContact CB-CH2 3.91Å; C224-W228 HydrophobicContact CB-CZ3 3.57Å; C224-W228 PolarHBondContact O-N 2.83Å; W228-A231 PolarHBondContact O-N 2.98Å; W228-L232 VanDerWaalsContact O-CB 3.3Å; W228-L232 WeakPolarHBondContact O-CB 3.41Å; W228-L232 VanDerWaalsContact O-CG 3.26Å; W228-L232 WeakPolarHBondContact O-CG 3.08Å; W228-L232 PolarHBondContact O-N 3.19Å |
| 229 | G | 93.9 | Very high | 92 | Very high | 57 Ų | 57 | 49.7 Ų | 49.7 | 59% | 0.588 | 28% | 0.278 | S | S | * | . | H | α-helix | trans | -62 | -45.8 | 178.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | H227 L233 | H227-G229 VanDerWaalsContact C-N 3.25Å; H227-G229 PolarHBondContact O-N 3.12Å; G229-L233 VanDerWaalsContact O-CB 3.31Å; G229-L233 WeakPolarHBondContact O-CB 2.89Å; G229-L233 PolarHBondContact O-N 3.27Å |
| 230 | L | 92.8 | Very high | 92.4 | Very high | 14 Ų | 14 | 50.5 Ų | 50.5 | 7% | 0.073 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -69.7 | -38.9 | 176.8 | -68.6 | 175.5 | 0 | 0 | 0 | 111.6 | H227 L233 V234 V282 F291 P430 | H227-L230 HydrophobicContact CB-CB 4.37Å; H227-L230 HydrophobicContact CB-CD1 4.25Å; H227-L230 HydrophobicContact CB-CG 4.42Å; H227-L230 PolarHBondContact O-N 3.33Å; L230-L233 PolarHBondContact O-N 3.3Å; L230-V234 PolarHBondContact O-N 2.94Å; L230-V282 HydrophobicContact CB-CG1 4.37Å; L230-V282 HydrophobicContact CD2-CG1 4.04Å; L230-F291 HydrophobicContact CD1-CB 4.27Å; L230-P430 HydrophobicContact CB-CB 4.02Å; L230-P430 HydrophobicContact CB-CG 4.5Å |
| 231 | A | 94.2 | Very high | 92.5 | Very high | 0 Ų | 0 | 49.5 Ų | 49.5 | 0% | 0 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -62.1 | -48.1 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | C224 H227 W228 L233 V234 I235 P430 | C224-A231 HydrophobicContact CB-CB 3.86Å; H227-A231 PolarHBondContact O-N 3.39Å; H227-A231 VanDerWaalsContact O-N 3.12Å; W228-A231 PolarHBondContact O-N 2.98Å; A231-L233 VanDerWaalsContact C-N 3.32Å; A231-L233 PolarHBondContact O-N 3.11Å; A231-V234 WeakPolarHBondContact O-CG1 3.38Å; A231-V234 PolarHBondContact O-N 3.4Å; A231-I235 WeakPolarHBondContact O-CB 3.38Å; A231-I235 WeakPolarHBondContact O-CD1 3.47Å; A231-I235 WeakPolarHBondContact O-CG1 3Å; A231-I235 PolarHBondContact O-N 3.25Å; A231-P430 HydrophobicContact CB-CB 4.07Å |
| 232 | L | 95.8 | Very high | 92.5 | Very high | 106 Ų | 106 | 47.7 Ų | 47.7 | 56% | 0.555 | 26% | 0.264 | S | S | * | . | H | α-helix | trans | -63 | -39.4 | 176.5 | -74.2 | 171.3 | 0 | 0 | 0 | 111.6 | W228 I235 L236 | W228-L232 VanDerWaalsContact O-CB 3.3Å; W228-L232 WeakPolarHBondContact O-CB 3.41Å; W228-L232 VanDerWaalsContact O-CG 3.26Å; W228-L232 WeakPolarHBondContact O-CG 3.08Å; W228-L232 PolarHBondContact O-N 3.19Å; L232-I235 PolarHBondContact O-N 3.11Å; L232-L236 VanDerWaalsContact O-CB 3.25Å; L232-L236 WeakPolarHBondContact O-CB 3.29Å; L232-L236 PolarHBondContact O-N 2.98Å |
| 233 | L | 95.6 | Very high | 92.6 | Very high | 73 Ų | 73 | 48.8 Ų | 48.8 | 38% | 0.382 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -60.8 | -47.4 | 177.2 | -178.2 | 64.2 | 0 | 0 | 0 | 111.8 | G229 L230 A231 L237 V282 | G229-L233 VanDerWaalsContact O-CB 3.31Å; G229-L233 WeakPolarHBondContact O-CB 2.89Å; G229-L233 PolarHBondContact O-N 3.27Å; L230-L233 PolarHBondContact O-N 3.3Å; A231-L233 VanDerWaalsContact C-N 3.32Å; A231-L233 PolarHBondContact O-N 3.11Å; L233-L237 VanDerWaalsContact O-CB 3.27Å; L233-L237 WeakPolarHBondContact O-CB 3.15Å; L233-L237 PolarHBondContact O-N 3.31Å; L233-V282 HydrophobicContact CB-CG2 4.41Å; L233-V282 HydrophobicContact CD2-CG1 4.43Å; L233-V282 HydrophobicContact CD2-CG2 3.88Å; L233-V282 HydrophobicContact CG-CG2 3.81Å |
| 234 | V | 95.6 | Very high | 92.7 | Very high | 0 Ų | 0 | 54.8 Ų | 54.8 | 0% | 0 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -66.2 | -41.1 | 178.2 | 68.1 | 0 | 0 | 0 | 0 | 111.3 | L230 A231 L237 M238 P278 V282 V431 V435 | L230-V234 PolarHBondContact O-N 2.94Å; A231-V234 WeakPolarHBondContact O-CG1 3.38Å; A231-V234 PolarHBondContact O-N 3.4Å; V234-L237 PolarHBondContact O-N 2.94Å; V234-M238 HydrophobicContact CG2-CG 4.27Å; V234-M238 WeakPolarHBondContact O-CB 3.15Å; V234-M238 WeakPolarHBondContact O-CG 3.32Å; V234-M238 PolarHBondContact O-N 3.16Å; V234-P278 HydrophobicContact CG2-CB 4.05Å; V234-V282 HydrophobicContact CB-CB 4.38Å; V234-V282 HydrophobicContact CB-CG2 3.92Å; V234-V282 HydrophobicContact CG2-CG2 4.44Å; V234-V431 HydrophobicContact CG2-CG1 4.32Å; V234-V435 HydrophobicContact CG2-CG2 4.45Å |
| 235 | I | 95.8 | Very high | 92.4 | Very high | 53 Ų | 53 | 57.5 Ų | 57.5 | 27% | 0.272 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -62.1 | -49.9 | 178.7 | -68.8 | 165.5 | 0 | 0 | 0 | 110.2 | A231 L232 L237 M238 V239 V438 | A231-I235 WeakPolarHBondContact O-CB 3.38Å; A231-I235 WeakPolarHBondContact O-CD1 3.47Å; A231-I235 WeakPolarHBondContact O-CG1 3Å; A231-I235 PolarHBondContact O-N 3.25Å; L232-I235 PolarHBondContact O-N 3.11Å; I235-L237 VanDerWaalsContact C-N 3.32Å; I235-L237 PolarHBondContact O-N 3.03Å; I235-M238 PolarHBondContact O-N 2.95Å; I235-V239 WeakPolarHBondContact O-CG2 3.34Å; I235-V239 PolarHBondContact O-N 3.33Å; I235-V438 HydrophobicContact CB-CG2 4.35Å; I235-V438 HydrophobicContact CG1-CG2 4.07Å; I235-V438 HydrophobicContact CG2-CG2 3.98Å |
| 236 | L | 96 | Very high | 91.8 | Very high | 111 Ų | 111 | 54.4 Ų | 54.4 | 58% | 0.581 | 29% | 0.289 | S | S | * | . | H | α-helix | trans | -58.2 | -46.9 | 178.5 | -178 | 71.5 | 0 | 0 | 0 | 110.7 | L232 M238 V239 V240 | L232-L236 VanDerWaalsContact O-CB 3.25Å; L232-L236 WeakPolarHBondContact O-CB 3.29Å; L232-L236 PolarHBondContact O-N 2.98Å; L236-M238 VanDerWaalsContact C-N 3.35Å; L236-M238 PolarHBondContact O-N 3.22Å; L236-V239 PolarHBondContact O-N 2.05Å; L236-V240 HydrophobicContact CD1-CG2 4.49Å; L236-V240 HydrophobicContact CG-CG2 4.42Å; L236-V240 WeakPolarHBondContact O-CB 3.45Å; L236-V240 VanDerWaalsContact O-CG2 3.29Å; L236-V240 WeakPolarHBondContact O-CG2 3.16Å; L236-V240 PolarHBondContact O-N 2.96Å |
| 237 | L | 95.1 | Very high | 91.1 | Very high | 48 Ų | 48 | 56.9 Ų | 56.9 | 25% | 0.251 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -66.9 | -36.3 | -178.7 | -171.2 | 57.4 | 0 | 0 | 0 | 111.7 | L233 V234 I235 V240 C241 P278 C281 | L233-L237 VanDerWaalsContact O-CB 3.27Å; L233-L237 WeakPolarHBondContact O-CB 3.15Å; L233-L237 PolarHBondContact O-N 3.31Å; V234-L237 PolarHBondContact O-N 2.94Å; I235-L237 VanDerWaalsContact C-N 3.32Å; I235-L237 PolarHBondContact O-N 3.03Å; L237-V240 PolarHBondContact O-N 2.98Å; L237-C241 WeakPolarHBondContact O-CB 3.3Å; L237-C241 PolarHBondContact O-N 3.37Å; L237-C241 PolarHBondContact O-SG 3.11Å; L237-P278 HydrophobicContact CB-CB 3.94Å; L237-P278 HydrophobicContact CB-CG 4.28Å; L237-P278 HydrophobicContact CD2-CB 3.92Å; L237-P278 HydrophobicContact CD2-CG 4.44Å; L237-P278 HydrophobicContact CG-CB 3.77Å; L237-P278 HydrophobicContact CG-CG 3.89Å; L237-C281 HydrophobicContact CD2-CB 3.77Å |
| 238 | M | 94.3 | Very high | 90.2 | Very high | 1 Ų | 1 | 56 Ų | 56 | 1% | 0.005 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -62.2 | -44.7 | 171.1 | -63.1 | -121.5 | -47.7 | 0 | 0 | 112.3 | V234 I235 L236 S242 V275 P278 L395 V435 V438 | V234-M238 HydrophobicContact CG2-CG 4.27Å; V234-M238 WeakPolarHBondContact O-CB 3.15Å; V234-M238 WeakPolarHBondContact O-CG 3.32Å; V234-M238 PolarHBondContact O-N 3.16Å; I235-M238 PolarHBondContact O-N 2.95Å; L236-M238 VanDerWaalsContact C-N 3.35Å; L236-M238 PolarHBondContact O-N 3.22Å; M238-S242 VanDerWaalsContact O-CB 3.3Å; M238-S242 WeakPolarHBondContact O-CB 3.28Å; M238-S242 PolarHBondContact O-N 3.37Å; M238-S242 PolarHBondContact O-OG 3.07Å; M238-V275 HydrophobicContact CE-CG2 4.06Å; M238-V275 HydrophobicContact SD-CB 3.91Å; M238-V275 HydrophobicContact SD-CG1 3.88Å; M238-V275 HydrophobicContact SD-CG2 3.71Å; M238-P278 HydrophobicContact CB-CG 4.37Å; M238-P278 HydrophobicContact CG-CB 3.85Å; M238-P278 HydrophobicContact CG-CG 3.88Å; M238-L395 HydrophobicContact CE-CD1 4.24Å; M238-V435 HydrophobicContact SD-CG2 4.33Å; M238-V438 HydrophobicContact CE-CB 3.36Å; M238-V438 HydrophobicContact CE-CG1 3.35Å; M238-V438 HydrophobicContact CE-CG2 3.85Å |
| 239 | V | 92.7 | Very high | 89.1 | Confident | 54 Ų | 54 | 53.8 Ų | 53.8 | 33% | 0.327 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -64.7 | -44.1 | 178.1 | 172.6 | 0 | 0 | 0 | 0 | 110.4 | I235 L236 S242 Q243 | I235-V239 WeakPolarHBondContact O-CG2 3.34Å; I235-V239 PolarHBondContact O-N 3.33Å; L236-V239 PolarHBondContact O-N 2.05Å; V239-S242 PolarHBondContact O-N 3.39Å; V239-S242 PolarHBondContact O-OG 3.2Å; V239-Q243 HydrophobicContact CG1-CB 4.48Å; V239-Q243 HydrophobicContact CG1-CG 4.18Å; V239-Q243 WeakPolarHBondContact O-CA 3.26Å; V239-Q243 VanDerWaalsContact O-CB 3.29Å; V239-Q243 WeakPolarHBondContact O-CB 3.2Å; V239-Q243 PolarHBondContact O-N 3.41Å |
| 240 | V | 93 | Very high | 87.6 | Confident | 46 Ų | 46 | 56.8 Ų | 56.8 | 28% | 0.279 | 30% | 0.299 | S | S | . | . | I | π-helix | trans | -62.7 | -47.9 | 176.7 | 172.4 | 0 | 0 | 0 | 0 | 111.4 | L236 L237 S242 H244 L245 | L236-V240 HydrophobicContact CD1-CG2 4.49Å; L236-V240 HydrophobicContact CG-CG2 4.42Å; L236-V240 WeakPolarHBondContact O-CB 3.45Å; L236-V240 VanDerWaalsContact O-CG2 3.29Å; L236-V240 WeakPolarHBondContact O-CG2 3.16Å; L236-V240 PolarHBondContact O-N 2.96Å; L237-V240 PolarHBondContact O-N 2.98Å; V240-S242 PolarHBondContact O-N 2.83Å; V240-H244 PolarHBondContact O-N 2.89Å; V240-L245 HydrophobicContact CG1-CD1 3.86Å; V240-L245 HydrophobicContact CG1-CG 4.05Å; V240-L245 PolarHBondContact O-N 2.66Å |
| 241 | C | 91.1 | Very high | 85.8 | Confident | 3 Ų | 3 | 62.4 Ų | 62.4 | 2% | 0.02 | 32% | 0.324 | C | S | . | . | I | π-helix | trans | -64.6 | -40.6 | 178.9 | -71.2 | 0 | 0 | 0 | 0 | 112.8 | L237 G246 F270 | L237-C241 WeakPolarHBondContact O-CB 3.3Å; L237-C241 PolarHBondContact O-N 3.37Å; L237-C241 PolarHBondContact O-SG 3.11Å; C241-G246 PolarHBondContact O-N 3.34Å; C241-F270 CarbonylContact O-C 3.57Å |
| 242 | S | 90.1 | Very high | 83.9 | Confident | 6 Ų | 6 | 67.4 Ų | 67.4 | 4% | 0.042 | 35% | 0.354 | C | S | . | . | I | π-helix | trans | -81.2 | -46.9 | -177.1 | 60.2 | 0 | 0 | 0 | 0 | 113.7 | M238 V239 V240 G246 | M238-S242 VanDerWaalsContact O-CB 3.3Å; M238-S242 WeakPolarHBondContact O-CB 3.28Å; M238-S242 PolarHBondContact O-N 3.37Å; M238-S242 PolarHBondContact O-OG 3.07Å; V239-S242 PolarHBondContact O-N 3.39Å; V239-S242 PolarHBondContact O-OG 3.2Å; V240-S242 PolarHBondContact O-N 2.83Å; S242-G246 WeakPolarHBondContact O-CA 3.37Å |
| 243 | Q | 89.1 | Confident | 81.5 | Confident | 125 Ų | 125 | 67.6 Ų | 67.6 | 58% | 0.584 | 36% | 0.363 | S | S | * | . | I | π-helix | trans | -96.3 | -44.5 | -169.8 | -51.9 | -51.9 | -51.8 | 0 | 0 | 112.9 | V239 | V239-Q243 HydrophobicContact CG1-CB 4.48Å; V239-Q243 HydrophobicContact CG1-CG 4.18Å; V239-Q243 WeakPolarHBondContact O-CA 3.26Å; V239-Q243 VanDerWaalsContact O-CB 3.29Å; V239-Q243 WeakPolarHBondContact O-CB 3.2Å; V239-Q243 PolarHBondContact O-N 3.41Å |
| 244 | H | 88 | Confident | 79.3 | Confident | 134 Ų | 134 | 68.1 Ų | 68.1 | 62% | 0.62 | 37% | 0.371 | S | S | * | . | I | π-helix | trans | -88.7 | -43.9 | -173.4 | -67.6 | -72.9 | 0 | 0 | 0 | 112.9 | V240 | V240-H244 PolarHBondContact O-N 2.89Å |
| 245 | L | 85.2 | Confident | 76.8 | Confident | 60 Ų | 60 | 80.8 Ų | 80.8 | 31% | 0.314 | 42% | 0.419 | S | S | . | . | S | Bend | trans | -94.3 | 2.2 | 178.4 | -60.5 | 176.9 | 0 | 0 | 0 | 112.4 | V240 S247 S248 F270 | V240-L245 HydrophobicContact CG1-CD1 3.86Å; V240-L245 HydrophobicContact CG1-CG 4.05Å; V240-L245 PolarHBondContact O-N 2.66Å; L245-S247 PolarHBondContact O-N 3.47Å; L245-S247 VanDerWaalsContact O-N 3.16Å; L245-S248 WeakPolarHBondContact O-CB 3.18Å; L245-S248 PolarHBondContact O-N 2.88Å; L245-F270 HydrophobicContact CB-CB 3.99Å; L245-F270 HydrophobicContact CB-CD2 4.21Å; L245-F270 HydrophobicContact CB-CG 4.07Å; L245-F270 HydrophobicContact CD1-CD1 4.34Å; L245-F270 HydrophobicContact CD1-CE1 4.47Å; L245-F270 HydrophobicContact CD1-CG 4.44Å |
| 246 | G | 77 | Confident | 74.1 | Confident | 1 Ų | 1 | 88 Ų | 88 | 1% | 0.01 | 44% | 0.443 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -66.6 | -16.9 | -174 | 0 | 0 | 0 | 0 | 0 | 114.8 | C241 S242 R271 | C241-G246 PolarHBondContact O-N 3.34Å; S242-G246 WeakPolarHBondContact O-CA 3.37Å; G246-R271 PolarHBondContact O-NE 3.15Å; G246-R271 PolarHBondContact O-NH2 3.39Å |
| 247 | S | 74 | Confident | 71.8 | Confident | 88 Ų | 88 | 94.5 Ų | 94.5 | 62% | 0.615 | 46% | 0.46 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -96.8 | -11.1 | 173.7 | 57 | 0 | 0 | 0 | 0 | 113.3 | L245 Q249 | L245-S247 PolarHBondContact O-N 3.47Å; L245-S247 VanDerWaalsContact O-N 3.16Å; S247-Q249 PolarHBondContact O-N 3.28Å |
| 248 | S | 72.4 | Confident | 69.4 | Low | 50 Ų | 50 | 97.4 Ų | 97.4 | 35% | 0.35 | 48% | 0.48 | S | S | . | . | trans | -71.9 | 111.7 | -179.5 | -64.4 | 0 | 0 | 0 | 0 | 109.8 | L245 | L245-S248 WeakPolarHBondContact O-CB 3.18Å; L245-S248 PolarHBondContact O-N 2.88Å | ||
| 249 | Q | 70.3 | Confident | 66.7 | Low | 99 Ų | 99 | 103.3 Ų | 103.3 | 46% | 0.463 | 52% | 0.521 | S | S | . | . | trans | -84.5 | 123.2 | 178.9 | -66.4 | 178.4 | -0.8 | 0 | 0 | 109.6 | S247 P266 | S247-Q249 PolarHBondContact O-N 3.28Å; Q249-P266 HydrophobicContact CB-CB 3.94Å; Q249-P266 HydrophobicContact CG-CB 4.07Å | ||
| 250 | F | 61.8 | Low | 64.5 | Low | 121 Ų | 121 | 105.5 Ų | 105.5 | 53% | 0.531 | 55% | 0.545 | S | S | . | . | B | Isolated β-bridge | trans | -98.6 | 128.6 | 173.9 | -120.4 | -91 | 0 | 0 | 0 | 109.7 | V252 L267 A269 F270 | F250-V252 PolarHBondContact O-N 2.88Å; F250-L267 PolarHBondContact N-O 3.4Å; F250-A269 HydrophobicContact CB-CB 4.34Å; F250-F270 HydrophobicContact CD2-CD2 4.44Å; F250-F270 AromaticContact CD2-CE2 3.69Å; F250-F270 HydrophobicContact CD2-CE2 3.69Å; F250-F270 HydrophobicContact CD2-CZ 4.45Å; F250-F270 AromaticContact CE2-CE2 3.75Å; F250-F270 HydrophobicContact CE2-CE2 3.75Å; F250-F270 HydrophobicContact CE2-CZ 4.2Å |
| 251 | H | 55.8 | Low | 62.2 | Low | 132 Ų | 132 | 108.7 Ų | 108.7 | 61% | 0.611 | 57% | 0.569 | S | S | * | * | trans | -81.6 | 100 | 174.4 | -66.9 | 82.8 | 0 | 0 | 0 | 108.2 | C253 | H251-C253 PolarHBondContact O-N 3.3Š| ||
| 252 | V | 54.3 | Low | 59.8 | Low | 104 Ų | 104 | 112.4 Ų | 112.4 | 63% | 0.63 | 60% | 0.595 | S | S | * | * | trans | -68.9 | 115.6 | 175.5 | -175.3 | 0 | 0 | 0 | 0 | 108.1 | F250 | F250-V252 PolarHBondContact O-N 2.88Š| ||
| 253 | C | 45.1 | Very low | 57.6 | Low | 110 Ų | 110 | 117.9 Ų | 117.9 | 74% | 0.743 | 63% | 0.629 | S | S | * | * | trans | -67.8 | 125.1 | 174.7 | -69.7 | 0 | 0 | 0 | 0 | 109.3 | H251 W255 | H251-C253 PolarHBondContact O-N 3.3Å; C253-W255 PolarHBondContact O-N 3.46Å | ||
| 254 | P | 47.8 | Very low | 55.6 | Low | 85 Ų | 85 | 118.3 Ų | 118.3 | 55% | 0.552 | 63% | 0.63 | S | S | * | * | trans | -66.4 | 119.4 | 177.5 | 24.3 | -30.2 | 0 | 0 | 0 | 109.9 | R256 | P254-R256 PolarHBondContact O-N 2.94Å; P254-R256 VanDerWaalsContact O-N 3.11Å | ||
| 255 | W | 43.2 | Very low | 54.1 | Low | 265 Ų | 265 | 116.8 Ų | 116.8 | 100% | 1.004 | 63% | 0.631 | S | S | * | * | S | Bend | trans | -69.2 | 0.9 | 176.3 | -172.6 | -76.9 | 0 | 0 | 0 | 113 | C253 | C253-W255 PolarHBondContact O-N 3.46Š|
| 256 | R | 40.7 | Very low | 53 | Low | 205 Ų | 205 | 116.8 Ų | 116.8 | 77% | 0.774 | 63% | 0.634 | S | S | * | * | trans | -135.5 | 110.6 | 178.2 | -169.1 | 174.2 | -89.4 | -102.6 | 3 | 111.6 | P254 T258 | P254-R256 PolarHBondContact O-N 2.94Å; P254-R256 VanDerWaalsContact O-N 3.11Å; R256-T258 PolarHBondContact O-N 3.38Å | ||
| 257 | R | 46.1 | Very low | 52.7 | Low | 248 Ų | 248 | 118.4 Ų | 118.4 | 94% | 0.936 | 64% | 0.642 | S | S | * | * | trans | -74.1 | 91.7 | 165 | -72.2 | -174.8 | -150.7 | 167 | 6.3 | 108.9 | ||||
| 258 | T | 45 | Very low | 53 | Low | 109 Ų | 109 | 115.8 Ų | 115.8 | 67% | 0.669 | 62% | 0.623 | S | S | * | * | trans | -157.8 | 121.2 | 153.6 | 38 | 0 | 0 | 0 | 0 | 110.9 | R256 | R256-T258 PolarHBondContact O-N 3.38Š| ||
| 259 | S | 37.8 | Very low | 53.5 | Low | 124 Ų | 124 | 114.6 Ų | 114.6 | 87% | 0.867 | 62% | 0.617 | S | S | * | * | trans | 86.6 | 130 | 162.1 | -141.9 | 0 | 0 | 0 | 0 | 119 | S261 | S259-S261 PolarHBondContact O-N 2.65Š| ||
| 260 | A | 46 | Very low | 54.1 | Low | 101 Ų | 101 | 112.4 Ų | 112.4 | 84% | 0.835 | 61% | 0.606 | S | S | * | * | S | Bend | trans | -83.8 | 96.6 | -163.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||
| 261 | S | 45.6 | Very low | 55.2 | Low | 112 Ų | 112 | 109 Ų | 109 | 78% | 0.783 | 59% | 0.59 | S | S | * | * | trans | 174.9 | 61 | 140.7 | 70 | 0 | 0 | 0 | 0 | 108.5 | S259 T263 | S259-S261 PolarHBondContact O-N 2.65Å; S261-T263 PolarHBondContact O-N 3.49Å | ||
| 262 | S | 40.5 | Very low | 56.7 | Low | 81 Ų | 81 | 103 Ų | 103 | 57% | 0.566 | 56% | 0.562 | S | S | * | * | trans | -86.6 | 94.1 | 174.7 | -167.5 | 0 | 0 | 0 | 0 | 108.3 | H264 | S262-H264 PolarHBondContact O-CD2 3.07Å; S262-H264 PolarHBondContact O-N 3.25Å; S262-H264 VanDerWaalsContact O-N 3.07Å | ||
| 263 | T | 43.2 | Very low | 58.4 | Low | 122 Ų | 122 | 99.1 Ų | 99.1 | 75% | 0.748 | 54% | 0.537 | S | S | * | . | trans | -62.2 | 107.8 | 164 | 45.7 | 0 | 0 | 0 | 0 | 107.6 | S261 T265 | S261-T263 PolarHBondContact O-N 3.49Å; T263-T265 PolarHBondContact O-N 3.07Å | ||
| 264 | H | 46.8 | Very low | 60.6 | Low | 133 Ų | 133 | 93.9 Ų | 93.9 | 62% | 0.616 | 50% | 0.502 | S | S | * | . | trans | -64.4 | 102 | 176.4 | -69.3 | -87.3 | 0 | 0 | 0 | 109.3 | S262 P266 | S262-H264 PolarHBondContact O-CD2 3.07Å; S262-H264 PolarHBondContact O-N 3.25Å; S262-H264 VanDerWaalsContact O-N 3.07Å; H264-P266 WeakPolarHBondContact O-CD 3.1Å | ||
| 265 | T | 57 | Low | 62.7 | Low | 103 Ų | 103 | 89.8 Ų | 89.8 | 63% | 0.632 | 48% | 0.476 | S | S | * | . | trans | -88.1 | 114.2 | 170.7 | 48.4 | 0 | 0 | 0 | 0 | 108.8 | T263 L267 | T263-T265 PolarHBondContact O-N 3.07Å; T265-L267 PolarHBondContact O-N 3.41Å | ||
| 266 | P | 63.5 | Low | 65.1 | Low | 60 Ų | 60 | 78.2 Ų | 78.2 | 39% | 0.39 | 43% | 0.433 | S | S | . | . | trans | -66.4 | 128.9 | 176.7 | 25.5 | -31.9 | 0 | 0 | 0 | 110.1 | Q249 H264 | Q249-P266 HydrophobicContact CB-CB 3.94Å; Q249-P266 HydrophobicContact CG-CB 4.07Å; H264-P266 WeakPolarHBondContact O-CD 3.1Å | ||
| 267 | L | 70.5 | Confident | 67.6 | Low | 34 Ų | 34 | 70.8 Ų | 70.8 | 18% | 0.178 | 41% | 0.408 | C | S | . | . | B | Isolated β-bridge | trans | -110.9 | 128.7 | -178.7 | -78.8 | 149.5 | 0 | 0 | 0 | 110.2 | L47 F250 T265 A269 L272 | L47-L267 HydrophobicContact CD2-CD2 3.91Å; F250-L267 PolarHBondContact N-O 3.4Å; T265-L267 PolarHBondContact O-N 3.41Å; L267-A269 VanDerWaalsContact C-N 3.26Å; L267-A269 PolarHBondContact O-N 3.04Å; L267-L272 HydrophobicContact CD2-CD1 4.25Å |
| 268 | P | 80.2 | Confident | 69.9 | Low | 33 Ų | 33 | 59 Ų | 59 | 21% | 0.214 | 36% | 0.364 | C | S | . | . | trans | -78.1 | 74.3 | 176.5 | 32.2 | -34.5 | 0 | 0 | 0 | 110.7 | F270 R271 L272 | P268-F270 VanDerWaalsContact C-N 3.34Å; P268-F270 PolarHBondContact O-N 2.89Å; P268-R271 HydrophobicContact CB-CB 4.29Å; P268-R271 PolarHBondContact O-N 2.86Å; P268-L272 HydrophobicContact CG-CD1 4.39Å; P268-L272 HydrophobicContact CG-CG 4.46Å; P268-L272 WeakPolarHBondContact O-CG 3.11Å; P268-L272 PolarHBondContact O-N 3.21Å; P268-L272 VanDerWaalsContact O-N 3.12Å | ||
| 269 | A | 81.5 | Confident | 72.2 | Confident | 26 Ų | 26 | 54 Ų | 54 | 22% | 0.215 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -57.8 | -39.7 | -172.1 | 0 | 0 | 0 | 0 | 0 | 113.7 | F250 L267 L272 L273 | F250-A269 HydrophobicContact CB-CB 4.34Å; L267-A269 VanDerWaalsContact C-N 3.26Å; L267-A269 PolarHBondContact O-N 3.04Å; A269-L272 PolarHBondContact O-N 3.08Å; A269-L273 WeakPolarHBondContact O-CB 3.42Å; A269-L273 PolarHBondContact O-N 2.85Å |
| 270 | F | 83.3 | Confident | 74.9 | Confident | 53 Ų | 53 | 49.9 Ų | 49.9 | 23% | 0.232 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -66.9 | -36.4 | -180 | -71.5 | -69.7 | 0 | 0 | 0 | 113.4 | C241 L245 F250 P268 S274 I277 | C241-F270 CarbonylContact O-C 3.57Å; L245-F270 HydrophobicContact CB-CB 3.99Å; L245-F270 HydrophobicContact CB-CD2 4.21Å; L245-F270 HydrophobicContact CB-CG 4.07Å; L245-F270 HydrophobicContact CD1-CD1 4.34Å; L245-F270 HydrophobicContact CD1-CE1 4.47Å; L245-F270 HydrophobicContact CD1-CG 4.44Å; F250-F270 HydrophobicContact CD2-CD2 4.44Å; F250-F270 AromaticContact CD2-CE2 3.69Å; F250-F270 HydrophobicContact CD2-CE2 3.69Å; F250-F270 HydrophobicContact CD2-CZ 4.45Å; F250-F270 AromaticContact CE2-CE2 3.75Å; F250-F270 HydrophobicContact CE2-CE2 3.75Å; F250-F270 HydrophobicContact CE2-CZ 4.2Å; P268-F270 VanDerWaalsContact C-N 3.34Å; P268-F270 PolarHBondContact O-N 2.89Å; F270-S274 VanDerWaalsContact O-CA 3.27Å; F270-S274 WeakPolarHBondContact O-CA 3.45Å; F270-S274 WeakPolarHBondContact O-CB 3.42Å; F270-S274 PolarHBondContact O-N 3Å; F270-S274 VanDerWaalsContact O-N 3.13Å; F270-I277 HydrophobicContact CD1-CD1 4.03Å; F270-I277 HydrophobicContact CE1-CD1 4.37Å |
| 271 | R | 86.1 | Confident | 77.1 | Confident | 50 Ų | 50 | 47.8 Ų | 47.8 | 19% | 0.189 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -67.4 | -50.4 | 174.3 | -171.6 | -175.2 | -63.2 | -134.1 | -5 | 110.4 | G246 P268 L273 S274 I396 | G246-R271 PolarHBondContact O-NE 3.15Å; G246-R271 PolarHBondContact O-NH2 3.39Å; P268-R271 HydrophobicContact CB-CB 4.29Å; P268-R271 PolarHBondContact O-N 2.86Å; R271-L273 VanDerWaalsContact C-N 3.33Å; R271-L273 PolarHBondContact O-N 2.95Å; R271-S274 WeakPolarHBondContact O-CB 3.31Å; R271-S274 PolarHBondContact O-N 3.48Å; R271-S274 PolarHBondContact O-OG 2.72Å; R271-I396 WeakPolarHBondContact O-CG2 3.28Å |
| 272 | L | 86.6 | Confident | 79.4 | Confident | 6 Ų | 6 | 42.5 Ų | 42.5 | 3% | 0.031 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -62.4 | -39.7 | -177.1 | -69.9 | 169.9 | 0 | 0 | 0 | 112.3 | L47 L51 Q54 L267 P268 A269 I396 A398 | L47-L272 HydrophobicContact CD1-CD1 4.38Å; L47-L272 HydrophobicContact CD2-CD1 4.1Å; L51-L272 HydrophobicContact CD2-CB 4.3Å; L51-L272 WeakPolarHBondContact CD2-O 3.27Å; Q54-L272 PolarHBondContact OE1-O 3.43Å; Q54-L272 VanDerWaalsContact OE1-O 3.07Å; L267-L272 HydrophobicContact CD2-CD1 4.25Å; P268-L272 HydrophobicContact CG-CD1 4.39Å; P268-L272 HydrophobicContact CG-CG 4.46Å; P268-L272 WeakPolarHBondContact O-CG 3.11Å; P268-L272 PolarHBondContact O-N 3.21Å; P268-L272 VanDerWaalsContact O-N 3.12Å; A269-L272 PolarHBondContact O-N 3.08Å; L272-I396 WeakPolarHBondContact O-CG2 3.44Å; L272-A398 HydrophobicContact CD2-CB 3.98Å |
| 273 | L | 89.8 | Confident | 81.7 | Confident | 21 Ų | 21 | 42.2 Ų | 42.2 | 11% | 0.11 | 24% | 0.235 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -101.3 | 23.9 | -178.5 | -56.3 | 179.4 | 0 | 0 | 0 | 113.2 | L50 L51 A269 R271 V275 L276 I277 | L50-L273 HydrophobicContact CB-CD2 3.81Å; L50-L273 HydrophobicContact CD1-CD1 4.16Å; L51-L273 HydrophobicContact CD2-CD2 4.47Å; A269-L273 WeakPolarHBondContact O-CB 3.42Å; A269-L273 PolarHBondContact O-N 2.85Å; R271-L273 VanDerWaalsContact C-N 3.33Å; R271-L273 PolarHBondContact O-N 2.95Å; L273-V275 PolarHBondContact O-N 2.99Å; L273-L276 HydrophobicContact CB-CB 4.44Å; L273-L276 HydrophobicContact CD2-CD2 4.12Å; L273-L276 PolarHBondContact O-N 3.12Å; L273-L276 VanDerWaalsContact O-N 3.11Å; L273-I277 HydrophobicContact CB-CD1 3.71Å; L273-I277 HydrophobicContact CB-CG1 3.86Å; L273-I277 HydrophobicContact CD1-CD1 4.43Å; L273-I277 PolarHBondContact O-N 2.99Å |
| 274 | S | 91.5 | Very high | 84 | Confident | 0 Ų | 0 | 41 Ų | 41 | 0% | 0 | 22% | 0.223 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -63.7 | -11.2 | -173.3 | 53.4 | 0 | 0 | 0 | 0 | 115.7 | F270 R271 P278 | F270-S274 VanDerWaalsContact O-CA 3.27Å; F270-S274 WeakPolarHBondContact O-CA 3.45Å; F270-S274 WeakPolarHBondContact O-CB 3.42Å; F270-S274 PolarHBondContact O-N 3Å; F270-S274 VanDerWaalsContact O-N 3.13Å; R271-S274 WeakPolarHBondContact O-CB 3.31Å; R271-S274 PolarHBondContact O-N 3.48Å; R271-S274 PolarHBondContact O-OG 2.72Å; S274-P278 WeakPolarHBondContact O-CD 3.49Å; S274-P278 WeakPolarHBondContact O-CG 3.41Å |
| 275 | V | 92.3 | Very high | 86.1 | Confident | 0 Ų | 0 | 37.4 Ų | 37.4 | 0% | 0 | 21% | 0.21 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -106.9 | -36.8 | 169 | -176.8 | 0 | 0 | 0 | 0 | 111.2 | Q54 V58 M238 L273 P278 V279 K392 L395 V435 | Q54-V275 HydrophobicContact CG-CB 3.65Å; Q54-V275 HydrophobicContact CG-CG1 4.28Å; Q54-V275 HydrophobicContact CG-CG2 4.47Å; Q54-V275 VanDerWaalsContact NE2-CB 3.25Å; Q54-V275 VanDerWaalsContact NE2-N 3.13Å; V58-V275 HydrophobicContact CG2-CG1 4.07Å; M238-V275 HydrophobicContact CE-CG2 4.06Å; M238-V275 HydrophobicContact SD-CB 3.91Å; M238-V275 HydrophobicContact SD-CG1 3.88Å; M238-V275 HydrophobicContact SD-CG2 3.71Å; L273-V275 PolarHBondContact O-N 2.99Å; V275-P278 WeakPolarHBondContact O-CD 3.48Å; V275-V279 HydrophobicContact CG1-CG2 4.04Å; V275-V279 WeakPolarHBondContact O-CB 3.29Å; V275-V279 WeakPolarHBondContact O-CG2 3.34Å; V275-V279 PolarHBondContact O-N 2.86Å; V275-V279 VanDerWaalsContact O-N 3.11Å; V275-K392 HydrophobicContact CG2-CD 4.3Å; V275-K392 HydrophobicContact CG2-CG 3.96Å; V275-L395 HydrophobicContact CG2-CD1 4.3Å; V275-V435 HydrophobicContact CG1-CG1 3.76Å; V275-V435 HydrophobicContact CG1-CG2 4.05Å |
| 276 | L | 93.2 | Very high | 87.5 | Confident | 21 Ų | 21 | 32.7 Ų | 32.7 | 11% | 0.11 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -67 | -47.4 | -176.4 | -177.7 | 63.7 | 0 | 0 | 0 | 112 | L50 L53 Q54 L57 L273 A280 | L50-L276 HydrophobicContact CB-CD2 4.19Å; L50-L276 HydrophobicContact CD2-CD2 3.95Å; L53-L276 HydrophobicContact CD2-CD1 3.89Å; L53-L276 HydrophobicContact CD2-CD2 4.44Å; L53-L276 HydrophobicContact CG-CD1 4.16Å; Q54-L276 HydrophobicContact CB-CB 4.16Å; Q54-L276 HydrophobicContact CG-CB 4.03Å; L57-L276 HydrophobicContact CD1-CD1 3.4Å; L273-L276 HydrophobicContact CB-CB 4.44Å; L273-L276 HydrophobicContact CD2-CD2 4.12Å; L273-L276 PolarHBondContact O-N 3.12Å; L273-L276 VanDerWaalsContact O-N 3.11Å; L276-A280 VanDerWaalsContact O-CB 3.29Å; L276-A280 WeakPolarHBondContact O-CB 3.38Å; L276-A280 PolarHBondContact O-N 2.87Å |
| 277 | I | 92.9 | Very high | 88.6 | Confident | 49 Ų | 49 | 33.2 Ų | 33.2 | 25% | 0.251 | 19% | 0.19 | S | C | . | . | H | α-helix | trans | -62 | -51.6 | -179.6 | -65.6 | 166.4 | 0 | 0 | 0 | 110.4 | F270 L273 V279 A280 C281 | F270-I277 HydrophobicContact CD1-CD1 4.03Å; F270-I277 HydrophobicContact CE1-CD1 4.37Å; L273-I277 HydrophobicContact CB-CD1 3.71Å; L273-I277 HydrophobicContact CB-CG1 3.86Å; L273-I277 HydrophobicContact CD1-CD1 4.43Å; L273-I277 PolarHBondContact O-N 2.99Å; I277-V279 PolarHBondContact O-N 3.3Å; I277-A280 PolarHBondContact O-N 3.38Å; I277-C281 WeakPolarHBondContact O-CB 3.12Å; I277-C281 PolarHBondContact O-N 2.62Å; I277-C281 PolarHBondContact O-SG 3.39Å |
| 278 | P | 94.8 | Very high | 89.3 | Confident | 0 Ų | 0 | 40 Ų | 40 | 0% | 0 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -61.2 | -43.4 | 179.1 | -24.4 | 33.6 | 0 | 0 | 0 | 114.3 | V234 L237 M238 S274 V275 C281 V282 | V234-P278 HydrophobicContact CG2-CB 4.05Å; L237-P278 HydrophobicContact CB-CB 3.94Å; L237-P278 HydrophobicContact CB-CG 4.28Å; L237-P278 HydrophobicContact CD2-CB 3.92Å; L237-P278 HydrophobicContact CD2-CG 4.44Å; L237-P278 HydrophobicContact CG-CB 3.77Å; L237-P278 HydrophobicContact CG-CG 3.89Å; M238-P278 HydrophobicContact CB-CG 4.37Å; M238-P278 HydrophobicContact CG-CB 3.85Å; M238-P278 HydrophobicContact CG-CG 3.88Å; S274-P278 WeakPolarHBondContact O-CD 3.49Å; S274-P278 WeakPolarHBondContact O-CG 3.41Å; V275-P278 WeakPolarHBondContact O-CD 3.48Å; P278-C281 PolarHBondContact O-N 3.17Å; P278-V282 WeakPolarHBondContact O-CG2 3.33Å; P278-V282 PolarHBondContact O-N 3.34Å |
| 279 | V | 93.6 | Very high | 89.5 | Confident | 5 Ų | 5 | 43.2 Ų | 43.2 | 3% | 0.03 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -61.5 | -47.6 | 178.3 | 170.1 | 0 | 0 | 0 | 0 | 110.3 | L57 V275 I277 C281 V282 W283 V431 V435 | L57-V279 HydrophobicContact CD1-CG1 4.22Å; V275-V279 HydrophobicContact CG1-CG2 4.04Å; V275-V279 WeakPolarHBondContact O-CB 3.29Å; V275-V279 WeakPolarHBondContact O-CG2 3.34Å; V275-V279 PolarHBondContact O-N 2.86Å; V275-V279 VanDerWaalsContact O-N 3.11Å; I277-V279 PolarHBondContact O-N 3.3Å; V279-C281 PolarHBondContact O-N 3.35Å; V279-V282 PolarHBondContact O-N 2.74Å; V279-W283 WeakPolarHBondContact O-CB 3.2Å; V279-W283 PolarHBondContact O-N 3.22Å; V279-V431 HydrophobicContact CB-CG1 4.34Å; V279-V431 HydrophobicContact CG1-CG1 4.04Å; V279-V431 HydrophobicContact CG2-CG1 3.99Å; V279-V435 HydrophobicContact CG2-CG2 3.41Å; V279-V435 VanDerWaalsContact CG2-CG2 3.41Å |
| 280 | A | 93.1 | Very high | 89 | Confident | 38 Ų | 38 | 44.8 Ų | 44.8 | 31% | 0.314 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -61.1 | -45.8 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112 | L276 I277 W283 I284 | L276-A280 VanDerWaalsContact O-CB 3.29Å; L276-A280 WeakPolarHBondContact O-CB 3.38Å; L276-A280 PolarHBondContact O-N 2.87Å; I277-A280 PolarHBondContact O-N 3.38Å; A280-W283 PolarHBondContact O-N 3.01Å; A280-I284 WeakPolarHBondContact O-CB 3.35Å; A280-I284 WeakPolarHBondContact O-CD1 3.06Å; A280-I284 VanDerWaalsContact O-CG1 3.24Å; A280-I284 WeakPolarHBondContact O-CG1 2.97Å; A280-I284 PolarHBondContact O-N 3.08Å |
| 281 | C | 93.1 | Very high | 88.2 | Confident | 56 Ų | 56 | 46.9 Ų | 46.9 | 38% | 0.378 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -60.3 | -51.4 | 178.5 | -71.8 | 0 | 0 | 0 | 0 | 112 | L237 I277 P278 V279 W283 I284 V285 | L237-C281 HydrophobicContact CD2-CB 3.77Å; I277-C281 WeakPolarHBondContact O-CB 3.12Å; I277-C281 PolarHBondContact O-N 2.62Å; I277-C281 PolarHBondContact O-SG 3.39Å; P278-C281 PolarHBondContact O-N 3.17Å; V279-C281 PolarHBondContact O-N 3.35Å; C281-W283 VanDerWaalsContact C-N 3.33Å; C281-W283 PolarHBondContact O-N 3.38Å; C281-I284 PolarHBondContact O-N 3.34Å; C281-V285 VanDerWaalsContact O-CG2 3.29Å; C281-V285 WeakPolarHBondContact O-CG2 3.44Å; C281-V285 PolarHBondContact O-N 3.14Å |
| 282 | V | 93.3 | Very high | 86.9 | Confident | 1 Ų | 1 | 47.6 Ų | 47.6 | 1% | 0.006 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -70.3 | -32.6 | -177.8 | -178.5 | 0 | 0 | 0 | 0 | 111.5 | L230 L233 V234 P278 V279 V285 S286 V431 | L230-V282 HydrophobicContact CB-CG1 4.37Å; L230-V282 HydrophobicContact CD2-CG1 4.04Å; L233-V282 HydrophobicContact CB-CG2 4.41Å; L233-V282 HydrophobicContact CD2-CG1 4.43Å; L233-V282 HydrophobicContact CD2-CG2 3.88Å; L233-V282 HydrophobicContact CG-CG2 3.81Å; V234-V282 HydrophobicContact CB-CB 4.38Å; V234-V282 HydrophobicContact CB-CG2 3.92Å; V234-V282 HydrophobicContact CG2-CG2 4.44Å; P278-V282 WeakPolarHBondContact O-CG2 3.33Å; P278-V282 PolarHBondContact O-N 3.34Å; V279-V282 PolarHBondContact O-N 2.74Å; V282-V285 PolarHBondContact O-N 3.21Å; V282-S286 WeakPolarHBondContact O-CB 3.21Å; V282-S286 PolarHBondContact O-N 3.48Å; V282-S286 PolarHBondContact O-OG 3.22Å; V282-V431 HydrophobicContact CB-CG2 4.21Å; V282-V431 HydrophobicContact CG1-CG2 3.61Å |
| 283 | W | 90.4 | Very high | 85.4 | Confident | 75 Ų | 75 | 50 Ų | 50 | 28% | 0.284 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -64.3 | -44.2 | 174.2 | -168.3 | 17 | 0 | 0 | 0 | 111.6 | V279 A280 C281 S286 A287 T426 I427 | V279-W283 WeakPolarHBondContact O-CB 3.2Å; V279-W283 PolarHBondContact O-N 3.22Å; A280-W283 PolarHBondContact O-N 3.01Å; C281-W283 VanDerWaalsContact C-N 3.33Å; C281-W283 PolarHBondContact O-N 3.38Å; W283-S286 PolarHBondContact O-N 2.93Å; W283-S286 PolarHBondContact O-OG 2.91Å; W283-A287 PolarHBondContact O-N 3.49Å; W283-T426 WeakPolarHBondContact CZ2-OG1 3.41Å; W283-T426 PolarHBondContact NE1-O 2.92Å; W283-I427 HydrophobicContact CD2-CG1 4.31Å; W283-I427 HydrophobicContact CH2-CG1 4.25Å; W283-I427 HydrophobicContact CZ2-CG1 4.04Å; W283-I427 HydrophobicContact CZ3-CG1 4.47Å |
| 284 | I | 90.4 | Very high | 83.9 | Confident | 98 Ų | 98 | 51.8 Ų | 51.8 | 50% | 0.503 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -62.7 | -46.4 | 174.1 | -68.9 | 165 | 0 | 0 | 0 | 111.2 | A280 C281 S286 A287 F288 | A280-I284 WeakPolarHBondContact O-CB 3.35Å; A280-I284 WeakPolarHBondContact O-CD1 3.06Å; A280-I284 VanDerWaalsContact O-CG1 3.24Å; A280-I284 WeakPolarHBondContact O-CG1 2.97Å; A280-I284 PolarHBondContact O-N 3.08Å; C281-I284 PolarHBondContact O-N 3.34Å; I284-S286 VanDerWaalsContact C-N 3.31Å; I284-S286 PolarHBondContact O-N 3.32Å; I284-A287 WeakPolarHBondContact O-CB 3.5Å; I284-A287 PolarHBondContact O-N 3Å; I284-A287 VanDerWaalsContact O-N 3.15Å; I284-F288 HydrophobicContact CG2-CD2 3.63Å; I284-F288 HydrophobicContact CG2-CE2 3.39Å; I284-F288 VanDerWaalsContact O-CD2 3.24Å; I284-F288 WeakPolarHBondContact O-CD2 3.43Å; I284-F288 PolarHBondContact O-N 3.04Å |
| 285 | V | 90.2 | Very high | 82 | Confident | 57 Ų | 57 | 52.7 Ų | 52.7 | 35% | 0.345 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -59.8 | -42 | 177.2 | 169.2 | 0 | 0 | 0 | 0 | 111.2 | C281 V282 A287 F288 L289 | C281-V285 VanDerWaalsContact O-CG2 3.29Å; C281-V285 WeakPolarHBondContact O-CG2 3.44Å; C281-V285 PolarHBondContact O-N 3.14Å; V282-V285 PolarHBondContact O-N 3.21Å; V285-A287 VanDerWaalsContact C-N 3.31Å; V285-A287 PolarHBondContact O-N 3.49Å; V285-F288 PolarHBondContact O-N 3.11Å; V285-L289 HydrophobicContact CG1-CD1 3.62Å; V285-L289 HydrophobicContact CG1-CG 4.37Å; V285-L289 WeakPolarHBondContact O-CB 3.43Å; V285-L289 VanDerWaalsContact O-CG 3.31Å; V285-L289 WeakPolarHBondContact O-CG 3.12Å; V285-L289 PolarHBondContact O-N 3.43Å |
| 286 | S | 87.7 | Confident | 80 | Confident | 3 Ų | 3 | 61 Ų | 61 | 2% | 0.021 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -63.6 | -36.8 | 176.9 | 72.4 | 0 | 0 | 0 | 0 | 112.6 | V282 W283 I284 G290 F291 P428 | V282-S286 WeakPolarHBondContact O-CB 3.21Å; V282-S286 PolarHBondContact O-N 3.48Å; V282-S286 PolarHBondContact O-OG 3.22Å; W283-S286 PolarHBondContact O-N 2.93Å; W283-S286 PolarHBondContact O-OG 2.91Å; I284-S286 VanDerWaalsContact C-N 3.31Å; I284-S286 PolarHBondContact O-N 3.32Å; S286-G290 PolarHBondContact O-N 3.47Å; S286-F291 PolarHBondContact O-N 3.32Å; S286-F291 VanDerWaalsContact O-N 3.11Å; S286-P428 VanDerWaalsContact OG-CG 3.27Å; S286-P428 WeakPolarHBondContact OG-CG 2.92Å |
| 287 | A | 86 | Confident | 77.9 | Confident | 71 Ų | 71 | 65.8 Ų | 65.8 | 59% | 0.587 | 37% | 0.365 | S | S | * | . | H | α-helix | trans | -66.9 | -42.5 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | W283 I284 V285 G290 | W283-A287 PolarHBondContact O-N 3.49Å; I284-A287 WeakPolarHBondContact O-CB 3.5Å; I284-A287 PolarHBondContact O-N 3Å; I284-A287 VanDerWaalsContact O-N 3.15Å; V285-A287 VanDerWaalsContact C-N 3.31Å; V285-A287 PolarHBondContact O-N 3.49Å; A287-G290 PolarHBondContact O-N 3.08Å |
| 288 | F | 86.1 | Confident | 75.9 | Confident | 178 Ų | 178 | 63.7 Ų | 63.7 | 78% | 0.781 | 35% | 0.354 | S | S | * | . | H | α-helix | trans | -66.4 | -37.8 | 176.7 | -81 | -65.1 | 0 | 0 | 0 | 113.4 | I284 V285 G290 | I284-F288 HydrophobicContact CG2-CD2 3.63Å; I284-F288 HydrophobicContact CG2-CE2 3.39Å; I284-F288 VanDerWaalsContact O-CD2 3.24Å; I284-F288 WeakPolarHBondContact O-CD2 3.43Å; I284-F288 PolarHBondContact O-N 3.04Å; V285-F288 PolarHBondContact O-N 3.11Å; F288-G290 PolarHBondContact O-N 3.47Å |
| 289 | L | 82.9 | Confident | 73.8 | Confident | 99 Ų | 99 | 65.6 Ų | 65.6 | 52% | 0.518 | 37% | 0.368 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -77.2 | -5.3 | 178.8 | -67.8 | 167.8 | 0 | 0 | 0 | 113.1 | V285 F291 | V285-L289 HydrophobicContact CG1-CD1 3.62Å; V285-L289 HydrophobicContact CG1-CG 4.37Å; V285-L289 WeakPolarHBondContact O-CB 3.43Å; V285-L289 VanDerWaalsContact O-CG 3.31Å; V285-L289 WeakPolarHBondContact O-CG 3.12Å; V285-L289 PolarHBondContact O-N 3.43Å; L289-F291 HydrophobicContact CB-CD2 3.33Å; L289-F291 HydrophobicContact CB-CE2 3.71Å; L289-F291 HydrophobicContact CB-CG 4.26Å; L289-F291 HydrophobicContact CD1-CD2 3.9Å; L289-F291 HydrophobicContact CD1-CE2 4.09Å; L289-F291 HydrophobicContact CD2-CE2 4.48Å; L289-F291 HydrophobicContact CG-CD2 4.2Å; L289-F291 HydrophobicContact CG-CE2 4.32Å; L289-F291 PolarHBondContact O-N 2.85Å |
| 290 | G | 71.7 | Confident | 71.8 | Confident | 60 Ų | 60 | 67.1 Ų | 67.1 | 62% | 0.619 | 38% | 0.38 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 67.9 | 8.7 | -175 | 0 | 0 | 0 | 0 | 0 | 114 | S286 A287 F288 S292 | S286-G290 PolarHBondContact O-N 3.47Å; A287-G290 PolarHBondContact O-N 3.08Å; F288-G290 PolarHBondContact O-N 3.47Å; G290-S292 PolarHBondContact O-N 3.44Å |
| 291 | F | 67.1 | Low | 69.8 | Low | 97 Ų | 97 | 71.5 Ų | 71.5 | 43% | 0.425 | 41% | 0.406 | S | S | . | . | trans | -79.6 | 54.5 | 174.1 | -64.4 | -57.3 | 0 | 0 | 0 | 110.7 | L230 S286 L289 V293 | L230-F291 HydrophobicContact CD1-CB 4.27Å; S286-F291 PolarHBondContact O-N 3.32Å; S286-F291 VanDerWaalsContact O-N 3.11Å; L289-F291 HydrophobicContact CB-CD2 3.33Å; L289-F291 HydrophobicContact CB-CE2 3.71Å; L289-F291 HydrophobicContact CB-CG 4.26Å; L289-F291 HydrophobicContact CD1-CD2 3.9Å; L289-F291 HydrophobicContact CD1-CE2 4.09Å; L289-F291 HydrophobicContact CD2-CE2 4.48Å; L289-F291 HydrophobicContact CG-CD2 4.2Å; L289-F291 HydrophobicContact CG-CE2 4.32Å; L289-F291 PolarHBondContact O-N 2.85Å; F291-V293 PolarHBondContact O-N 3.38Å | ||
| 292 | S | 58.3 | Low | 67.8 | Low | 65 Ų | 65 | 72.8 Ų | 72.8 | 46% | 0.455 | 41% | 0.412 | S | S | . | . | trans | -81.8 | 74.3 | 168.4 | -159.2 | 0 | 0 | 0 | 0 | 107.4 | G290 I294 | G290-S292 PolarHBondContact O-N 3.44Å; S292-I294 PolarHBondContact O-N 2.6Å; S292-I294 WeakPolarHBondContact OG-CD1 3.43Å; S292-I294 WeakPolarHBondContact OG-CG1 3.47Å | ||
| 293 | V | 55.7 | Low | 66.4 | Low | 55 Ų | 55 | 82.3 Ų | 82.3 | 33% | 0.333 | 45% | 0.453 | S | S | . | . | trans | -72.6 | 67.3 | 167.2 | -173 | 0 | 0 | 0 | 0 | 107.3 | H227 F291 | H227-V293 VanDerWaalsContact CD2-CG2 3.48Å; H227-V293 WeakPolarHBondContact CD2-CG2 3.46Å; H227-V293 WeakPolarHBondContact NE2-CG2 3.34Å; F291-V293 PolarHBondContact O-N 3.38Å | ||
| 294 | I | 56.9 | Low | 65.5 | Low | 60 Ų | 60 | 79.1 Ų | 79.1 | 31% | 0.308 | 44% | 0.443 | S | S | . | . | trans | -72.8 | 131 | 174 | -40.9 | -179.6 | 0 | 0 | 0 | 105.6 | S292 Q296 S299 | S292-I294 PolarHBondContact O-N 2.6Å; S292-I294 WeakPolarHBondContact OG-CD1 3.43Å; S292-I294 WeakPolarHBondContact OG-CG1 3.47Å; I294-Q296 PolarHBondContact O-N 3.43Å; I294-S299 WeakPolarHBondContact CG2-OG 3.36Å | ||
| 295 | P | 53.3 | Low | 65.1 | Low | 19 Ų | 19 | 76.9 Ų | 76.9 | 12% | 0.123 | 44% | 0.435 | C | S | . | . | trans | -58.3 | 112 | 172 | 18.2 | -25.7 | 0 | 0 | 0 | 109.1 | L68 E297 L298 S299 L429 | L68-P295 HydrophobicContact CD1-CB 4.31Å; L68-P295 HydrophobicContact CD1-CG 4.24Å; L68-P295 HydrophobicContact CD2-CB 3.65Å; L68-P295 HydrophobicContact CD2-CG 4.26Å; P295-E297 PolarHBondContact O-N 3.16Å; P295-E297 VanDerWaalsContact O-N 3.12Å; P295-L298 HydrophobicContact CB-CD1 4.18Å; P295-L298 HydrophobicContact CG-CB 4.48Å; P295-L298 HydrophobicContact CG-CD1 4.12Å; P295-L298 PolarHBondContact O-N 3.13Å; P295-S299 PolarHBondContact O-N 3.23Å; P295-S299 PolarHBondContact O-OG 2.96Å; P295-L429 HydrophobicContact CB-CD1 4.21Å; P295-L429 HydrophobicContact CG-CD1 3.85Å | ||
| 296 | Q | 48.8 | Very low | 64.9 | Low | 173 Ų | 173 | 83 Ų | 83 | 81% | 0.808 | 45% | 0.452 | S | S | * | . | G | 310 helix | trans | -59.2 | -27.8 | -175.5 | -165.6 | 156.5 | -16.8 | 0 | 0 | 111.7 | I294 S299 | I294-Q296 PolarHBondContact O-N 3.43Å; Q296-S299 PolarHBondContact O-N 2.93Å |
| 297 | E | 49.5 | Very low | 65 | Low | 122 Ų | 122 | 90 Ų | 90 | 57% | 0.57 | 49% | 0.487 | S | S | * | . | G | 310 helix | trans | -67.7 | -27.9 | 176.2 | -59.2 | -59.1 | 149.9 | 0 | 0 | 114.7 | P295 | P295-E297 PolarHBondContact O-N 3.16Å; P295-E297 VanDerWaalsContact O-N 3.12Å |
| 298 | L | 51.8 | Low | 65.2 | Low | 6 Ų | 6 | 87.8 Ų | 87.8 | 3% | 0.031 | 46% | 0.464 | C | S | . | . | G | 310 helix | trans | -98.6 | -1.8 | 172.1 | -75 | 108.2 | 0 | 0 | 0 | 113.1 | L68 P83 L87 P295 T425 | L68-L298 HydrophobicContact CD1-CD1 4.29Å; L68-L298 HydrophobicContact CD2-CD1 3.1Å; L68-L298 HydrophobicContact CG-CD1 3.43Å; L68-L298 VanDerWaalsContact CG-CD1 3.43Å; P83-L298 HydrophobicContact CB-CD2 4.22Å; P83-L298 HydrophobicContact CB-CG 4.17Å; L87-L298 HydrophobicContact CD1-CD2 4.31Å; P295-L298 HydrophobicContact CB-CD1 4.18Å; P295-L298 HydrophobicContact CG-CB 4.48Å; P295-L298 HydrophobicContact CG-CD1 4.12Å; P295-L298 PolarHBondContact O-N 3.13Å; L298-T425 HydrophobicContact CB-CG2 4.24Å; L298-T425 HydrophobicContact CD2-CG2 3.73Å |
| 299 | S | 50 | Low | 65.4 | Low | 40 Ų | 40 | 84.7 Ų | 84.7 | 28% | 0.28 | 46% | 0.455 | S | S | . | . | trans | -100.2 | 26.4 | -174.4 | -54.1 | 0 | 0 | 0 | 0 | 112.7 | I294 P295 Q296 | I294-S299 WeakPolarHBondContact CG2-OG 3.36Å; P295-S299 PolarHBondContact O-N 3.23Å; P295-S299 PolarHBondContact O-OG 2.96Å; Q296-S299 PolarHBondContact O-N 2.93Å | ||
| 300 | A | 51 | Low | 65.6 | Low | 36 Ų | 36 | 80.3 Ų | 80.3 | 30% | 0.298 | 43% | 0.433 | S | S | . | . | trans | -55 | 129.9 | 178.8 | 0 | 0 | 0 | 0 | 0 | 110.2 | T302 | A300-T302 VanDerWaalsContact C-N 3.29Å; A300-T302 PolarHBondContact O-N 3.47Å | ||
| 301 | P | 52 | Low | 66.3 | Low | 131 Ų | 131 | 81.9 Ų | 81.9 | 85% | 0.851 | 42% | 0.424 | S | S | * | . | trans | -77.4 | 83 | 179 | 30.9 | -32.1 | 0 | 0 | 0 | 108.8 | ||||
| 302 | T | 51.4 | Low | 67.3 | Low | 82 Ų | 82 | 80.2 Ų | 80.2 | 50% | 0.503 | 42% | 0.423 | S | S | . | . | trans | -133.7 | 142.2 | 174.2 | 32.9 | 0 | 0 | 0 | 0 | 110.6 | A300 A304 | A300-T302 VanDerWaalsContact C-N 3.29Å; A300-T302 PolarHBondContact O-N 3.47Å; T302-A304 PolarHBondContact O-N 3.18Å | ||
| 303 | K | 63.8 | Low | 68.2 | Low | 201 Ų | 201 | 78 Ų | 78 | 87% | 0.874 | 41% | 0.41 | S | S | * | . | trans | -66.9 | 75.2 | 177.3 | -80.8 | 176.2 | 176.3 | 174.6 | 0 | 110 | R419 | K303-R419 VanDerWaalsContact CA-NH2 3.31Š| ||
| 304 | A | 70.6 | Confident | 69.2 | Low | 9 Ų | 9 | 78.3 Ų | 78.3 | 7% | 0.074 | 41% | 0.408 | C | S | . | . | trans | -60.1 | 138.6 | 173.7 | 0 | 0 | 0 | 0 | 0 | 109.3 | T302 P418 R419 | T302-A304 PolarHBondContact O-N 3.18Å; A304-P418 HydrophobicContact CB-CB 4.22Å; A304-R419 HydrophobicContact CB-CG 3.92Å; A304-R419 WeakPolarHBondContact O-CD 3.47Å; A304-R419 WeakPolarHBondContact O-CG 3.32Å; A304-R419 PolarHBondContact O-NE 2.93Å | ||
| 305 | P | 83 | Confident | 69.9 | Low | 51 Ų | 51 | 76.7 Ų | 76.7 | 33% | 0.331 | 40% | 0.398 | S | S | . | . | trans | -68.6 | 150 | 178 | 28.4 | -34.9 | 0 | 0 | 0 | 110.8 | W308 P418 R419 | P305-W308 HydrophobicContact CB-CB 4.49Å; P305-W308 HydrophobicContact CG-CB 3.76Å; P305-W308 HydrophobicContact CG-CG 4.4Å; P305-P418 HydrophobicContact CG-CG 4.42Å; P305-R419 WeakPolarHBondContact O-CG 3.47Å | ||
| 306 | W | 86.4 | Confident | 71.3 | Confident | 185 Ų | 185 | 80.3 Ų | 80.3 | 70% | 0.701 | 42% | 0.416 | S | S | * | . | S | Bend | trans | -72.7 | -34.8 | 174.3 | -81.1 | 94.3 | 0 | 0 | 0 | 112.5 | S417 L420 | W306-S417 WeakPolarHBondContact O-CA 3.45Å; W306-S417 WeakPolarHBondContact O-CB 3.36Å; W306-S417 PolarHBondContact O-OG 2.9Å; W306-L420 HydrophobicContact CZ3-CD2 4.46Å |
| 307 | I | 89.6 | Confident | 73.2 | Confident | 149 Ų | 149 | 80.1 Ų | 80.1 | 76% | 0.764 | 41% | 0.408 | S | S | * | . | trans | -126.6 | 122.8 | 177.9 | -59.8 | 170.6 | 0 | 0 | 0 | 107.1 | L416 | I307-L416 CarbonylContact C-O 3.45Å; I307-L416 WeakPolarHBondContact CA-O 3.5Å | ||
| 308 | W | 89.1 | Confident | 75.2 | Confident | 25 Ų | 25 | 75.6 Ų | 75.6 | 10% | 0.095 | 39% | 0.389 | C | S | . | . | trans | -148.5 | 125.1 | 175.9 | 166.5 | 83 | 0 | 0 | 0 | 107.9 | Q85 A88 P305 P310 E314 W315 L416 P418 | Q85-W308 HydrophobicContact CB-CH2 4.4Å; Q85-W308 HydrophobicContact CB-CZ2 4.41Å; Q85-W308 HydrophobicContact CG-CD2 4.36Å; A88-W308 HydrophobicContact CB-CE3 4.29Å; A88-W308 HydrophobicContact CB-CZ3 3.96Å; P305-W308 HydrophobicContact CB-CB 4.49Å; P305-W308 HydrophobicContact CG-CB 3.76Å; P305-W308 HydrophobicContact CG-CG 4.4Å; W308-P310 VanDerWaalsContact CH2-CA 3.44Å; W308-P310 HydrophobicContact CH2-CB 3.41Å; W308-P310 VanDerWaalsContact CH2-CB 3.41Å; W308-P310 HydrophobicContact CH2-CG 4.38Å; W308-P310 HydrophobicContact CZ2-CB 4.19Å; W308-P310 HydrophobicContact CZ3-CB 3.63Å; W308-P310 HydrophobicContact CZ3-CG 4.12Å; W308-P310 WeakPolarHBondContact O-CD 3.33Å; W308-E314 WeakPolarHBondContact CZ2-OE2 3.2Å; W308-E314 PolarHBondContact NE1-OE1 3.26Å; W308-E314 PolarHBondContact NE1-OE2 3.21Å; W308-W315 AromaticContact CH2-CH2 3.14Å; W308-W315 HydrophobicContact CH2-CH2 3.14Å; W308-W315 AromaticContact CH2-CZ2 3.88Å; W308-W315 HydrophobicContact CH2-CZ2 3.88Å; W308-W315 AromaticContact CH2-CZ3 3.89Å; W308-W315 HydrophobicContact CH2-CZ3 3.89Å; W308-W315 AromaticContact CZ2-CH2 3.16Å; W308-W315 HydrophobicContact CZ2-CH2 3.16Å; W308-W315 AromaticContact CZ2-CZ2 3.43Å; W308-W315 HydrophobicContact CZ2-CZ2 3.43Å; W308-W315 VanDerWaalsContact CZ2-CZ2 3.43Å; W308-W315 AromaticContact CZ2-CZ3 3.99Å; W308-W315 HydrophobicContact CZ2-CZ3 3.99Å; W308-W315 HydrophobicContact CZ3-CH2 4.33Å; W308-L416 PolarHBondContact N-O 3.02Å; W308-L416 CarbonylContact O-C 3.24Å; W308-L416 WeakPolarHBondContact O-CA 3.35Å; W308-P418 HydrophobicContact CB-CG 3.85Å; W308-P418 HydrophobicContact CD2-CG 3.95Å; W308-P418 HydrophobicContact CE3-CG 3.6Å; W308-P418 HydrophobicContact CG-CG 4.1Å; W308-P418 HydrophobicContact CZ3-CG 4.48Å | ||
| 309 | L | 90.2 | Very high | 77.1 | Confident | 114 Ų | 114 | 78.5 Ų | 78.5 | 60% | 0.597 | 41% | 0.405 | S | S | * | . | trans | -93.9 | 114 | -179.5 | -179.4 | 66.4 | 0 | 0 | 0 | 108.5 | H311 L416 | L309-H311 PolarHBondContact O-N 2.9Å; L309-L416 HydrophobicContact CD1-CD2 3.5Å; L309-L416 VanDerWaalsContact CD1-CD2 3.5Å | ||
| 310 | P | 86.7 | Confident | 79.1 | Confident | 7 Ų | 7 | 82.2 Ų | 82.2 | 5% | 0.045 | 42% | 0.421 | C | S | . | . | trans | -60.5 | 119.2 | 174.6 | 22.5 | -32.1 | 0 | 0 | 0 | 109.7 | F92 W308 L377 | F92-P310 HydrophobicContact CB-CG 3.76Å; F92-P310 HydrophobicContact CD1-CG 3.64Å; F92-P310 HydrophobicContact CD2-CG 3.91Å; F92-P310 HydrophobicContact CE1-CG 4.17Å; F92-P310 HydrophobicContact CE2-CG 4.42Å; F92-P310 HydrophobicContact CG-CG 3.48Å; F92-P310 VanDerWaalsContact CG-CG 3.48Å; W308-P310 VanDerWaalsContact CH2-CA 3.44Å; W308-P310 HydrophobicContact CH2-CB 3.41Å; W308-P310 VanDerWaalsContact CH2-CB 3.41Å; W308-P310 HydrophobicContact CH2-CG 4.38Å; W308-P310 HydrophobicContact CZ2-CB 4.19Å; W308-P310 HydrophobicContact CZ3-CB 3.63Å; W308-P310 HydrophobicContact CZ3-CG 4.12Å; W308-P310 WeakPolarHBondContact O-CD 3.33Å; P310-L377 HydrophobicContact CB-CD1 4.19Å; P310-L377 HydrophobicContact CB-CD2 4.02Å; P310-L377 HydrophobicContact CG-CD1 4.49Å; P310-L377 WeakPolarHBondContact O-CD2 3.48Å | ||
| 311 | H | 87.1 | Confident | 81.1 | Confident | 93 Ų | 93 | 81.7 Ų | 81.7 | 43% | 0.431 | 41% | 0.414 | S | S | . | . | trans | -115.5 | 144.2 | 176.4 | 64.9 | 87.1 | 0 | 0 | 0 | 112.2 | L309 G313 E314 | L309-H311 PolarHBondContact O-N 2.9Å; H311-G313 PolarHBondContact O-N 3.13Å; H311-E314 IonicContact CD2-OE2 3.92Å; H311-E314 PolarHBondContact CD2-OE2 3.44Å; H311-E314 VanDerWaalsContact CE1-CA 3.49Å; H311-E314 WeakPolarHBondContact CE1-CA 3.46Å; H311-E314 WeakPolarHBondContact CE1-CB 3.05Å; H311-E314 WeakPolarHBondContact CE1-CG 3.21Å; H311-E314 IonicContact CE1-OE2 3.56Å; H311-E314 IonicContact CG-OE2 3.83Å; H311-E314 VanDerWaalsContact NE2-CG 3.31Å; H311-E314 WeakPolarHBondContact NE2-CG 3.48Å; H311-E314 IonicContact NE2-OE1 3.31Å; H311-E314 IonicContact NE2-OE2 3.62Å; H311-E314 PolarHBondContact NE2-OE2 3.39Å; H311-E314 PolarHBondContact O-N 3.45Å | ||
| 312 | P | 87.9 | Confident | 83.1 | Confident | 62 Ų | 62 | 79.7 Ų | 79.7 | 40% | 0.403 | 40% | 0.401 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -55.8 | 137.2 | 176.9 | -26.8 | 35.2 | 0 | 0 | 0 | 112.2 | E314 W317 L376 L377 | P312-E314 VanDerWaalsContact C-N 3.27Å; P312-E314 PolarHBondContact O-N 2.84Å; P312-W317 HydrophobicContact CB-CH2 4.23Å; P312-W317 HydrophobicContact CB-CZ3 4.34Å; P312-L376 WeakPolarHBondContact CA-O 3.29Å; P312-L376 HydrophobicContact CB-CB 4.34Å; P312-L377 HydrophobicContact CG-CD2 4.18Å |
| 313 | G | 78.4 | Confident | 85.1 | Confident | 19 Ų | 19 | 78.6 Ų | 78.6 | 20% | 0.196 | 39% | 0.388 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 73.5 | 7.2 | 174.8 | 0 | 0 | 0 | 0 | 0 | 116.1 | H311 W315 N316 L376 | H311-G313 PolarHBondContact O-N 3.13Å; G313-W315 PolarHBondContact O-N 3.27Å; G313-N316 PolarHBondContact O-N 2.74Å; G313-N316 VanDerWaalsContact O-N 3.12Å; G313-L376 PolarHBondContact N-O 2.91Å |
| 314 | E | 75.7 | Confident | 86.5 | Confident | 60 Ų | 60 | 69 Ų | 69 | 28% | 0.28 | 35% | 0.346 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -54.3 | -36.1 | 175 | -169 | 166.2 | 171 | 0 | 0 | 112.4 | W308 H311 P312 | W308-E314 WeakPolarHBondContact CZ2-OE2 3.2Å; W308-E314 PolarHBondContact NE1-OE1 3.26Å; W308-E314 PolarHBondContact NE1-OE2 3.21Å; H311-E314 IonicContact CD2-OE2 3.92Å; H311-E314 PolarHBondContact CD2-OE2 3.44Å; H311-E314 VanDerWaalsContact CE1-CA 3.49Å; H311-E314 WeakPolarHBondContact CE1-CA 3.46Å; H311-E314 WeakPolarHBondContact CE1-CB 3.05Å; H311-E314 WeakPolarHBondContact CE1-CG 3.21Å; H311-E314 IonicContact CE1-OE2 3.56Å; H311-E314 IonicContact CG-OE2 3.83Å; H311-E314 VanDerWaalsContact NE2-CG 3.31Å; H311-E314 WeakPolarHBondContact NE2-CG 3.48Å; H311-E314 IonicContact NE2-OE1 3.31Å; H311-E314 IonicContact NE2-OE2 3.62Å; H311-E314 PolarHBondContact NE2-OE2 3.39Å; H311-E314 PolarHBondContact O-N 3.45Å; P312-E314 VanDerWaalsContact C-N 3.27Å; P312-E314 PolarHBondContact O-N 2.84Å |
| 315 | W | 72.3 | Confident | 87.7 | Confident | 26 Ų | 26 | 73 Ų | 73 | 10% | 0.098 | 37% | 0.366 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -105.1 | 28.6 | -177.5 | -63.7 | -52.3 | 0 | 0 | 0 | 113.4 | Y81 Q85 W308 G313 L377 | Y81-W315 HydrophobicContact CD1-CB 3.89Å; Y81-W315 AromaticContact CD1-CD1 3.09Å; Y81-W315 HydrophobicContact CD1-CD2 4.46Å; Y81-W315 AromaticContact CD1-CG 3.53Å; Y81-W315 HydrophobicContact CD1-CG 3.53Å; Y81-W315 AromaticContact CD1-NE1 3.73Å; Y81-W315 HydrophobicContact CE1-CB 3.39Å; Y81-W315 AromaticContact CE1-CD1 3.38Å; Y81-W315 AromaticContact CE1-CG 3.58Å; Y81-W315 HydrophobicContact CE1-CG 3.58Å; Y81-W315 HydrophobicContact CG-CG 4.45Å; Y81-W315 PolarHBondContact OH-O 3.24Å; Y81-W315 VanDerWaalsContact OH-O 3.13Å; Q85-W315 HydrophobicContact CB-CH2 3.93Å; Q85-W315 HydrophobicContact CB-CZ2 3.59Å; Q85-W315 HydrophobicContact CG-CZ2 4.41Å; W308-W315 AromaticContact CH2-CH2 3.14Å; W308-W315 HydrophobicContact CH2-CH2 3.14Å; W308-W315 AromaticContact CH2-CZ2 3.88Å; W308-W315 HydrophobicContact CH2-CZ2 3.88Å; W308-W315 AromaticContact CH2-CZ3 3.89Å; W308-W315 HydrophobicContact CH2-CZ3 3.89Å; W308-W315 AromaticContact CZ2-CH2 3.16Å; W308-W315 HydrophobicContact CZ2-CH2 3.16Å; W308-W315 AromaticContact CZ2-CZ2 3.43Å; W308-W315 HydrophobicContact CZ2-CZ2 3.43Å; W308-W315 VanDerWaalsContact CZ2-CZ2 3.43Å; W308-W315 AromaticContact CZ2-CZ3 3.99Å; W308-W315 HydrophobicContact CZ2-CZ3 3.99Å; W308-W315 HydrophobicContact CZ3-CH2 4.33Å; G313-W315 PolarHBondContact O-N 3.27Å; W315-L377 WeakPolarHBondContact CZ3-O 3.37Å |
| 316 | N | 82.4 | Confident | 88.3 | Confident | 95 Ų | 95 | 71 Ų | 71 | 51% | 0.508 | 35% | 0.353 | S | S | . | . | trans | 73.6 | 158.2 | -165.2 | -46 | -83.1 | 0 | 0 | 0 | 113 | Q171 G313 | Q171-N316 HydrophobicContact CG-CB 4.46Å; Q171-N316 VanDerWaalsContact NE2-CB 3.29Å; Q171-N316 PolarHBondContact NE2-ND2 3.37Å; Q171-N316 VanDerWaalsContact NE2-ND2 3.15Å; G313-N316 PolarHBondContact O-N 2.74Å; G313-N316 VanDerWaalsContact O-N 3.12Å | ||
| 317 | W | 88.9 | Confident | 88.7 | Confident | 169 Ų | 169 | 62.1 Ų | 62.1 | 64% | 0.64 | 32% | 0.319 | S | S | * | . | P | Polyproline II helix | trans | -69.1 | 147.5 | 177.7 | -69.4 | 99.1 | 0 | 0 | 0 | 111.9 | P312 L319 L376 | P312-W317 HydrophobicContact CB-CH2 4.23Å; P312-W317 HydrophobicContact CB-CZ3 4.34Å; W317-L319 PolarHBondContact O-N 3.45Å; W317-L376 HydrophobicContact CE3-CD2 4.45Å; W317-L376 HydrophobicContact CZ3-CD2 4.14Å |
| 318 | P | 90.9 | Very high | 89 | Confident | 27 Ų | 27 | 55 Ų | 55 | 18% | 0.175 | 28% | 0.283 | C | S | . | . | P | Polyproline II helix | trans | -55.9 | 136.2 | 174.8 | 21 | -31.5 | 0 | 0 | 0 | 111.4 | V178 L376 | V178-P318 HydrophobicContact CG2-CB 4.28Å; V178-P318 HydrophobicContact CG2-CG 4.05Å; P318-L376 HydrophobicContact CG-CD2 4.24Å |
| 319 | L | 91.1 | Very high | 89.4 | Confident | 68 Ų | 68 | 56.5 Ų | 56.5 | 36% | 0.356 | 29% | 0.292 | S | S | . | . | P | Polyproline II helix | trans | -94.9 | 116.6 | -178.3 | -175 | 63.2 | 0 | 0 | 0 | 110.4 | Q171 E172 W317 T321 | Q171-L319 HydrophobicContact CB-CB 3.9Å; Q171-L319 PolarHBondContact O-N 3.42Å; E172-L319 HydrophobicContact CG-CB 4.13Å; E172-L319 HydrophobicContact CG-CD2 3.83Å; E172-L319 HydrophobicContact CG-CG 4.14Å; W317-L319 PolarHBondContact O-N 3.45Å; L319-T321 HydrophobicContact CD2-CG2 4.05Å; L319-T321 HydrophobicContact CG-CG2 3.98Å; L319-T321 PolarHBondContact O-N 3.4Å |
| 320 | L | 93.4 | Very high | 89.7 | Confident | 117 Ų | 117 | 51 Ų | 51 | 61% | 0.613 | 26% | 0.263 | S | S | * | . | trans | -92.5 | 90.9 | 179.2 | -61.6 | 177.7 | 0 | 0 | 0 | 110.5 | V179 | V179-L320 HydrophobicContact CG2-CD2 3.67Š| ||
| 321 | T | 93.1 | Very high | 90.1 | Very high | 26 Ų | 26 | 50.7 Ų | 50.7 | 16% | 0.16 | 26% | 0.261 | C | S | . | . | trans | -95.5 | 159.3 | 168.7 | 68.1 | 0 | 0 | 0 | 0 | 110.9 | E172 L319 R323 A324 L325 | E172-T321 HydrophobicContact CG-CG2 3.85Å; L319-T321 HydrophobicContact CD2-CG2 4.05Å; L319-T321 HydrophobicContact CG-CG2 3.98Å; L319-T321 PolarHBondContact O-N 3.4Å; T321-R323 PolarHBondContact O-N 3.18Å; T321-A324 WeakPolarHBondContact O-CA 3.46Å; T321-A324 WeakPolarHBondContact O-CB 3.46Å; T321-A324 PolarHBondContact O-N 3.2Å; T321-A324 WeakPolarHBondContact OG1-CB 3.28Å; T321-A324 PolarHBondContact OG1-N 3.18Å; T321-A324 VanDerWaalsContact OG1-N 3.1Å; T321-L325 PolarHBondContact O-N 3.5Å | ||
| 322 | P | 93.9 | Very high | 90.6 | Very high | 88 Ų | 88 | 46.3 Ų | 46.3 | 57% | 0.571 | 24% | 0.241 | S | C | * | . | H | α-helix | trans | -55.5 | -34.2 | 173.6 | -28.7 | 36.8 | 0 | 0 | 0 | 113.5 | L325 A326 P492 | P322-L325 WeakPolarHBondContact O-CB 3.49Å; P322-L325 PolarHBondContact O-N 2.96Å; P322-A326 PolarHBondContact O-N 3.39Å; P322-P492 HydrophobicContact CB-CB 4.24Å; P322-P492 HydrophobicContact CB-CG 3.58Å |
| 323 | R | 92.1 | Very high | 91 | Very high | 60 Ų | 60 | 45.9 Ų | 45.9 | 23% | 0.226 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -68.8 | -40.5 | 173.8 | -67.3 | -176.7 | -67.6 | 168.1 | -6 | 112.2 | L125 K129 T321 L325 A326 A327 V495 | L125-R323 HydrophobicContact CD1-CB 3.64Å; K129-R323 VanDerWaalsContact CE-NH2 3.29Å; T321-R323 PolarHBondContact O-N 3.18Å; R323-L325 VanDerWaalsContact C-N 3.33Å; R323-A326 PolarHBondContact O-N 3.42Å; R323-A327 WeakPolarHBondContact O-CB 3.43Å; R323-A327 PolarHBondContact O-N 2.94Å; R323-V495 HydrophobicContact CB-CG2 4.27Å; R323-V495 HydrophobicContact CG-CG2 4.17Å |
| 324 | A | 93.2 | Very high | 91.8 | Very high | 0 Ų | 0 | 45 Ų | 45 | 0% | 0 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -64 | -38.1 | 173.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | E172 A176 T321 A327 G328 | E172-A324 HydrophobicContact CB-CB 4.43Å; E172-A324 WeakPolarHBondContact O-CB 3.43Å; A176-A324 WeakPolarHBondContact CA-O 3.18Å; A176-A324 HydrophobicContact CB-CB 4.3Å; A176-A324 VanDerWaalsContact CB-O 3.25Å; A176-A324 WeakPolarHBondContact CB-O 3.42Å; T321-A324 WeakPolarHBondContact O-CA 3.46Å; T321-A324 WeakPolarHBondContact O-CB 3.46Å; T321-A324 PolarHBondContact O-N 3.2Å; T321-A324 WeakPolarHBondContact OG1-CB 3.28Å; T321-A324 PolarHBondContact OG1-N 3.18Å; T321-A324 VanDerWaalsContact OG1-N 3.1Å; A324-A327 PolarHBondContact O-N 3.35Å; A324-G328 PolarHBondContact O-N 3.26Å |
| 325 | L | 96.3 | Very high | 92.7 | Very high | 93 Ų | 93 | 42.1 Ų | 42.1 | 49% | 0.487 | 21% | 0.212 | S | C | . | . | H | α-helix | trans | -59.8 | -49.3 | 172.6 | 179.5 | 67.4 | 0 | 0 | 0 | 111 | V179 T321 P322 R323 G328 I329 | V179-L325 HydrophobicContact CG1-CD1 3.7Å; V179-L325 HydrophobicContact CG2-CD1 4.17Å; T321-L325 PolarHBondContact O-N 3.5Å; P322-L325 WeakPolarHBondContact O-CB 3.49Å; P322-L325 PolarHBondContact O-N 2.96Å; R323-L325 VanDerWaalsContact C-N 3.33Å; L325-G328 PolarHBondContact O-N 3.4Å; L325-I329 HydrophobicContact CD1-CD1 4.44Å; L325-I329 HydrophobicContact CG-CD1 4.19Å; L325-I329 VanDerWaalsContact O-CG1 3.31Å; L325-I329 WeakPolarHBondContact O-CG1 3.39Å; L325-I329 PolarHBondContact O-N 3.26Å |
| 326 | A | 95.1 | Very high | 93.8 | Very high | 7 Ų | 7 | 41.1 Ų | 41.1 | 6% | 0.058 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -59.6 | -47.6 | 176.8 | 0 | 0 | 0 | 0 | 0 | 113 | P322 R323 G328 I329 S330 P492 V495 L496 | P322-A326 PolarHBondContact O-N 3.39Å; R323-A326 PolarHBondContact O-N 3.42Å; A326-G328 VanDerWaalsContact C-N 3.33Å; A326-G328 PolarHBondContact O-N 3.02Å; A326-I329 PolarHBondContact O-N 3.37Å; A326-S330 PolarHBondContact O-N 3.38Å; A326-S330 VanDerWaalsContact O-N 3.12Å; A326-P492 HydrophobicContact CB-CB 4.12Å; A326-P492 WeakPolarHBondContact CB-O 3.5Å; A326-V495 HydrophobicContact CB-CB 4.28Å; A326-V495 HydrophobicContact CB-CG1 4.24Å; A326-L496 HydrophobicContact CB-CB 3.98Å; A326-L496 VanDerWaalsContact O-CD1 3.3Å; A326-L496 WeakPolarHBondContact O-CD1 3.48Å |
| 327 | A | 94.4 | Very high | 94.4 | Very high | 0 Ų | 0 | 38.6 Ų | 38.6 | 0% | 0 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -61.4 | -42.3 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | L125 A176 R323 A324 I329 S330 M331 V495 | L125-A327 HydrophobicContact CB-CB 4.18Å; L125-A327 HydrophobicContact CD1-CB 4.37Å; L125-A327 HydrophobicContact CD2-CB 3.95Å; L125-A327 HydrophobicContact CG-CB 4.41Å; A176-A327 HydrophobicContact CB-CB 4Å; R323-A327 WeakPolarHBondContact O-CB 3.43Å; R323-A327 PolarHBondContact O-N 2.94Å; A324-A327 PolarHBondContact O-N 3.35Å; A327-I329 PolarHBondContact O-N 3.24Å; A327-S330 WeakPolarHBondContact O-CB 3.37Å; A327-S330 PolarHBondContact O-N 3.28Å; A327-M331 VanDerWaalsContact O-CG 3.27Å; A327-M331 WeakPolarHBondContact O-CG 3.22Å; A327-M331 PolarHBondContact O-N 2.67Å; A327-V495 HydrophobicContact CB-CG1 3.94Å |
| 328 | G | 96.5 | Very high | 94.6 | Very high | 0 Ų | 0 | 30.6 Ų | 30.6 | 0% | 0 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -64 | -38.5 | 178.6 | 0 | 0 | 0 | 0 | 0 | 113.4 | A176 S180 A324 L325 A326 M331 A332 | A176-G328 WeakPolarHBondContact O-CA 3.12Å; S180-G328 WeakPolarHBondContact CA-O 3.4Å; S180-G328 WeakPolarHBondContact CB-O 3.4Å; A324-G328 PolarHBondContact O-N 3.26Å; L325-G328 PolarHBondContact O-N 3.4Å; A326-G328 VanDerWaalsContact C-N 3.33Å; A326-G328 PolarHBondContact O-N 3.02Å; G328-M331 PolarHBondContact O-N 3.46Å; G328-A332 WeakPolarHBondContact O-CB 3.31Å; G328-A332 PolarHBondContact O-N 2.95Å |
| 329 | I | 97.4 | Very high | 94.8 | Very high | 55 Ų | 55 | 29.3 Ų | 29.3 | 28% | 0.282 | 16% | 0.159 | S | C | . | . | H | α-helix | trans | -61.7 | -46.3 | 172 | -67 | 163.1 | 0 | 0 | 0 | 110.3 | L183 L325 A326 A327 A332 L333 L496 | L183-I329 HydrophobicContact CD2-CB 4.23Å; L183-I329 HydrophobicContact CD2-CG1 4.03Å; L183-I329 HydrophobicContact CD2-CG2 4.13Å; L325-I329 HydrophobicContact CD1-CD1 4.44Å; L325-I329 HydrophobicContact CG-CD1 4.19Å; L325-I329 VanDerWaalsContact O-CG1 3.31Å; L325-I329 WeakPolarHBondContact O-CG1 3.39Å; L325-I329 PolarHBondContact O-N 3.26Å; A326-I329 PolarHBondContact O-N 3.37Å; A327-I329 PolarHBondContact O-N 3.24Å; I329-A332 PolarHBondContact O-N 2.88Å; I329-L333 HydrophobicContact CG2-CD1 4.18Å; I329-L333 WeakPolarHBondContact O-CG 3.17Å; I329-L333 PolarHBondContact O-N 3.49Å; I329-L333 VanDerWaalsContact O-N 3.1Å; I329-L496 HydrophobicContact CB-CD1 3.97Å; I329-L496 HydrophobicContact CG2-CD1 3.83Å |
| 330 | S | 95.9 | Very high | 95 | Very high | 0 Ų | 0 | 27.1 Ų | 27.1 | 0% | 0 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -61 | -45.7 | 177.2 | 174.4 | 0 | 0 | 0 | 0 | 112.3 | S121 A326 A327 A332 L333 A334 S499 L500 | S121-S330 PolarHBondContact OG-OG 3.22Å; A326-S330 PolarHBondContact O-N 3.38Å; A326-S330 VanDerWaalsContact O-N 3.12Å; A327-S330 WeakPolarHBondContact O-CB 3.37Å; A327-S330 PolarHBondContact O-N 3.28Å; S330-A332 VanDerWaalsContact C-N 3.33Å; S330-A332 PolarHBondContact O-N 3.27Å; S330-L333 PolarHBondContact O-N 2.64Å; S330-A334 WeakPolarHBondContact O-CB 3.47Å; S330-A334 PolarHBondContact O-N 3.31Å; S330-S499 WeakPolarHBondContact OG-CB 3.45Å; S330-L500 PolarHBondContact OG-N 2.79Å |
| 331 | M | 96.4 | Very high | 95 | Very high | 0 Ų | 0 | 21.9 Ų | 21.9 | 0% | 0 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -57.6 | -45.8 | 175.2 | -70.3 | 173.7 | -176.8 | 0 | 0 | 111.2 | F118 A122 A176 V177 S180 A327 G328 L333 A335 | F118-M331 HydrophobicContact CD1-CB 3.8Å; F118-M331 HydrophobicContact CD1-CG 3.93Å; F118-M331 HydrophobicContact CD1-SD 3.79Å; F118-M331 HydrophobicContact CE1-CB 3.94Å; A122-M331 HydrophobicContact CB-CE 3.94Å; A176-M331 HydrophobicContact CB-CE 4Å; A176-M331 HydrophobicContact CB-SD 3.99Å; V177-M331 HydrophobicContact CG2-SD 4.21Å; S180-M331 WeakPolarHBondContact OG-CB 3.27Å; A327-M331 VanDerWaalsContact O-CG 3.27Å; A327-M331 WeakPolarHBondContact O-CG 3.22Å; A327-M331 PolarHBondContact O-N 2.67Å; G328-M331 PolarHBondContact O-N 3.46Å; M331-L333 PolarHBondContact O-N 3.4Å; M331-A335 VanDerWaalsContact O-CB 3.26Å; M331-A335 WeakPolarHBondContact O-CB 3.28Å; M331-A335 PolarHBondContact O-N 2.87Å |
| 332 | A | 96.9 | Very high | 95 | Very high | 0 Ų | 0 | 20.7 Ų | 20.7 | 0% | 0 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -59.8 | -49.9 | -178.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | S180 L183 Q184 G328 I329 S330 S336 | S180-A332 WeakPolarHBondContact OG-CA 3.49Å; S180-A332 PolarHBondContact OG-N 2.92Å; L183-A332 HydrophobicContact CB-CB 3.87Å; L183-A332 HydrophobicContact CD2-CB 3.66Å; L183-A332 HydrophobicContact CG-CB 3.88Å; Q184-A332 HydrophobicContact CG-CB 4.02Å; Q184-A332 PolarHBondContact NE2-O 3.18Å; G328-A332 WeakPolarHBondContact O-CB 3.31Å; G328-A332 PolarHBondContact O-N 2.95Å; I329-A332 PolarHBondContact O-N 2.88Å; S330-A332 VanDerWaalsContact C-N 3.33Å; S330-A332 PolarHBondContact O-N 3.27Å; A332-S336 VanDerWaalsContact O-CB 3.24Å; A332-S336 WeakPolarHBondContact O-CB 3.28Å; A332-S336 PolarHBondContact O-N 2.94Å; A332-S336 PolarHBondContact O-OG 3.14Å |
| 333 | L | 96.1 | Very high | 95 | Very high | 53 Ų | 53 | 16.5 Ų | 16.5 | 28% | 0.277 | 9% | 0.087 | S | C | . | . | H | α-helix | trans | -64.4 | -48.5 | -178.2 | -67.5 | 175.8 | 0 | 0 | 0 | 111.1 | M187 I329 S330 M331 S336 T337 L500 F506 | M187-L333 HydrophobicContact CE-CD2 4.33Å; M187-L333 HydrophobicContact SD-CD2 4.35Å; I329-L333 HydrophobicContact CG2-CD1 4.18Å; I329-L333 WeakPolarHBondContact O-CG 3.17Å; I329-L333 PolarHBondContact O-N 3.49Å; I329-L333 VanDerWaalsContact O-N 3.1Å; S330-L333 PolarHBondContact O-N 2.64Å; M331-L333 PolarHBondContact O-N 3.4Å; L333-S336 PolarHBondContact O-N 3.46Å; L333-T337 PolarHBondContact O-N 2.94Å; L333-T337 PolarHBondContact O-OG1 3.42Å; L333-T337 VanDerWaalsContact O-OG1 3.04Å; L333-L500 HydrophobicContact CB-CD2 4.23Å; L333-L500 HydrophobicContact CD1-CD1 4.49Å; L333-L500 HydrophobicContact CD1-CD2 4.16Å; L333-F506 HydrophobicContact CB-CD2 4.37Å; L333-F506 HydrophobicContact CB-CE2 3.96Å |
| 334 | A | 95.3 | Very high | 95 | Very high | 0 Ų | 0 | 14.1 Ų | 14.1 | 0% | 0 | 8% | 0.08 | C | C | . | . | H | α-helix | trans | -63.4 | -47.7 | -178.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | E117 S330 S336 T337 S338 Q503 F506 | E117-A334 HydrophobicContact CB-CB 3.92Å; E117-A334 HydrophobicContact CG-CB 4.1Å; S330-A334 WeakPolarHBondContact O-CB 3.47Å; S330-A334 PolarHBondContact O-N 3.31Å; A334-S336 VanDerWaalsContact C-N 3.35Å; A334-S336 PolarHBondContact O-N 3.37Å; A334-T337 PolarHBondContact O-N 3.43Å; A334-S338 WeakPolarHBondContact O-CB 3.33Å; A334-S338 PolarHBondContact O-N 3Å; A334-Q503 HydrophobicContact CB-CB 4.16Å; A334-Q503 HydrophobicContact CB-CG 3.76Å; A334-F506 HydrophobicContact CB-CB 4.22Å |
| 335 | A | 95.5 | Very high | 95 | Very high | 0 Ų | 0 | 14.1 Ų | 14.1 | 0% | 0 | 8% | 0.08 | C | C | . | . | H | α-helix | trans | -67.2 | -34 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | E117 F118 Q184 M331 T337 S338 S339 A384 | E117-A335 HydrophobicContact CB-CB 4.5Å; F118-A335 HydrophobicContact CE2-CB 3.74Å; F118-A335 HydrophobicContact CZ-CB 3.85Å; Q184-A335 VanDerWaalsContact NE2-CB 3.25Å; M331-A335 VanDerWaalsContact O-CB 3.26Å; M331-A335 WeakPolarHBondContact O-CB 3.28Å; M331-A335 PolarHBondContact O-N 2.87Å; A335-T337 PolarHBondContact O-N 3.48Å; A335-S338 PolarHBondContact O-N 2.94Å; A335-S339 WeakPolarHBondContact O-CB 3.15Å; A335-S339 PolarHBondContact O-N 3.44Å; A335-S339 PolarHBondContact O-OG 2.94Å; A335-A384 HydrophobicContact CB-CB 4.12Å |
| 336 | S | 95.4 | Very high | 94.8 | Very high | 6 Ų | 6 | 9.7 Ų | 9.7 | 4% | 0.042 | 6% | 0.057 | C | C | . | . | H | α-helix | trans | -61.4 | -45.7 | 173.7 | -60.1 | 0 | 0 | 0 | 0 | 112 | A332 L333 A334 S339 L340 | A332-S336 VanDerWaalsContact O-CB 3.24Å; A332-S336 WeakPolarHBondContact O-CB 3.28Å; A332-S336 PolarHBondContact O-N 2.94Å; A332-S336 PolarHBondContact O-OG 3.14Å; L333-S336 PolarHBondContact O-N 3.46Å; A334-S336 VanDerWaalsContact C-N 3.35Å; A334-S336 PolarHBondContact O-N 3.37Å; S336-S339 PolarHBondContact O-N 2.88Å; S336-L340 WeakPolarHBondContact O-CG 3.3Å; S336-L340 PolarHBondContact O-N 3.36Å; S336-L340 VanDerWaalsContact O-N 3.08Å |
| 337 | T | 93.8 | Very high | 94.5 | Very high | 42 Ų | 42 | 9.5 Ų | 9.5 | 26% | 0.258 | 6% | 0.055 | S | C | . | . | H | α-helix | trans | -62.7 | -44.9 | 177.5 | -52.1 | 0 | 0 | 0 | 0 | 111.2 | L333 A334 A335 G341 | L333-T337 PolarHBondContact O-N 2.94Å; L333-T337 PolarHBondContact O-OG1 3.42Å; L333-T337 VanDerWaalsContact O-OG1 3.04Å; A334-T337 PolarHBondContact O-N 3.43Å; A335-T337 PolarHBondContact O-N 3.48Å; T337-G341 PolarHBondContact O-N 3.42Å; T337-G341 VanDerWaalsContact O-N 3.13Å |
| 338 | S | 94.4 | Very high | 94.1 | Very high | 1 Ų | 1 | 13.2 Ų | 13.2 | 1% | 0.007 | 7% | 0.069 | C | C | . | . | H | α-helix | trans | -60.4 | -46.5 | 177.6 | -171.5 | 0 | 0 | 0 | 0 | 112.3 | E117 A334 A335 G341 C342 F387 | E117-S338 WeakPolarHBondContact OE1-CB 3.28Å; E117-S338 PolarHBondContact OE1-OG 3.04Å; A334-S338 WeakPolarHBondContact O-CB 3.33Å; A334-S338 PolarHBondContact O-N 3Å; A335-S338 PolarHBondContact O-N 2.94Å; S338-G341 WeakPolarHBondContact O-CA 3.2Å; S338-G341 PolarHBondContact O-N 3.08Å; S338-G341 VanDerWaalsContact O-N 3.16Å; S338-C342 PolarHBondContact O-N 3.44Å; S338-F387 WeakPolarHBondContact O-CZ 3.46Å; S338-F387 WeakPolarHBondContact OG-CE2 3.08Å |
| 339 | S | 95.4 | Very high | 93.7 | Very high | 0 Ų | 0 | 15.1 Ų | 15.1 | 0% | 0 | 8% | 0.08 | C | C | . | . | H | α-helix | trans | -67.3 | -39.3 | -179 | -71.8 | 0 | 0 | 0 | 0 | 113.3 | A335 S336 G341 C342 Y343 E367 S385 | A335-S339 WeakPolarHBondContact O-CB 3.15Å; A335-S339 PolarHBondContact O-N 3.44Å; A335-S339 PolarHBondContact O-OG 2.94Å; S336-S339 PolarHBondContact O-N 2.88Å; S339-G341 VanDerWaalsContact C-N 3.29Å; S339-G341 PolarHBondContact O-N 3.46Å; S339-C342 WeakPolarHBondContact O-CA 3.5Å; S339-C342 WeakPolarHBondContact O-CB 3.41Å; S339-C342 PolarHBondContact O-N 3.43Å; S339-C342 VanDerWaalsContact O-N 3.11Å; S339-Y343 WeakPolarHBondContact O-CD1 3.49Å; S339-Y343 WeakPolarHBondContact O-CE1 3.49Å; S339-Y343 VanDerWaalsContact O-CG 3.29Å; S339-Y343 PolarHBondContact O-N 3.08Å; S339-E367 VanDerWaalsContact CB-OE1 3.29Å; S339-E367 WeakPolarHBondContact CB-OE1 3.34Å; S339-E367 WeakPolarHBondContact CB-OE2 3.31Å; S339-E367 PolarHBondContact OG-OE1 3.37Å; S339-E367 PolarHBondContact OG-OE2 2.97Å; S339-S385 PolarHBondContact OG-N 2.55Å; S339-S385 VanDerWaalsContact OG-N 3.14Å |
| 340 | L | 93.9 | Very high | 93.2 | Very high | 22 Ų | 22 | 12.9 Ų | 12.9 | 12% | 0.115 | 7% | 0.068 | C | C | . | . | H | α-helix | trans | -61.6 | -39 | 171.7 | -70.5 | 174.1 | 0 | 0 | 0 | 112.1 | P193 F197 S336 C342 Y343 A344 C360 | P193-L340 HydrophobicContact CB-CD1 4.24Å; P193-L340 HydrophobicContact CB-CD2 4Å; F197-L340 HydrophobicContact CD2-CB 4.06Å; F197-L340 HydrophobicContact CD2-CD1 4.49Å; F197-L340 HydrophobicContact CD2-CD2 4.01Å; F197-L340 HydrophobicContact CD2-CG 4.41Å; F197-L340 HydrophobicContact CE2-CB 4.26Å; S336-L340 WeakPolarHBondContact O-CG 3.3Å; S336-L340 PolarHBondContact O-N 3.36Å; S336-L340 VanDerWaalsContact O-N 3.08Å; L340-C342 VanDerWaalsContact C-N 3.33Å; L340-C342 PolarHBondContact O-N 3.41Å; L340-Y343 HydrophobicContact CD2-CD2 4.04Å; L340-Y343 HydrophobicContact CD2-CE2 4.3Å; L340-Y343 PolarHBondContact O-N 3.26Å; L340-A344 PolarHBondContact O-N 3.18Å; L340-A344 VanDerWaalsContact O-N 3.07Å; L340-C360 HydrophobicContact CD2-CB 3.87Å |
| 341 | G | 93.3 | Very high | 92.7 | Very high | 7 Ų | 7 | 19.8 Ų | 19.8 | 7% | 0.072 | 10% | 0.1 | C | C | . | . | H | α-helix | trans | -59.8 | -42.3 | 171.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | T337 S338 S339 Y343 A344 L345 | T337-G341 PolarHBondContact O-N 3.42Å; T337-G341 VanDerWaalsContact O-N 3.13Å; S338-G341 WeakPolarHBondContact O-CA 3.2Å; S338-G341 PolarHBondContact O-N 3.08Å; S338-G341 VanDerWaalsContact O-N 3.16Å; S339-G341 VanDerWaalsContact C-N 3.29Å; S339-G341 PolarHBondContact O-N 3.46Å; G341-Y343 PolarHBondContact O-N 3.14Å; G341-A344 PolarHBondContact O-N 3.45Å; G341-L345 VanDerWaalsContact O-CB 3.28Å; G341-L345 WeakPolarHBondContact O-CB 3.4Å; G341-L345 PolarHBondContact O-N 2.96Å |
| 342 | C | 94.7 | Very high | 92 | Very high | 0 Ų | 0 | 21.5 Ų | 21.5 | 0% | 0 | 11% | 0.109 | C | C | . | . | H | α-helix | trans | -63.4 | -37.7 | 174.1 | -74.5 | 0 | 0 | 0 | 0 | 112.8 | L110 S338 S339 L340 L345 C346 S385 F387 V390 | L110-C342 HydrophobicContact CD2-CB 4.46Å; S338-C342 PolarHBondContact O-N 3.44Å; S339-C342 WeakPolarHBondContact O-CA 3.5Å; S339-C342 WeakPolarHBondContact O-CB 3.41Å; S339-C342 PolarHBondContact O-N 3.43Å; S339-C342 VanDerWaalsContact O-N 3.11Å; L340-C342 VanDerWaalsContact C-N 3.33Å; L340-C342 PolarHBondContact O-N 3.41Å; C342-L345 PolarHBondContact O-N 2.67Å; C342-C346 WeakPolarHBondContact O-CB 3.45Å; C342-C346 PolarHBondContact O-N 3.07Å; C342-S385 PolarHBondContact SG-O 2.62Å; C342-F387 HydrophobicContact CB-CE1 4.49Å; C342-F387 WeakPolarHBondContact SG-CD1 2.94Å; C342-F387 WeakPolarHBondContact SG-CE1 3.24Å; C342-V390 HydrophobicContact CB-CG2 4.37Å |
| 343 | Y | 93.5 | Very high | 91.4 | Very high | 0 Ų | 0 | 23.9 Ų | 23.9 | 0% | 0 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -64.7 | -47.4 | 179 | -62.5 | -0.3 | 0 | 0 | 0 | 110.1 | Q101 L110 S339 L340 G341 G347 C360 G363 L364 E367 S385 | Q101-Y343 VanDerWaalsContact NE2-CE1 3.34Å; Q101-Y343 VanDerWaalsContact NE2-CZ 3.3Å; Q101-Y343 PolarHBondContact NE2-OH 2.98Å; L110-Y343 HydrophobicContact CD1-CD1 3.14Å; L110-Y343 HydrophobicContact CD1-CE1 3.42Å; L110-Y343 VanDerWaalsContact CD1-CE1 3.42Å; L110-Y343 HydrophobicContact CD1-CG 4.16Å; S339-Y343 WeakPolarHBondContact O-CD1 3.49Å; S339-Y343 WeakPolarHBondContact O-CE1 3.49Å; S339-Y343 VanDerWaalsContact O-CG 3.29Å; S339-Y343 PolarHBondContact O-N 3.08Å; L340-Y343 HydrophobicContact CD2-CD2 4.04Å; L340-Y343 HydrophobicContact CD2-CE2 4.3Å; L340-Y343 PolarHBondContact O-N 3.26Å; G341-Y343 PolarHBondContact O-N 3.14Å; Y343-G347 PolarHBondContact O-N 3.45Å; Y343-G347 VanDerWaalsContact O-N 3.08Å; Y343-C360 HydrophobicContact CD2-CB 4.41Å; Y343-G363 PolarHBondContact OH-O 3.02Å; Y343-L364 PolarHBondContact OH-N 3.4Å; Y343-E367 PolarHBondContact OH-OE2 2.97Å; Y343-S385 VanDerWaalsContact CE1-OG 3.31Å; Y343-S385 WeakPolarHBondContact CE1-OG 3.11Å |
| 344 | A | 91.8 | Very high | 90.7 | Very high | 10 Ų | 10 | 26.4 Ų | 26.4 | 8% | 0.083 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -60.8 | -48.3 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | F197 L205 L340 G341 G347 R348 | F197-A344 HydrophobicContact CE2-CB 4.14Å; F197-A344 HydrophobicContact CZ-CB 3.89Å; L205-A344 HydrophobicContact CD1-CB 3.96Å; L205-A344 HydrophobicContact CD2-CB 4.15Å; L340-A344 PolarHBondContact O-N 3.18Å; L340-A344 VanDerWaalsContact O-N 3.07Å; G341-A344 PolarHBondContact O-N 3.45Å; A344-G347 PolarHBondContact O-N 3.32Å; A344-R348 WeakPolarHBondContact O-CG 3.39Å; A344-R348 PolarHBondContact O-N 3.05Å |
| 345 | L | 92.8 | Very high | 90.3 | Very high | 1 Ų | 1 | 26.8 Ų | 26.8 | 1% | 0.005 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -63.5 | -44.4 | -178.9 | 177.8 | 62.4 | 0 | 0 | 0 | 112 | L209 G341 C342 R348 L349 F387 V390 V443 A446 | L209-L345 HydrophobicContact CD1-CB 4.39Å; L209-L345 HydrophobicContact CD1-CD1 4.15Å; L209-L345 HydrophobicContact CD2-CB 4.16Å; L209-L345 HydrophobicContact CD2-CD2 4.07Å; G341-L345 VanDerWaalsContact O-CB 3.28Å; G341-L345 WeakPolarHBondContact O-CB 3.4Å; G341-L345 PolarHBondContact O-N 2.96Å; C342-L345 PolarHBondContact O-N 2.67Å; L345-R348 PolarHBondContact O-N 3.48Å; L345-L349 HydrophobicContact CD1-CD1 3.9Å; L345-L349 HydrophobicContact CD1-CD2 4.48Å; L345-L349 HydrophobicContact CD1-CG 3.93Å; L345-L349 HydrophobicContact CD2-CD1 4.49Å; L345-L349 HydrophobicContact CG-CD1 3.91Å; L345-L349 HydrophobicContact CG-CG 4.32Å; L345-L349 WeakPolarHBondContact O-CG 3.39Å; L345-L349 PolarHBondContact O-N 3.34Å; L345-F387 HydrophobicContact CD2-CD1 4.06Å; L345-F387 HydrophobicContact CD2-CE1 4.29Å; L345-V390 HydrophobicContact CB-CG1 4.1Å; L345-V390 HydrophobicContact CD2-CB 4.27Å; L345-V390 HydrophobicContact CD2-CG1 3.55Å; L345-V390 HydrophobicContact CG-CG1 3.54Å; L345-V443 HydrophobicContact CD2-CG1 4.07Å; L345-V443 HydrophobicContact CD2-CG2 4.18Å; L345-A446 HydrophobicContact CD1-CB 3.37Å |
| 346 | C | 92.2 | Very high | 89.8 | Confident | 0 Ų | 0 | 28.4 Ų | 28.4 | 0% | 0 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -63.4 | -45 | 179.4 | -175.9 | 0 | 0 | 0 | 0 | 111.5 | L108 L110 C342 R348 L349 L350 V390 | L108-C346 HydrophobicContact CD1-CB 4.48Å; L110-C346 HydrophobicContact CD2-CB 3.61Å; L110-C346 HydrophobicContact CG-CB 4.42Å; C342-C346 WeakPolarHBondContact O-CB 3.45Å; C342-C346 PolarHBondContact O-N 3.07Å; C346-R348 VanDerWaalsContact C-N 3.31Å; C346-R348 PolarHBondContact O-N 2.95Å; C346-L349 PolarHBondContact O-N 3.15Å; C346-L350 WeakPolarHBondContact O-CB 3.38Å; C346-L350 WeakPolarHBondContact O-CG 3.48Å; C346-L350 PolarHBondContact O-N 3.49Å; C346-V390 HydrophobicContact CB-CG1 4.04Å; C346-V390 HydrophobicContact CB-CG2 4.36Å |
| 347 | G | 88.6 | Confident | 89.4 | Confident | 2 Ų | 2 | 31 Ų | 31 | 2% | 0.021 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -56.7 | -46.5 | 174.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | Y343 A344 L350 H351 L352 | Y343-G347 PolarHBondContact O-N 3.45Å; Y343-G347 VanDerWaalsContact O-N 3.08Å; A344-G347 PolarHBondContact O-N 3.32Å; G347-L350 CarbonylContact O-C 3.53Å; G347-L350 PolarHBondContact O-N 3.16Å; G347-H351 PolarHBondContact O-N 3.5Å; G347-H351 VanDerWaalsContact O-N 3.08Å; G347-L352 PolarHBondContact O-N 3.45Å |
| 348 | R | 87.1 | Confident | 89 | Confident | 78 Ų | 78 | 30.8 Ų | 30.8 | 29% | 0.294 | 17% | 0.17 | S | C | . | . | H | α-helix | trans | -62.9 | -47.8 | 178.2 | -74.6 | -177.2 | 61.6 | 147.1 | 4.1 | 114 | A344 L345 C346 L350 H351 S449 S450 | A344-R348 WeakPolarHBondContact O-CG 3.39Å; A344-R348 PolarHBondContact O-N 3.05Å; L345-R348 PolarHBondContact O-N 3.48Å; C346-R348 VanDerWaalsContact C-N 3.31Å; C346-R348 PolarHBondContact O-N 2.95Å; R348-L350 PolarHBondContact O-N 2.87Å; R348-H351 PolarHBondContact O-N 2.89Å; R348-H351 VanDerWaalsContact O-N 3.13Å; R348-S449 PolarHBondContact NH2-O 3.08Å; R348-S450 VanDerWaalsContact NH1-CA 3.27Å; R348-S450 PolarHBondContact NH1-OG 3.22Å |
| 349 | L | 87.3 | Confident | 88.7 | Confident | 41 Ų | 41 | 30.8 Ų | 30.8 | 22% | 0.215 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -66.1 | -25.8 | -179.4 | -70.2 | 175.9 | 0 | 0 | 0 | 112.6 | L345 C346 V390 A446 | L345-L349 HydrophobicContact CD1-CD1 3.9Å; L345-L349 HydrophobicContact CD1-CD2 4.48Å; L345-L349 HydrophobicContact CD1-CG 3.93Å; L345-L349 HydrophobicContact CD2-CD1 4.49Å; L345-L349 HydrophobicContact CG-CD1 3.91Å; L345-L349 HydrophobicContact CG-CG 4.32Å; L345-L349 WeakPolarHBondContact O-CG 3.39Å; L345-L349 PolarHBondContact O-N 3.34Å; C346-L349 PolarHBondContact O-N 3.15Å; L349-V390 HydrophobicContact CD1-CG1 3.86Å; L349-V390 VanDerWaalsContact CD1-O 3.32Å; L349-V390 WeakPolarHBondContact CD1-O 3.42Å; L349-A446 HydrophobicContact CD2-CB 4.49Å |
| 350 | L | 86.6 | Confident | 88.5 | Confident | 8 Ų | 8 | 30.8 Ų | 30.8 | 4% | 0.042 | 17% | 0.17 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -95.9 | 6.1 | 176.3 | -64.5 | 177.8 | 0 | 0 | 0 | 113.4 | P109 C346 G347 R348 L352 V393 | P109-L350 HydrophobicContact CG-CD1 3.49Å; P109-L350 VanDerWaalsContact CG-CD1 3.49Å; C346-L350 WeakPolarHBondContact O-CB 3.38Å; C346-L350 WeakPolarHBondContact O-CG 3.48Å; C346-L350 PolarHBondContact O-N 3.49Å; G347-L350 CarbonylContact O-C 3.53Å; G347-L350 PolarHBondContact O-N 3.16Å; R348-L350 PolarHBondContact O-N 2.87Å; L350-L352 HydrophobicContact CB-CD1 3.91Å; L350-L352 HydrophobicContact CB-CG 3.82Å; L350-L352 HydrophobicContact CD1-CD1 4.17Å; L350-L352 PolarHBondContact O-N 3.48Å; L350-V393 HydrophobicContact CD2-CG1 3.47Å; L350-V393 VanDerWaalsContact CD2-CG1 3.47Å; L350-V393 HydrophobicContact CG-CG1 3.96Å |
| 351 | H | 85.1 | Confident | 88.4 | Confident | 145 Ų | 145 | 29.8 Ų | 29.8 | 67% | 0.671 | 16% | 0.164 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 52 | 37.1 | -176.4 | -60 | -75.8 | 0 | 0 | 0 | 113.4 | G347 R348 | G347-H351 PolarHBondContact O-N 3.5Å; G347-H351 VanDerWaalsContact O-N 3.08Å; R348-H351 PolarHBondContact O-N 2.89Å; R348-H351 VanDerWaalsContact O-N 3.13Å |
| 352 | L | 83.5 | Confident | 88.3 | Confident | 35 Ų | 35 | 29.9 Ų | 29.9 | 18% | 0.183 | 16% | 0.163 | C | C | . | . | P | Polyproline II helix | trans | -90.7 | 153.9 | 174.2 | -61.5 | 175.9 | 0 | 0 | 0 | 110.1 | L108 G347 L350 V554 | L108-L352 HydrophobicContact CD2-CD1 3.63Å; G347-L352 PolarHBondContact O-N 3.45Å; L350-L352 HydrophobicContact CB-CD1 3.91Å; L350-L352 HydrophobicContact CB-CG 3.82Å; L350-L352 HydrophobicContact CD1-CD1 4.17Å; L350-L352 PolarHBondContact O-N 3.48Å; L352-V554 HydrophobicContact CD1-CG1 4.16Å; L352-V554 HydrophobicContact CD2-CG2 4.17Å |
| 353 | P | 83.1 | Confident | 88.3 | Confident | 50 Ų | 50 | 29.9 Ų | 29.9 | 33% | 0.325 | 16% | 0.163 | S | C | . | . | P | Polyproline II helix | trans | -60.3 | 157.4 | 172.3 | 28.5 | -36.2 | 0 | 0 | 0 | 110.4 | A551 Y555 | P353-A551 HydrophobicContact CG-CB 3.79Å; P353-Y555 HydrophobicContact CG-CE2 4.15Å; P353-Y555 PolarHBondContact O-OH 3.04Å |
| 354 | P | 82.6 | Confident | 88.3 | Confident | 107 Ų | 107 | 29.9 Ų | 29.9 | 70% | 0.695 | 16% | 0.163 | S | C | * | . | P | Polyproline II helix | trans | -56.7 | 140 | 178.9 | 24.4 | -33.8 | 0 | 0 | 0 | 110.6 | ||
| 355 | P | 85.6 | Confident | 88.5 | Confident | 8 Ų | 8 | 30 Ų | 30 | 5% | 0.052 | 16% | 0.163 | C | C | . | . | P | Polyproline II helix | trans | -64.6 | 128.2 | -175 | 25.5 | -32.4 | 0 | 0 | 0 | 109.9 | F197 Y555 | F197-P355 HydrophobicContact CE1-CG 3.64Å; F197-P355 HydrophobicContact CZ-CG 3.74Å; P355-Y555 HydrophobicContact CB-CE1 3.96Å |
| 356 | P | 86.2 | Confident | 88.6 | Confident | 33 Ų | 33 | 31 Ų | 31 | 21% | 0.214 | 17% | 0.168 | C | C | . | . | P | Polyproline II helix | trans | -69.9 | 157.8 | -178 | 28.5 | -35.4 | 0 | 0 | 0 | 111.3 | H358 A359 C360 Y555 | P356-H358 VanDerWaalsContact C-N 3.28Å; P356-H358 VanDerWaalsContact CB-CE1 3.49Å; P356-H358 WeakPolarHBondContact CB-CE1 3.47Å; P356-H358 WeakPolarHBondContact CG-CE1 3.45Å; P356-H358 PolarHBondContact O-N 3.49Å; P356-H358 VanDerWaalsContact O-N 3.12Å; P356-A359 HydrophobicContact CG-CB 3.88Å; P356-A359 WeakPolarHBondContact O-CB 3.23Å; P356-A359 PolarHBondContact O-N 3.21Å; P356-C360 PolarHBondContact O-N 2.85Å; P356-Y555 HydrophobicContact CG-CD2 4.3Å; P356-Y555 HydrophobicContact CG-CG 4.09Å |
| 357 | P | 86.3 | Confident | 88.7 | Confident | 62 Ų | 62 | 31 Ų | 31 | 40% | 0.403 | 17% | 0.168 | S | C | . | . | H | α-helix | trans | -47.3 | -45.1 | -178.3 | -34.8 | 38.6 | 0 | 0 | 0 | 115.1 | G194 P198 A359 C360 S361 | G194-P357 WeakPolarHBondContact O-CB 3.39Å; P198-P357 HydrophobicContact CG-CG 4.18Å; P357-A359 VanDerWaalsContact C-N 3.33Å; P357-A359 PolarHBondContact O-N 2.76Å; P357-C360 PolarHBondContact O-N 2.88Å; P357-S361 PolarHBondContact O-N 3.01Å; P357-S361 PolarHBondContact O-OG 3.32Å |
| 358 | H | 84.9 | Confident | 89.1 | Confident | 37 Ų | 37 | 30.9 Ų | 30.9 | 17% | 0.171 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -66.9 | -33.3 | -178.6 | 64.8 | -94.1 | 0 | 0 | 0 | 112.7 | P356 R362 C574 | P356-H358 VanDerWaalsContact C-N 3.28Å; P356-H358 VanDerWaalsContact CB-CE1 3.49Å; P356-H358 WeakPolarHBondContact CB-CE1 3.47Å; P356-H358 WeakPolarHBondContact CG-CE1 3.45Å; P356-H358 PolarHBondContact O-N 3.49Å; P356-H358 VanDerWaalsContact O-N 3.12Å; H358-R362 WeakPolarHBondContact O-CB 3.21Å; H358-R362 PolarHBondContact O-N 3.47Å; H358-C574 VanDerWaalsContact CA-O 3.28Å; H358-C574 WeakPolarHBondContact CA-O 3.46Å; H358-C574 VanDerWaalsContact CB-O 3.3Å; H358-C574 WeakPolarHBondContact CB-O 3.04Å |
| 359 | A | 88.6 | Confident | 89.5 | Confident | 0 Ų | 0 | 31.6 Ų | 31.6 | 0% | 0 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -70.8 | -37.6 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.3 | P356 P357 G363 Y555 | P356-A359 HydrophobicContact CG-CB 3.88Å; P356-A359 WeakPolarHBondContact O-CB 3.23Å; P356-A359 PolarHBondContact O-N 3.21Å; P357-A359 VanDerWaalsContact C-N 3.33Å; P357-A359 PolarHBondContact O-N 2.76Å; A359-G363 PolarHBondContact O-N 3.31Å; A359-Y555 HydrophobicContact CB-CD1 3.73Å; A359-Y555 HydrophobicContact CB-CE1 4.45Å; A359-Y555 HydrophobicContact CB-CG 4.32Å |
| 360 | C | 90.8 | Very high | 89.9 | Confident | 0 Ų | 0 | 29.7 Ų | 29.7 | 0% | 0 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -64.9 | -47.6 | 174.2 | -66.8 | 0 | 0 | 0 | 0 | 111.7 | P193 L340 Y343 P356 P357 G363 L364 | P193-C360 HydrophobicContact CB-CB 4.26Å; L340-C360 HydrophobicContact CD2-CB 3.87Å; Y343-C360 HydrophobicContact CD2-CB 4.41Å; P356-C360 PolarHBondContact O-N 2.85Å; P357-C360 PolarHBondContact O-N 2.88Å; C360-G363 PolarHBondContact O-N 3.38Å; C360-L364 PolarHBondContact O-N 2.87Å |
| 361 | S | 91.9 | Very high | 90.3 | Very high | 1 Ų | 1 | 29.3 Ų | 29.3 | 1% | 0.007 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -61.6 | -43.3 | 178.1 | -75.1 | 0 | 0 | 0 | 0 | 113.1 | G188 G191 G194 P357 S365 | G188-S361 CarbonylContact C-O 3.6Å; G188-S361 VanDerWaalsContact CA-O 3.23Å; G188-S361 WeakPolarHBondContact CA-O 3.48Å; G188-S361 WeakPolarHBondContact O-CB 3.36Å; G191-S361 VanDerWaalsContact CA-OG 3.31Å; G191-S361 WeakPolarHBondContact CA-OG 3.35Å; G194-S361 PolarHBondContact N-OG 3.35Å; P357-S361 PolarHBondContact O-N 3.01Å; P357-S361 PolarHBondContact O-OG 3.32Å; S361-S365 WeakPolarHBondContact O-CB 3.22Å; S361-S365 PolarHBondContact O-N 3.48Å; S361-S365 PolarHBondContact O-OG 3.15Å |
| 362 | R | 92.3 | Very high | 90.9 | Very high | 9 Ų | 9 | 23.5 Ų | 23.5 | 3% | 0.034 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -71.9 | -35.4 | 177.6 | -167.1 | 176 | 67.6 | -148.8 | 3.7 | 113 | M104 G105 H358 S365 L366 Y555 L575 | M104-R362 WeakPolarHBondContact O-CD 3.28Å; M104-R362 WeakPolarHBondContact O-CG 3.42Å; M104-R362 PolarHBondContact O-NE 3.04Å; G105-R362 PolarHBondContact O-NE 2.94Å; G105-R362 PolarHBondContact O-NH2 3.42Å; H358-R362 WeakPolarHBondContact O-CB 3.21Å; H358-R362 PolarHBondContact O-N 3.47Å; R362-S365 PolarHBondContact O-OG 3.01Å; R362-L366 WeakPolarHBondContact O-CG 3.46Å; R362-L366 PolarHBondContact O-N 3.43Å; R362-Y555 PolarHBondContact NH2-O 3.33Å; R362-L575 HydrophobicContact CB-CD2 4.03Å; R362-L575 HydrophobicContact CG-CD2 4.45Å; R362-L575 PolarHBondContact NH1-O 2.72Å |
| 363 | G | 93.4 | Very high | 91.5 | Very high | 0 Ų | 0 | 24 Ų | 24 | 0% | 0 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -61.2 | -52.1 | 172.5 | 0 | 0 | 0 | 0 | 0 | 111.3 | Q101 Y343 A359 C360 S365 L366 E367 | Q101-G363 VanDerWaalsContact OE1-CA 3.23Å; Q101-G363 PolarHBondContact OE1-O 3.41Å; Q101-G363 VanDerWaalsContact OE1-O 3.04Å; Y343-G363 PolarHBondContact OH-O 3.02Å; A359-G363 PolarHBondContact O-N 3.31Å; C360-G363 PolarHBondContact O-N 3.38Å; G363-S365 VanDerWaalsContact C-N 3.32Å; G363-S365 PolarHBondContact O-N 3.38Å; G363-L366 PolarHBondContact O-N 3.46Å; G363-E367 WeakPolarHBondContact O-CB 3.36Å; G363-E367 PolarHBondContact O-N 3.37Å |
| 364 | L | 94.9 | Very high | 92 | Very high | 1 Ų | 1 | 21.6 Ų | 21.6 | 1% | 0.005 | 13% | 0.126 | C | C | . | . | H | α-helix | trans | -65.7 | -35 | -178.2 | -168.1 | 67.8 | 0 | 0 | 0 | 112.5 | Q184 M187 P193 Y343 C360 E367 G368 | Q184-L364 HydrophobicContact CB-CD1 4.47Å; Q184-L364 HydrophobicContact CB-CG 4.4Å; Q184-L364 HydrophobicContact CG-CD1 4.4Å; M187-L364 HydrophobicContact CB-CD2 4.24Å; P193-L364 HydrophobicContact CB-CD2 4.38Å; P193-L364 HydrophobicContact CG-CB 4.08Å; P193-L364 HydrophobicContact CG-CD2 3.33Å; P193-L364 HydrophobicContact CG-CG 4.34Å; Y343-L364 PolarHBondContact OH-N 3.4Å; C360-L364 PolarHBondContact O-N 2.87Å; L364-E367 PolarHBondContact O-N 2.89Å; L364-G368 PolarHBondContact O-N 3.03Å |
| 365 | S | 94.7 | Very high | 92.5 | Very high | 11 Ų | 11 | 16.5 Ų | 16.5 | 8% | 0.077 | 9% | 0.093 | C | C | . | . | H | α-helix | trans | -65.7 | -41.6 | 179.4 | 66.3 | 0 | 0 | 0 | 0 | 112.6 | S361 R362 G363 G368 L369 | S361-S365 WeakPolarHBondContact O-CB 3.22Å; S361-S365 PolarHBondContact O-N 3.48Å; S361-S365 PolarHBondContact O-OG 3.15Å; R362-S365 PolarHBondContact O-OG 3.01Å; G363-S365 VanDerWaalsContact C-N 3.32Å; G363-S365 PolarHBondContact O-N 3.38Å; S365-G368 PolarHBondContact O-N 3.05Å; S365-L369 PolarHBondContact O-N 3.14Å; S365-L369 VanDerWaalsContact O-N 3.08Å |
| 366 | L | 94.8 | Very high | 92.9 | Very high | 23 Ų | 23 | 18.4 Ų | 18.4 | 12% | 0.12 | 10% | 0.102 | C | C | . | . | H | α-helix | trans | -75.6 | -33 | 178 | -65.5 | -173.2 | 0 | 0 | 0 | 112.8 | L100 M104 R362 G363 G368 L369 G370 | L100-L366 HydrophobicContact CB-CB 4.28Å; L100-L366 HydrophobicContact CB-CD1 4.23Å; L100-L366 WeakPolarHBondContact O-CD1 3.43Å; M104-L366 VanDerWaalsContact C-CD1 3.42Å; M104-L366 HydrophobicContact CB-CD1 3.49Å; M104-L366 VanDerWaalsContact CB-CD1 3.49Å; R362-L366 WeakPolarHBondContact O-CG 3.46Å; R362-L366 PolarHBondContact O-N 3.43Å; G363-L366 PolarHBondContact O-N 3.46Å; L366-G368 VanDerWaalsContact C-N 3.31Å; L366-L369 HydrophobicContact CD2-CD2 4.49Å; L366-L369 WeakPolarHBondContact O-CB 3.33Å; L366-L369 PolarHBondContact O-N 3.49Å; L366-G370 PolarHBondContact O-N 3.36Å |
| 367 | E | 95.4 | Very high | 93.1 | Very high | 0 Ų | 0 | 17 Ų | 17 | 0% | 0 | 9% | 0.093 | C | C | . | . | H | α-helix | trans | -60.8 | -43.1 | 169.7 | -174.3 | 174.4 | 132.8 | 0 | 0 | 111 | Q112 S339 Y343 G363 L364 L369 G370 S371 T383 A384 S385 | Q112-E367 PolarHBondContact OE1-OE2 3.07Å; S339-E367 VanDerWaalsContact CB-OE1 3.29Å; S339-E367 WeakPolarHBondContact CB-OE1 3.34Å; S339-E367 WeakPolarHBondContact CB-OE2 3.31Å; S339-E367 PolarHBondContact OG-OE1 3.37Å; S339-E367 PolarHBondContact OG-OE2 2.97Å; Y343-E367 PolarHBondContact OH-OE2 2.97Å; G363-E367 WeakPolarHBondContact O-CB 3.36Å; G363-E367 PolarHBondContact O-N 3.37Å; L364-E367 PolarHBondContact O-N 2.89Å; E367-L369 PolarHBondContact O-N 2.99Å; E367-G370 PolarHBondContact O-N 2.97Å; E367-G370 VanDerWaalsContact O-N 3.16Å; E367-S371 PolarHBondContact O-N 3.21Å; E367-S371 PolarHBondContact O-OG 3.17Å; E367-T383 VanDerWaalsContact CG-O 3.27Å; E367-T383 WeakPolarHBondContact CG-O 3.27Å; E367-T383 PolarHBondContact O-OG1 3.02Å; E367-A384 VanDerWaalsContact OE1-CA 3.27Å; E367-A384 WeakPolarHBondContact OE1-CA 3.45Å; E367-A384 WeakPolarHBondContact OE1-CB 3.29Å; E367-S385 PolarHBondContact OE2-OG 3.39Å |
| 368 | G | 96 | Very high | 93.1 | Very high | 0 Ų | 0 | 14.9 Ų | 14.9 | 0% | 0 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -59.4 | -42.5 | 172.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | G181 L364 S365 L366 G370 S371 V372 | G181-G368 CarbonylContact C-O 3.57Å; G181-G368 WeakPolarHBondContact CA-O 3.3Å; G181-G368 CarbonylContact O-C 3.53Å; G181-G368 WeakPolarHBondContact O-CA 3.33Å; L364-G368 PolarHBondContact O-N 3.03Å; S365-G368 PolarHBondContact O-N 3.05Å; L366-G368 VanDerWaalsContact C-N 3.31Å; G368-G370 VanDerWaalsContact C-N 3.33Å; G368-G370 PolarHBondContact O-N 3.46Å; G368-S371 WeakPolarHBondContact O-CB 2.99Å; G368-S371 PolarHBondContact O-N 3.3Å; G368-V372 WeakPolarHBondContact O-CG2 3.27Å; G368-V372 PolarHBondContact O-N 2.97Å |
| 369 | L | 95.8 | Very high | 93.1 | Very high | 93 Ų | 93 | 13.2 Ų | 13.2 | 49% | 0.487 | 8% | 0.075 | S | C | . | . | H | α-helix | trans | -61.7 | -40.5 | 174.4 | -176.2 | 63 | 0 | 0 | 0 | 112.1 | L100 S365 L366 E367 S371 V372 L373 | L100-L369 HydrophobicContact CD1-CD2 4.09Å; S365-L369 PolarHBondContact O-N 3.14Å; S365-L369 VanDerWaalsContact O-N 3.08Å; L366-L369 HydrophobicContact CD2-CD2 4.49Å; L366-L369 WeakPolarHBondContact O-CB 3.33Å; L366-L369 PolarHBondContact O-N 3.49Å; E367-L369 PolarHBondContact O-N 2.99Å; L369-S371 VanDerWaalsContact C-N 3.34Å; L369-V372 PolarHBondContact O-N 3.33Å; L369-L373 PolarHBondContact O-N 3.38Å |
| 370 | G | 95.4 | Very high | 92.7 | Very high | 1 Ų | 1 | 13.3 Ų | 13.3 | 1% | 0.01 | 8% | 0.076 | C | C | . | . | H | α-helix | trans | -61.1 | -41 | 172.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | L366 E367 G368 L373 A374 T383 | L366-G370 PolarHBondContact O-N 3.36Å; E367-G370 PolarHBondContact O-N 2.97Å; E367-G370 VanDerWaalsContact O-N 3.16Å; G368-G370 VanDerWaalsContact C-N 3.33Å; G368-G370 PolarHBondContact O-N 3.46Å; G370-L373 PolarHBondContact O-N 3.11Å; G370-A374 WeakPolarHBondContact O-CB 3.32Å; G370-A374 PolarHBondContact O-N 3.25Å; G370-T383 VanDerWaalsContact C-OG1 3.26Å |
| 371 | S | 96 | Very high | 92.5 | Very high | 0 Ų | 0 | 13.3 Ų | 13.3 | 0% | 0 | 8% | 0.076 | C | C | . | . | H | α-helix | trans | -66.6 | -39.8 | 175.1 | -72.3 | 0 | 0 | 0 | 0 | 112.7 | V177 E367 G368 L369 A374 G375 T383 | V177-S371 WeakPolarHBondContact CG1-O 3.4Å; E367-S371 PolarHBondContact O-N 3.21Å; E367-S371 PolarHBondContact O-OG 3.17Å; G368-S371 WeakPolarHBondContact O-CB 2.99Å; G368-S371 PolarHBondContact O-N 3.3Å; L369-S371 VanDerWaalsContact C-N 3.34Å; S371-A374 PolarHBondContact O-N 3.15Å; S371-G375 PolarHBondContact O-N 3.49Å; S371-T383 PolarHBondContact N-OG1 3.47Å; S371-T383 PolarHBondContact OG-N 2.85Å; S371-T383 PolarHBondContact OG-O 3.45Å |
| 372 | V | 96.8 | Very high | 92.4 | Very high | 23 Ų | 23 | 13.3 Ų | 13.3 | 14% | 0.139 | 8% | 0.076 | C | C | . | . | H | α-helix | trans | -59.7 | -48.5 | 172.1 | 173.2 | 0 | 0 | 0 | 0 | 110.2 | G181 L182 G368 L369 A374 G375 L376 | G181-V372 VanDerWaalsContact C-CG2 3.49Å; L182-V372 HydrophobicContact CD2-CG2 3.97Å; L182-V372 HydrophobicContact CG-CG2 3.94Å; G368-V372 WeakPolarHBondContact O-CG2 3.27Å; G368-V372 PolarHBondContact O-N 2.97Å; L369-V372 PolarHBondContact O-N 3.33Å; V372-A374 VanDerWaalsContact C-N 3.32Å; V372-A374 PolarHBondContact O-N 3.18Å; V372-G375 PolarHBondContact O-N 3.41Å; V372-L376 HydrophobicContact CG1-CD1 3.89Å; V372-L376 HydrophobicContact CG1-CG 4.26Å; V372-L376 VanDerWaalsContact O-CG 3.29Å; V372-L376 WeakPolarHBondContact O-CG 3.43Å; V372-L376 PolarHBondContact O-N 2.78Å |
| 373 | L | 95.3 | Very high | 92.5 | Very high | 44 Ų | 44 | 12.9 Ų | 12.9 | 23% | 0.23 | 8% | 0.075 | C | C | . | . | H | α-helix | trans | -58.4 | -45.5 | 177 | 179.3 | 64.2 | 0 | 0 | 0 | 111.2 | V96 L369 G370 G375 L376 L377 | V96-L373 HydrophobicContact CB-CD2 3.89Å; V96-L373 HydrophobicContact CG1-CD2 3.75Å; V96-L373 HydrophobicContact CG2-CD2 4.14Å; L369-L373 PolarHBondContact O-N 3.38Å; G370-L373 PolarHBondContact O-N 3.11Å; L373-G375 PolarHBondContact O-N 3.29Å; L373-L376 PolarHBondContact O-N 3.19Å; L373-L377 HydrophobicContact CD1-CD1 4.02Å; L373-L377 HydrophobicContact CD1-CG 4.08Å; L373-L377 HydrophobicContact CG-CD1 3.98Å; L373-L377 HydrophobicContact CG-CG 4.38Å; L373-L377 WeakPolarHBondContact O-CB 3.34Å; L373-L377 VanDerWaalsContact O-CG 3.26Å; L373-L377 WeakPolarHBondContact O-CG 3.44Å; L373-L377 PolarHBondContact O-N 2.51Å |
| 374 | A | 93.9 | Very high | 92.5 | Very high | 0 Ų | 0 | 12.9 Ų | 12.9 | 0% | 0 | 8% | 0.075 | C | C | . | . | H | α-helix | trans | -56.5 | -50.6 | 177.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | S93 V177 G370 S371 V372 L376 L377 G378 S379 T383 | S93-A374 WeakPolarHBondContact OG-CB 3.25Å; V177-A374 HydrophobicContact CG1-CB 4.49Å; G370-A374 WeakPolarHBondContact O-CB 3.32Å; G370-A374 PolarHBondContact O-N 3.25Å; S371-A374 PolarHBondContact O-N 3.15Å; V372-A374 VanDerWaalsContact C-N 3.32Å; V372-A374 PolarHBondContact O-N 3.18Å; A374-L376 VanDerWaalsContact C-N 3.33Å; A374-L376 PolarHBondContact O-N 2.84Å; A374-L377 CarbonylContact O-C 3.59Å; A374-L377 PolarHBondContact O-N 3.19Å; A374-G378 PolarHBondContact O-N 3.39Å; A374-S379 WeakPolarHBondContact O-CA 3.15Å; A374-S379 WeakPolarHBondContact O-CB 3.34Å; A374-S379 PolarHBondContact O-N 2.87Å; A374-T383 HydrophobicContact CB-CG2 4.32Å |
| 375 | G | 93.3 | Very high | 92.5 | Very high | 0 Ų | 0 | 13 Ų | 13 | 0% | 0 | 8% | 0.075 | C | C | . | . | H | α-helix | trans | -67.5 | -28.3 | 179.3 | 0 | 0 | 0 | 0 | 0 | 114.1 | S174 S371 V372 L373 G378 | S174-G375 PolarHBondContact OG-O 2.85Å; S371-G375 PolarHBondContact O-N 3.49Å; V372-G375 PolarHBondContact O-N 3.41Å; L373-G375 PolarHBondContact O-N 3.29Å; G375-G378 PolarHBondContact O-N 3.49Å |
| 376 | L | 93.5 | Very high | 92.5 | Very high | 48 Ų | 48 | 12.6 Ų | 12.6 | 25% | 0.251 | 7% | 0.073 | S | C | . | . | H | α-helix | trans | -73.7 | -33.8 | 173.1 | -71 | 178.1 | 0 | 0 | 0 | 112.6 | V178 P312 G313 W317 P318 V372 L373 A374 G378 | V178-L376 HydrophobicContact CG2-CD2 4.26Å; V178-L376 HydrophobicContact CG2-CG 4.31Å; P312-L376 WeakPolarHBondContact CA-O 3.29Å; P312-L376 HydrophobicContact CB-CB 4.34Å; G313-L376 PolarHBondContact N-O 2.91Å; W317-L376 HydrophobicContact CE3-CD2 4.45Å; W317-L376 HydrophobicContact CZ3-CD2 4.14Å; P318-L376 HydrophobicContact CG-CD2 4.24Å; V372-L376 HydrophobicContact CG1-CD1 3.89Å; V372-L376 HydrophobicContact CG1-CG 4.26Å; V372-L376 VanDerWaalsContact O-CG 3.29Å; V372-L376 WeakPolarHBondContact O-CG 3.43Å; V372-L376 PolarHBondContact O-N 2.78Å; L373-L376 PolarHBondContact O-N 3.19Å; A374-L376 VanDerWaalsContact C-N 3.33Å; A374-L376 PolarHBondContact O-N 2.84Å; L376-G378 PolarHBondContact O-N 3.14Å |
| 377 | L | 91.3 | Very high | 92.5 | Very high | 3 Ų | 3 | 12 Ų | 12 | 2% | 0.016 | 7% | 0.069 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -78.6 | 11.6 | 173 | -64.7 | -179.3 | 0 | 0 | 0 | 112.8 | F92 P310 P312 W315 L373 A374 S379 | F92-L377 HydrophobicContact CD1-CD1 3.76Å; F92-L377 HydrophobicContact CE1-CD1 4.41Å; P310-L377 HydrophobicContact CB-CD1 4.19Å; P310-L377 HydrophobicContact CB-CD2 4.02Å; P310-L377 HydrophobicContact CG-CD1 4.49Å; P310-L377 WeakPolarHBondContact O-CD2 3.48Å; P312-L377 HydrophobicContact CG-CD2 4.18Å; W315-L377 WeakPolarHBondContact CZ3-O 3.37Å; L373-L377 HydrophobicContact CD1-CD1 4.02Å; L373-L377 HydrophobicContact CD1-CG 4.08Å; L373-L377 HydrophobicContact CG-CD1 3.98Å; L373-L377 HydrophobicContact CG-CG 4.38Å; L373-L377 WeakPolarHBondContact O-CB 3.34Å; L373-L377 VanDerWaalsContact O-CG 3.26Å; L373-L377 WeakPolarHBondContact O-CG 3.44Å; L373-L377 PolarHBondContact O-N 2.51Å; A374-L377 CarbonylContact O-C 3.59Å; A374-L377 PolarHBondContact O-N 3.19Å; L377-S379 PolarHBondContact O-N 3.37Å |
| 378 | G | 85.4 | Confident | 92.3 | Very high | 19 Ų | 19 | 12.1 Ų | 12.1 | 20% | 0.196 | 7% | 0.07 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 70.9 | 11.3 | 178.9 | 0 | 0 | 0 | 0 | 0 | 114.6 | S174 A374 G375 L376 P380 | S174-G378 WeakPolarHBondContact OG-CA 2.94Å; A374-G378 PolarHBondContact O-N 3.39Å; G375-G378 PolarHBondContact O-N 3.49Å; L376-G378 PolarHBondContact O-N 3.14Å; G378-P380 WeakPolarHBondContact O-CD 3.43Å |
| 379 | S | 86.4 | Confident | 92.2 | Very high | 1 Ų | 1 | 12.3 Ų | 12.3 | 1% | 0.007 | 7% | 0.071 | C | C | . | . | trans | -67.8 | 124 | 174.2 | 178.6 | 0 | 0 | 0 | 0 | 108.7 | S90 A374 L377 M381 | S90-S379 PolarHBondContact OG-OG 3.47Å; A374-S379 WeakPolarHBondContact O-CA 3.15Å; A374-S379 WeakPolarHBondContact O-CB 3.34Å; A374-S379 PolarHBondContact O-N 2.87Å; L377-S379 PolarHBondContact O-N 3.37Å; S379-M381 PolarHBondContact O-N 3.33Å; S379-M381 PolarHBondContact OG-N 3.34Å; S379-M381 PolarHBondContact OG-O 3.07Å | ||
| 380 | P | 79.2 | Confident | 92.1 | Very high | 2 Ų | 2 | 8 Ų | 8 | 1% | 0.013 | 5% | 0.049 | C | C | . | . | S | Bend | trans | -73.2 | -9.8 | 178.9 | 30.7 | -35.1 | 0 | 0 | 0 | 112.7 | L70 L170 V173 V177 G378 | L70-P380 HydrophobicContact CD2-CB 3.31Å; L70-P380 HydrophobicContact CD2-CG 3.43Å; L70-P380 VanDerWaalsContact CD2-CG 3.43Å; L170-P380 HydrophobicContact CD2-CB 4.11Å; V173-P380 HydrophobicContact CG1-CB 3.94Å; V173-P380 WeakPolarHBondContact CG1-O 2.87Å; V177-P380 WeakPolarHBondContact CG2-O 3.12Å; G378-P380 WeakPolarHBondContact O-CD 3.43Å |
| 381 | M | 87.3 | Confident | 91.9 | Very high | 1 Ų | 1 | 8 Ų | 8 | 1% | 0.005 | 5% | 0.048 | C | C | . | . | S | Bend | trans | -116.4 | 136.5 | 178.2 | -54.2 | -78.7 | 88 | 0 | 0 | 109.6 | P114 F118 L119 A122 S379 | P114-M381 HydrophobicContact CB-CB 3.61Å; P114-M381 HydrophobicContact CB-CG 4.06Å; F118-M381 HydrophobicContact CB-CE 4.17Å; F118-M381 HydrophobicContact CB-SD 4.17Å; L119-M381 HydrophobicContact CB-CE 4.34Å; L119-M381 HydrophobicContact CB-SD 3.91Å; L119-M381 HydrophobicContact CD1-CE 4.29Å; L119-M381 HydrophobicContact CD1-SD 4.25Å; A122-M381 HydrophobicContact CB-CE 3.92Å; S379-M381 PolarHBondContact O-N 3.33Å; S379-M381 PolarHBondContact OG-N 3.34Å; S379-M381 PolarHBondContact OG-O 3.07Å |
| 382 | G | 90.6 | Very high | 91.7 | Very high | 1 Ų | 1 | 8 Ų | 8 | 1% | 0.01 | 5% | 0.048 | C | C | . | . | trans | -75.7 | -179.9 | 168.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | P114 | P114-G382 WeakPolarHBondContact CA-O 3.49Š| ||
| 383 | T | 93 | Very high | 91.4 | Very high | 0 Ų | 0 | 7 Ų | 7 | 0% | 0 | 4% | 0.042 | C | C | . | . | trans | -104.7 | 130.7 | 176.9 | 64.3 | 0 | 0 | 0 | 0 | 109.9 | S97 E367 G370 S371 A374 | S97-T383 PolarHBondContact OG-OG1 3.18Å; E367-T383 VanDerWaalsContact CG-O 3.27Å; E367-T383 WeakPolarHBondContact CG-O 3.27Å; E367-T383 PolarHBondContact O-OG1 3.02Å; G370-T383 VanDerWaalsContact C-OG1 3.26Å; S371-T383 PolarHBondContact N-OG1 3.47Å; S371-T383 PolarHBondContact OG-N 2.85Å; S371-T383 PolarHBondContact OG-O 3.45Å; A374-T383 HydrophobicContact CB-CG2 4.32Å | ||
| 384 | A | 94.4 | Very high | 91 | Very high | 0 Ų | 0 | 5.8 Ų | 5.8 | 0% | 0 | 4% | 0.04 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -142.9 | 168.6 | 170.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | Q112 A113 F118 A335 E367 S386 | Q112-A384 CarbonylContact C-O 3.5Å; Q112-A384 WeakPolarHBondContact CA-O 3.36Å; Q112-A384 PolarHBondContact OE1-O 3.36Å; A113-A384 PolarHBondContact N-O 3.14Å; A113-A384 PolarHBondContact O-N 2.9Å; F118-A384 HydrophobicContact CE2-CB 3.95Å; A335-A384 HydrophobicContact CB-CB 4.12Å; E367-A384 VanDerWaalsContact OE1-CA 3.27Å; E367-A384 WeakPolarHBondContact OE1-CA 3.45Å; E367-A384 WeakPolarHBondContact OE1-CB 3.29Å; A384-S386 PolarHBondContact O-N 3.04Å |
| 385 | S | 95.1 | Very high | 90.6 | Very high | 2 Ų | 2 | 6.4 Ų | 6.4 | 1% | 0.014 | 4% | 0.044 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -70.4 | 131.1 | -178.7 | -61.1 | 0 | 0 | 0 | 0 | 111.2 | Q112 S339 C342 Y343 E367 | Q112-S385 PolarHBondContact NE2-OG 3.03Å; S339-S385 PolarHBondContact OG-N 2.55Å; S339-S385 VanDerWaalsContact OG-N 3.14Å; C342-S385 PolarHBondContact SG-O 2.62Å; Y343-S385 VanDerWaalsContact CE1-OG 3.31Å; Y343-S385 WeakPolarHBondContact CE1-OG 3.11Å; E367-S385 PolarHBondContact OE2-OG 3.39Å |
| 386 | S | 93.8 | Very high | 90.3 | Very high | 4 Ų | 4 | 6.7 Ų | 6.7 | 3% | 0.028 | 5% | 0.045 | C | C | . | . | trans | -94 | 111 | -165.5 | 178.2 | 0 | 0 | 0 | 0 | 113.9 | V111 A384 N389 V390 | V111-S386 WeakPolarHBondContact O-CB 3.5Å; V111-S386 PolarHBondContact O-N 3.04Å; A384-S386 PolarHBondContact O-N 3.04Å; S386-N389 PolarHBondContact O-N 3.35Å; S386-N389 VanDerWaalsContact O-N 3.14Å; S386-N389 PolarHBondContact OG-ND2 3.47Å; S386-V390 WeakPolarHBondContact O-CG2 3.5Å; S386-V390 PolarHBondContact O-N 3.49Å | ||
| 387 | F | 94.1 | Very high | 89.7 | Confident | 9 Ų | 9 | 8.8 Ų | 8.8 | 4% | 0.039 | 5% | 0.054 | C | C | . | . | H | α-helix | trans | -53.1 | -48.4 | 172.9 | -82.4 | -58.8 | 0 | 0 | 0 | 113.7 | L209 A212 S338 C342 L345 N389 V390 G391 V443 I505 | L209-F387 HydrophobicContact CD2-CD1 4.25Å; L209-F387 HydrophobicContact CD2-CE1 3.35Å; L209-F387 HydrophobicContact CD2-CZ 3.94Å; A212-F387 HydrophobicContact CB-CD2 3.92Å; A212-F387 HydrophobicContact CB-CE2 3.77Å; A212-F387 HydrophobicContact CB-CG 4.33Å; A212-F387 HydrophobicContact CB-CZ 4.11Å; S338-F387 WeakPolarHBondContact O-CZ 3.46Å; S338-F387 WeakPolarHBondContact OG-CE2 3.08Å; C342-F387 HydrophobicContact CB-CE1 4.49Å; C342-F387 WeakPolarHBondContact SG-CD1 2.94Å; C342-F387 WeakPolarHBondContact SG-CE1 3.24Å; L345-F387 HydrophobicContact CD2-CD1 4.06Å; L345-F387 HydrophobicContact CD2-CE1 4.29Å; F387-N389 VanDerWaalsContact C-N 3.29Å; F387-N389 PolarHBondContact O-N 2.94Å; F387-V390 CarbonylContact O-C 3.6Å; F387-V390 PolarHBondContact O-N 3.39Å; F387-V390 VanDerWaalsContact O-N 3.15Å; F387-G391 PolarHBondContact O-N 2.97Å; F387-V443 HydrophobicContact CB-CG1 4.44Å; F387-V443 HydrophobicContact CB-CG2 4.22Å; F387-V443 HydrophobicContact CD1-CG1 3.75Å; F387-V443 HydrophobicContact CD1-CG2 4.47Å; F387-V443 HydrophobicContact CE1-CG1 4.37Å; F387-V443 HydrophobicContact CG-CG1 4.27Å; F387-V443 WeakPolarHBondContact O-CG2 3.39Å; F387-I505 HydrophobicContact CD2-CD1 4.33Å; F387-I505 HydrophobicContact CE2-CD1 4.01Å |
| 388 | P | 92.7 | Very high | 89.1 | Confident | 4 Ų | 4 | 9 Ų | 9 | 3% | 0.026 | 6% | 0.056 | C | C | . | . | H | α-helix | trans | -57 | -38.3 | 176.1 | -29.1 | 36.3 | 0 | 0 | 0 | 114 | V58 G391 K392 L436 T439 | V58-P388 HydrophobicContact CG1-CB 3.69Å; P388-G391 PolarHBondContact O-N 3.06Å; P388-K392 PolarHBondContact O-N 3.49Å; P388-L436 HydrophobicContact CB-CD2 4.15Å; P388-L436 HydrophobicContact CG-CD2 3.98Å; P388-T439 WeakPolarHBondContact O-CB 3.39Å |
| 389 | N | 93.6 | Very high | 88.8 | Confident | 3 Ų | 3 | 8.6 Ų | 8.6 | 2% | 0.016 | 5% | 0.052 | C | C | . | . | H | α-helix | trans | -70.6 | -37.8 | 177.1 | -84.1 | -66.7 | 0 | 0 | 0 | 112.5 | H55 M59 V111 S386 F387 K392 V393 | H55-N389 PolarHBondContact ND1-OD1 3.37Å; H55-N389 PolarHBondContact O-OD1 2.82Å; M59-N389 WeakPolarHBondContact CG-ND2 3.43Å; V111-N389 HydrophobicContact CB-CB 4.06Å; S386-N389 PolarHBondContact O-N 3.35Å; S386-N389 VanDerWaalsContact O-N 3.14Å; S386-N389 PolarHBondContact OG-ND2 3.47Å; F387-N389 VanDerWaalsContact C-N 3.29Å; F387-N389 PolarHBondContact O-N 2.94Å; N389-K392 WeakPolarHBondContact O-CB 3.07Å; N389-K392 PolarHBondContact O-N 2.78Å; N389-V393 PolarHBondContact O-N 2.81Å |
| 390 | V | 93.1 | Very high | 88.8 | Confident | 3 Ų | 3 | 9.5 Ų | 9.5 | 2% | 0.018 | 6% | 0.058 | C | C | . | . | H | α-helix | trans | -68.5 | -40.6 | 173.6 | 179 | 0 | 0 | 0 | 0 | 110.6 | L110 C342 L345 C346 L349 S386 F387 K392 V393 G394 | L110-V390 HydrophobicContact CD2-CG2 3.59Å; C342-V390 HydrophobicContact CB-CG2 4.37Å; L345-V390 HydrophobicContact CB-CG1 4.1Å; L345-V390 HydrophobicContact CD2-CB 4.27Å; L345-V390 HydrophobicContact CD2-CG1 3.55Å; L345-V390 HydrophobicContact CG-CG1 3.54Å; C346-V390 HydrophobicContact CB-CG1 4.04Å; C346-V390 HydrophobicContact CB-CG2 4.36Å; L349-V390 HydrophobicContact CD1-CG1 3.86Å; L349-V390 VanDerWaalsContact CD1-O 3.32Å; L349-V390 WeakPolarHBondContact CD1-O 3.42Å; S386-V390 WeakPolarHBondContact O-CG2 3.5Å; S386-V390 PolarHBondContact O-N 3.49Å; F387-V390 CarbonylContact O-C 3.6Å; F387-V390 PolarHBondContact O-N 3.39Å; F387-V390 VanDerWaalsContact O-N 3.15Å; V390-K392 VanDerWaalsContact C-N 3.26Å; V390-K392 PolarHBondContact O-N 2.86Å; V390-V393 WeakPolarHBondContact O-CA 3.37Å; V390-V393 VanDerWaalsContact O-CB 3.26Å; V390-V393 WeakPolarHBondContact O-CB 3.44Å; V390-V393 PolarHBondContact O-N 3.46Å; V390-G394 PolarHBondContact O-N 3.1Å |
| 391 | G | 91.3 | Very high | 89.1 | Confident | 0 Ų | 0 | 12.5 Ų | 12.5 | 0% | 0 | 7% | 0.072 | C | C | . | . | H | α-helix | trans | -58.6 | -37.6 | 172.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | F387 P388 V393 G394 L395 V442 | F387-G391 PolarHBondContact O-N 2.97Å; P388-G391 PolarHBondContact O-N 3.06Å; G391-V393 VanDerWaalsContact C-N 3.33Å; G391-V393 PolarHBondContact O-N 3.38Å; G391-G394 WeakPolarHBondContact O-CA 3.21Å; G391-G394 PolarHBondContact O-N 3.47Å; G391-L395 PolarHBondContact O-N 3.2Å; G391-V442 WeakPolarHBondContact O-CG1 3.45Å |
| 392 | K | 91.9 | Very high | 89.2 | Confident | 0 Ų | 0 | 14.4 Ų | 14.4 | 0% | 0 | 8% | 0.08 | C | C | . | . | H | α-helix | trans | -61.3 | -39.5 | 171.4 | -168.4 | -161.5 | 67.9 | 155.1 | 0 | 112.5 | L51 Q54 H55 V58 V275 P388 N389 V390 G394 L395 I396 T439 | L51-K392 PolarHBondContact O-NZ 3.16Å; Q54-K392 HydrophobicContact CG-CD 3.91Å; H55-K392 PolarHBondContact CD2-NZ 2.84Å; H55-K392 WeakPolarHBondContact CE1-CE 3.43Å; H55-K392 PolarHBondContact CE1-NZ 3.04Å; H55-K392 VanDerWaalsContact ND1-CE 3.27Å; H55-K392 WeakPolarHBondContact ND1-CE 3.28Å; H55-K392 PolarHBondContact ND1-NZ 3.49Å; H55-K392 VanDerWaalsContact ND1-NZ 3.13Å; H55-K392 WeakPolarHBondContact NE2-CE 3.46Å; H55-K392 PolarHBondContact NE2-NZ 3.49Å; V58-K392 HydrophobicContact CG2-CD 4.13Å; V275-K392 HydrophobicContact CG2-CD 4.3Å; V275-K392 HydrophobicContact CG2-CG 3.96Å; P388-K392 PolarHBondContact O-N 3.49Å; N389-K392 WeakPolarHBondContact O-CB 3.07Å; N389-K392 PolarHBondContact O-N 2.78Å; V390-K392 VanDerWaalsContact C-N 3.26Å; V390-K392 PolarHBondContact O-N 2.86Å; K392-G394 PolarHBondContact O-N 3.4Å; K392-L395 WeakPolarHBondContact O-CB 3.42Å; K392-L395 PolarHBondContact O-N 2.92Å; K392-I396 PolarHBondContact O-N 2.94Å; K392-I396 VanDerWaalsContact O-N 3.09Å; K392-T439 HydrophobicContact CB-CG2 4.25Å |
| 393 | V | 90.3 | Very high | 89.2 | Confident | 3 Ų | 3 | 14.6 Ų | 14.6 | 2% | 0.018 | 8% | 0.081 | C | C | . | . | H | α-helix | trans | -57.3 | -37 | 173.4 | 175.1 | 0 | 0 | 0 | 0 | 110.4 | L350 N389 V390 G391 L395 I396 Q397 | L350-V393 HydrophobicContact CD2-CG1 3.47Å; L350-V393 VanDerWaalsContact CD2-CG1 3.47Å; L350-V393 HydrophobicContact CG-CG1 3.96Å; N389-V393 PolarHBondContact O-N 2.81Å; V390-V393 WeakPolarHBondContact O-CA 3.37Å; V390-V393 VanDerWaalsContact O-CB 3.26Å; V390-V393 WeakPolarHBondContact O-CB 3.44Å; V390-V393 PolarHBondContact O-N 3.46Å; G391-V393 VanDerWaalsContact C-N 3.33Å; G391-V393 PolarHBondContact O-N 3.38Å; V393-L395 PolarHBondContact O-N 2.91Å; V393-I396 PolarHBondContact O-N 2.95Å; V393-Q397 VanDerWaalsContact O-CA 3.32Å; V393-Q397 WeakPolarHBondContact O-CA 3.21Å; V393-Q397 PolarHBondContact O-N 3.32Å |
| 394 | G | 86.3 | Confident | 89.2 | Confident | 18 Ų | 18 | 14.7 Ų | 14.7 | 19% | 0.186 | 8% | 0.082 | C | C | . | . | H | α-helix | trans | -63.2 | -34.4 | 173.1 | 0 | 0 | 0 | 0 | 0 | 114.4 | V390 G391 K392 | V390-G394 PolarHBondContact O-N 3.1Å; G391-G394 WeakPolarHBondContact O-CA 3.21Å; G391-G394 PolarHBondContact O-N 3.47Å; K392-G394 PolarHBondContact O-N 3.4Å |
| 395 | L | 86.6 | Confident | 89.1 | Confident | 14 Ų | 14 | 17.6 Ų | 17.6 | 7% | 0.073 | 10% | 0.096 | C | C | . | . | H | α-helix | trans | -70.7 | -43.2 | 175.7 | -68.4 | 172.3 | 0 | 0 | 0 | 112.7 | M238 V275 G391 K392 V393 V438 T439 V442 | M238-L395 HydrophobicContact CE-CD1 4.24Å; V275-L395 HydrophobicContact CG2-CD1 4.3Å; G391-L395 PolarHBondContact O-N 3.2Å; K392-L395 WeakPolarHBondContact O-CB 3.42Å; K392-L395 PolarHBondContact O-N 2.92Å; V393-L395 PolarHBondContact O-N 2.91Å; L395-V438 HydrophobicContact CD1-CG1 4.2Å; L395-V438 HydrophobicContact CD2-CG1 4.46Å; L395-T439 HydrophobicContact CD1-CG2 4.34Å; L395-V442 HydrophobicContact CD2-CG2 3.53Å; L395-V442 HydrophobicContact CG-CG2 3.87Å |
| 396 | I | 87.4 | Confident | 89 | Confident | 6 Ų | 6 | 19 Ų | 19 | 3% | 0.031 | 10% | 0.103 | C | C | . | . | H | α-helix | trans | -89.4 | -17.3 | -174 | 69.6 | 175.1 | 0 | 0 | 0 | 112.8 | L51 R271 L272 K392 V393 A398 | L51-I396 HydrophobicContact CD2-CD1 4.09Å; R271-I396 WeakPolarHBondContact O-CG2 3.28Å; L272-I396 WeakPolarHBondContact O-CG2 3.44Å; K392-I396 PolarHBondContact O-N 2.94Å; K392-I396 VanDerWaalsContact O-N 3.09Å; V393-I396 PolarHBondContact O-N 2.95Å; I396-A398 HydrophobicContact CD1-CB 4.4Å; I396-A398 WeakPolarHBondContact CD1-O 3.41Å; I396-A398 HydrophobicContact CG1-CB 4.26Å; I396-A398 WeakPolarHBondContact CG1-O 3.28Å; I396-A398 PolarHBondContact O-N 2.95Å |
| 397 | Q | 79.8 | Confident | 89.1 | Confident | 92 Ų | 92 | 18.8 Ų | 18.8 | 43% | 0.43 | 10% | 0.101 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 50.8 | 35.2 | -175.6 | -63.4 | -177.7 | -37.5 | 0 | 0 | 113.5 | V393 | V393-Q397 VanDerWaalsContact O-CA 3.32Å; V393-Q397 WeakPolarHBondContact O-CA 3.21Å; V393-Q397 PolarHBondContact O-N 3.32Å |
| 398 | A | 78.6 | Confident | 89.2 | Confident | 7 Ų | 7 | 18.3 Ų | 18.3 | 6% | 0.058 | 10% | 0.099 | C | C | . | . | trans | -143.1 | 131.9 | -178.7 | 0 | 0 | 0 | 0 | 0 | 109.6 | L272 I396 | L272-A398 HydrophobicContact CD2-CB 3.98Å; I396-A398 HydrophobicContact CD1-CB 4.4Å; I396-A398 WeakPolarHBondContact CD1-O 3.41Å; I396-A398 HydrophobicContact CG1-CB 4.26Å; I396-A398 WeakPolarHBondContact CG1-O 3.28Å; I396-A398 PolarHBondContact O-N 2.95Å | ||
| 399 | G | 80.4 | Confident | 89.4 | Confident | 11 Ų | 11 | 23.1 Ų | 23.1 | 11% | 0.113 | 12% | 0.124 | C | C | . | . | trans | -140.1 | 122.5 | 176.3 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 400 | S | 85.9 | Confident | 89.4 | Confident | 19 Ų | 19 | 26 Ų | 26 | 13% | 0.133 | 14% | 0.14 | C | C | . | . | trans | -129.1 | 133.1 | 179.5 | 174.8 | 0 | 0 | 0 | 0 | 110.2 | Q402 V403 A404 | S400-Q402 PolarHBondContact O-N 2.88Å; S400-Q402 PolarHBondContact OG-N 2.95Å; S400-V403 WeakPolarHBondContact O-CB 3.44Å; S400-V403 PolarHBondContact O-N 3.4Å; S400-A404 PolarHBondContact O-N 3.28Å | ||
| 401 | Q | 85.6 | Confident | 89.5 | Confident | 66 Ų | 66 | 25.9 Ų | 25.9 | 31% | 0.308 | 14% | 0.139 | S | C | . | . | H | α-helix | trans | -60.8 | -34.7 | 174 | -71.7 | 177.2 | -9.5 | 0 | 0 | 111.6 | R107 V403 A404 H405 | R107-Q401 PolarHBondContact O-NE2 2.65Å; Q401-V403 VanDerWaalsContact C-N 3.31Å; Q401-V403 PolarHBondContact O-N 2.86Å; Q401-A404 PolarHBondContact O-N 3.26Å; Q401-H405 PolarHBondContact O-CD2 2.88Å; Q401-H405 PolarHBondContact O-N 3.47Å |
| 402 | Q | 87.9 | Confident | 89.7 | Confident | 40 Ų | 40 | 28.4 Ų | 28.4 | 19% | 0.187 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -60.5 | -42.3 | 176.1 | -177.1 | -174.3 | -4.4 | 0 | 0 | 111.5 | S400 H405 L406 | S400-Q402 PolarHBondContact O-N 2.88Å; S400-Q402 PolarHBondContact OG-N 2.95Å; Q402-H405 PolarHBondContact O-N 2.63Å; Q402-L406 HydrophobicContact CG-CD1 4.44Å; Q402-L406 WeakPolarHBondContact O-CG 3.32Å; Q402-L406 PolarHBondContact O-N 2.93Å |
| 403 | V | 91.9 | Very high | 89.8 | Confident | 5 Ų | 5 | 30.1 Ų | 30.1 | 3% | 0.03 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -63.2 | -45.1 | 176.1 | 174.9 | 0 | 0 | 0 | 0 | 109.8 | L51 A52 S400 Q401 H405 L406 V407 | L51-V403 HydrophobicContact CB-CG1 3.79Å; L51-V403 HydrophobicContact CB-CG2 4.1Å; L51-V403 HydrophobicContact CD1-CG2 4.14Å; A52-V403 HydrophobicContact CB-CG1 4.3Å; S400-V403 WeakPolarHBondContact O-CB 3.44Å; S400-V403 PolarHBondContact O-N 3.4Å; Q401-V403 VanDerWaalsContact C-N 3.31Å; Q401-V403 PolarHBondContact O-N 2.86Å; V403-H405 PolarHBondContact O-N 3.33Å; V403-L406 WeakPolarHBondContact O-CB 3.34Å; V403-L406 PolarHBondContact O-N 2.71Å; V403-V407 HydrophobicContact CG1-CG2 4.48Å; V403-V407 VanDerWaalsContact O-CG2 3.28Å; V403-V407 WeakPolarHBondContact O-CG2 3.14Å; V403-V407 PolarHBondContact O-N 3.48Å |
| 404 | A | 92.1 | Very high | 89.9 | Confident | 2 Ų | 2 | 31 Ų | 31 | 2% | 0.017 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -64.5 | -36.8 | 179.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | T98 T102 P109 S400 Q401 V407 G408 | T98-A404 WeakPolarHBondContact CG2-O 3.22Å; T102-A404 HydrophobicContact CG2-CB 3.5Å; P109-A404 HydrophobicContact CB-CB 4.05Å; S400-A404 PolarHBondContact O-N 3.28Å; Q401-A404 PolarHBondContact O-N 3.26Å; A404-V407 WeakPolarHBondContact O-CB 3.44Å; A404-V407 PolarHBondContact O-N 3.5Å; A404-G408 PolarHBondContact O-N 3.19Å |
| 405 | H | 91.9 | Very high | 90.2 | Very high | 62 Ų | 62 | 30.1 Ų | 30.1 | 29% | 0.287 | 16% | 0.164 | S | C | . | . | H | α-helix | trans | -61.8 | -45.5 | 170.9 | -70.6 | 179.8 | 0 | 0 | 0 | 111.9 | T102 Q401 Q402 V403 V407 G408 L409 | T102-H405 PolarHBondContact OG1-CD2 2.82Å; T102-H405 PolarHBondContact OG1-NE2 3.2Å; Q401-H405 PolarHBondContact O-CD2 2.88Å; Q401-H405 PolarHBondContact O-N 3.47Å; Q402-H405 PolarHBondContact O-N 2.63Å; V403-H405 PolarHBondContact O-N 3.33Å; H405-V407 VanDerWaalsContact C-N 3.3Å; H405-V407 PolarHBondContact O-N 3.44Å; H405-G408 PolarHBondContact O-N 3.1Å; H405-L409 WeakPolarHBondContact O-CG 3.33Å; H405-L409 PolarHBondContact O-N 2.92Å |
| 406 | L | 94.7 | Very high | 90.5 | Very high | 30 Ų | 30 | 32.3 Ų | 32.3 | 16% | 0.157 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -62 | -37.4 | 176.2 | -77.7 | 168.8 | 0 | 0 | 0 | 112.2 | W45 A52 Q402 V403 L409 L410 | W45-L406 HydrophobicContact CE3-CD1 4.29Å; W45-L406 HydrophobicContact CZ3-CD1 4.22Å; W45-L406 HydrophobicContact CZ3-CD2 4.14Å; W45-L406 HydrophobicContact CZ3-CG 4.44Å; A52-L406 HydrophobicContact CB-CB 3.71Å; Q402-L406 HydrophobicContact CG-CD1 4.44Å; Q402-L406 WeakPolarHBondContact O-CG 3.32Å; Q402-L406 PolarHBondContact O-N 2.93Å; V403-L406 WeakPolarHBondContact O-CB 3.34Å; V403-L406 PolarHBondContact O-N 2.71Å; L406-L409 PolarHBondContact O-N 3.37Å; L406-L410 VanDerWaalsContact O-CB 3.28Å; L406-L410 WeakPolarHBondContact O-CB 3.41Å; L406-L410 PolarHBondContact O-N 2.9Å |
| 407 | V | 95.6 | Very high | 90.7 | Very high | 0 Ų | 0 | 32.3 Ų | 32.3 | 0% | 0 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -59 | -48.8 | 172.9 | 172.5 | 0 | 0 | 0 | 0 | 110.5 | A52 H55 V56 M59 T98 V111 V403 A404 H405 L409 L410 C411 | A52-V407 HydrophobicContact CB-CG2 3.75Å; H55-V407 HydrophobicContact CB-CB 4.47Å; H55-V407 HydrophobicContact CB-CG1 4.17Å; H55-V407 HydrophobicContact CB-CG2 3.41Å; H55-V407 VanDerWaalsContact CB-CG2 3.41Å; V56-V407 HydrophobicContact CG2-CG1 4.04Å; M59-V407 HydrophobicContact CE-CG1 3.47Å; M59-V407 VanDerWaalsContact CE-CG1 3.47Å; T98-V407 HydrophobicContact CG2-CG1 4.49Å; V111-V407 HydrophobicContact CG1-CG1 3.93Å; V111-V407 HydrophobicContact CG2-CB 4.47Å; V111-V407 HydrophobicContact CG2-CG1 4.02Å; V111-V407 HydrophobicContact CG2-CG2 4.45Å; V403-V407 HydrophobicContact CG1-CG2 4.48Å; V403-V407 VanDerWaalsContact O-CG2 3.28Å; V403-V407 WeakPolarHBondContact O-CG2 3.14Å; V403-V407 PolarHBondContact O-N 3.48Å; A404-V407 WeakPolarHBondContact O-CB 3.44Å; A404-V407 PolarHBondContact O-N 3.5Å; H405-V407 VanDerWaalsContact C-N 3.3Å; H405-V407 PolarHBondContact O-N 3.44Å; V407-L409 PolarHBondContact O-N 3.36Å; V407-L410 PolarHBondContact O-N 3.16Å; V407-C411 WeakPolarHBondContact O-CB 3.19Å; V407-C411 PolarHBondContact O-N 3.08Å; V407-C411 PolarHBondContact O-SG 3Å; V407-C411 VanDerWaalsContact O-SG 3.38Å |
| 408 | G | 95.9 | Very high | 91.1 | Very high | 0 Ų | 0 | 28 Ų | 28 | 0% | 0 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -58.5 | -46.4 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | G95 A404 H405 C411 M412 | G95-G408 WeakPolarHBondContact CA-O 3.4Å; A404-G408 PolarHBondContact O-N 3.19Å; H405-G408 PolarHBondContact O-N 3.1Å; G408-C411 PolarHBondContact O-N 3.43Å; G408-M412 WeakPolarHBondContact O-CG 3.47Å; G408-M412 PolarHBondContact O-N 2.99Å |
| 409 | L | 95.8 | Very high | 91.5 | Very high | 104 Ų | 104 | 31.4 Ų | 31.4 | 55% | 0.545 | 17% | 0.167 | S | C | . | . | H | α-helix | trans | -63.5 | -43.4 | 176.6 | -69.5 | 174.1 | 0 | 0 | 0 | 112.5 | I99 H405 L406 V407 C411 M412 G413 | I99-L409 HydrophobicContact CD1-CD2 3.95Å; I99-L409 HydrophobicContact CD1-CG 4.28Å; H405-L409 WeakPolarHBondContact O-CG 3.33Å; H405-L409 PolarHBondContact O-N 2.92Å; L406-L409 PolarHBondContact O-N 3.37Å; V407-L409 PolarHBondContact O-N 3.36Å; L409-C411 VanDerWaalsContact C-N 3.35Å; L409-M412 PolarHBondContact O-N 2.96Å; L409-G413 PolarHBondContact O-N 3.45Å |
| 410 | L | 95.4 | Very high | 91.9 | Very high | 65 Ų | 65 | 34 Ų | 34 | 34% | 0.34 | 18% | 0.178 | S | C | . | . | H | α-helix | trans | -64.7 | -40.6 | 178.4 | -175.1 | 59.6 | 0 | 0 | 0 | 111 | L53 V56 L406 V407 G413 L414 | L53-L410 HydrophobicContact CD1-CD2 4.18Å; V56-L410 HydrophobicContact CB-CD2 4.24Å; V56-L410 HydrophobicContact CG2-CB 4.25Å; V56-L410 HydrophobicContact CG2-CD2 3.73Å; V56-L410 HydrophobicContact CG2-CG 4.09Å; L406-L410 VanDerWaalsContact O-CB 3.28Å; L406-L410 WeakPolarHBondContact O-CB 3.41Å; L406-L410 PolarHBondContact O-N 2.9Å; V407-L410 PolarHBondContact O-N 3.16Å; L410-G413 PolarHBondContact O-N 3.26Å; L410-L414 HydrophobicContact CG-CD1 4.47Å; L410-L414 WeakPolarHBondContact O-CG 3.49Å; L410-L414 PolarHBondContact O-N 3.45Å |
| 411 | C | 95 | Very high | 91.9 | Very high | 0 Ų | 0 | 33.1 Ų | 33.1 | 0% | 0 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -65.7 | -40.8 | 175 | -75.8 | 0 | 0 | 0 | 0 | 113.2 | M59 F91 V407 G408 L409 G413 L414 G415 | M59-C411 WeakPolarHBondContact CE-SG 3.47Å; F91-C411 CarbonylContact C-O 3.54Å; V407-C411 WeakPolarHBondContact O-CB 3.19Å; V407-C411 PolarHBondContact O-N 3.08Å; V407-C411 PolarHBondContact O-SG 3Å; V407-C411 VanDerWaalsContact O-SG 3.38Å; G408-C411 PolarHBondContact O-N 3.43Å; L409-C411 VanDerWaalsContact C-N 3.35Å; C411-G413 VanDerWaalsContact C-N 3.32Å; C411-G413 PolarHBondContact O-N 3.48Å; C411-L414 PolarHBondContact O-N 2.9Å; C411-G415 PolarHBondContact O-N 2.88Å |
| 412 | M | 95.3 | Very high | 91.8 | Very high | 53 Ų | 53 | 31.6 Ų | 31.6 | 26% | 0.261 | 17% | 0.165 | S | C | . | . | H | α-helix | trans | -59.1 | -45.5 | 171.2 | -73.1 | 179.9 | 68.6 | 0 | 0 | 111 | F92 V96 I99 G408 L409 L414 G415 L416 | F92-M412 HydrophobicContact CD2-CB 4.43Å; F92-M412 HydrophobicContact CE2-CE 4.11Å; F92-M412 HydrophobicContact CZ-CE 4.26Å; V96-M412 HydrophobicContact CG2-CE 4Å; V96-M412 HydrophobicContact CG2-CG 4.06Å; V96-M412 HydrophobicContact CG2-SD 3.95Å; I99-M412 HydrophobicContact CD1-SD 3.47Å; I99-M412 WeakPolarHBondContact CD1-SD 3.5Å; G408-M412 WeakPolarHBondContact O-CG 3.47Å; G408-M412 PolarHBondContact O-N 2.99Å; L409-M412 PolarHBondContact O-N 2.96Å; M412-L414 PolarHBondContact O-N 3.44Å; M412-G415 PolarHBondContact O-N 3.43Å; M412-G415 VanDerWaalsContact O-N 3.16Å; M412-L416 WeakPolarHBondContact O-CG 3.29Å; M412-L416 PolarHBondContact O-N 3.26Å |
| 413 | G | 94.2 | Very high | 91.6 | Very high | 36 Ų | 36 | 34.2 Ų | 34.2 | 37% | 0.371 | 18% | 0.18 | S | C | . | . | H | α-helix | trans | -60.4 | -42.9 | 176.3 | 0 | 0 | 0 | 0 | 0 | 113.5 | L409 L410 C411 G415 L416 | L409-G413 PolarHBondContact O-N 3.45Å; L410-G413 PolarHBondContact O-N 3.26Å; C411-G413 VanDerWaalsContact C-N 3.32Å; C411-G413 PolarHBondContact O-N 3.48Å; G413-G415 VanDerWaalsContact C-N 3.32Å; G413-G415 PolarHBondContact O-N 3.23Å; G413-L416 PolarHBondContact O-N 3.11Å |
| 414 | L | 92.1 | Very high | 91.2 | Very high | 20 Ų | 20 | 34.9 Ų | 34.9 | 11% | 0.105 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -64.1 | -37.2 | 173.9 | -71.5 | 171.2 | 0 | 0 | 0 | 112.1 | V56 F91 L410 C411 M412 L416 S417 L420 L424 | V56-L414 HydrophobicContact CG1-CD1 3.43Å; V56-L414 VanDerWaalsContact CG1-CD1 3.43Å; F91-L414 HydrophobicContact CB-CB 4.45Å; F91-L414 HydrophobicContact CG-CB 4.44Å; L410-L414 HydrophobicContact CG-CD1 4.47Å; L410-L414 WeakPolarHBondContact O-CG 3.49Å; L410-L414 PolarHBondContact O-N 3.45Å; C411-L414 PolarHBondContact O-N 2.9Å; M412-L414 PolarHBondContact O-N 3.44Å; L414-L416 VanDerWaalsContact C-N 3.29Å; L414-L416 PolarHBondContact O-N 3.24Å; L414-S417 CarbonylContact O-C 3.4Å; L414-S417 PolarHBondContact O-N 3.23Å; L414-S417 VanDerWaalsContact O-N 3.15Å; L414-S417 VanDerWaalsContact O-O 3.07Å; L414-L420 HydrophobicContact CD2-CB 3.75Å; L414-L420 HydrophobicContact CD2-CD1 4.43Å; L414-L424 HydrophobicContact CD1-CD1 3.79Å; L414-L424 HydrophobicContact CD2-CD1 4.24Å |
| 415 | G | 91.6 | Very high | 90.6 | Very high | 0 Ų | 0 | 35.1 Ų | 35.1 | 0% | 0 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -70.8 | -22 | 177.7 | 0 | 0 | 0 | 0 | 0 | 114.7 | A88 C411 M412 G413 S417 | A88-G415 WeakPolarHBondContact CB-O 3.26Å; A88-G415 WeakPolarHBondContact O-CA 3.47Å; C411-G415 PolarHBondContact O-N 2.88Å; M412-G415 PolarHBondContact O-N 3.43Å; M412-G415 VanDerWaalsContact O-N 3.16Å; G413-G415 VanDerWaalsContact C-N 3.32Å; G413-G415 PolarHBondContact O-N 3.23Å; G415-S417 VanDerWaalsContact C-N 3.26Å |
| 416 | L | 93.5 | Very high | 90.2 | Very high | 60 Ų | 60 | 33.9 Ų | 33.9 | 31% | 0.314 | 18% | 0.181 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -78.2 | -9.2 | 171.2 | -66.9 | 173.9 | 0 | 0 | 0 | 113.2 | F92 I307 W308 L309 M412 G413 L414 | F92-L416 HydrophobicContact CD2-CD2 4.2Å; F92-L416 HydrophobicContact CD2-CG 4.31Å; F92-L416 HydrophobicContact CE2-CD2 3.91Å; F92-L416 HydrophobicContact CE2-CG 4.24Å; I307-L416 CarbonylContact C-O 3.45Å; I307-L416 WeakPolarHBondContact CA-O 3.5Å; W308-L416 PolarHBondContact N-O 3.02Å; W308-L416 CarbonylContact O-C 3.24Å; W308-L416 WeakPolarHBondContact O-CA 3.35Å; L309-L416 HydrophobicContact CD1-CD2 3.5Å; L309-L416 VanDerWaalsContact CD1-CD2 3.5Å; M412-L416 WeakPolarHBondContact O-CG 3.29Å; M412-L416 PolarHBondContact O-N 3.26Å; G413-L416 PolarHBondContact O-N 3.11Å; L414-L416 VanDerWaalsContact C-N 3.29Å; L414-L416 PolarHBondContact O-N 3.24Å |
| 417 | S | 91.9 | Very high | 89.8 | Confident | 7 Ų | 7 | 33.1 Ų | 33.1 | 5% | 0.049 | 18% | 0.177 | C | C | . | . | trans | -132.3 | 93.7 | -176.8 | -169.7 | 0 | 0 | 0 | 0 | 111.7 | W306 L414 G415 R419 L420 A421 | W306-S417 WeakPolarHBondContact O-CA 3.45Å; W306-S417 WeakPolarHBondContact O-CB 3.36Å; W306-S417 PolarHBondContact O-OG 2.9Å; L414-S417 CarbonylContact O-C 3.4Å; L414-S417 PolarHBondContact O-N 3.23Å; L414-S417 VanDerWaalsContact O-N 3.15Å; L414-S417 VanDerWaalsContact O-O 3.07Å; G415-S417 VanDerWaalsContact C-N 3.26Å; S417-R419 PolarHBondContact O-N 2.99Å; S417-L420 PolarHBondContact O-N 3.25Å; S417-L420 WeakPolarHBondContact OG-CG 3.44Å; S417-L420 PolarHBondContact OG-N 3.2Å; S417-A421 PolarHBondContact O-N 2.93Å | ||
| 418 | P | 88.8 | Confident | 89.4 | Confident | 0 Ų | 0 | 33.2 Ų | 33.2 | 0% | 0 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -54.1 | -28.2 | 173.6 | -28 | 36 | 0 | 0 | 0 | 113.5 | Q85 A88 A304 P305 W308 Q422 | Q85-P418 HydrophobicContact CG-CB 4.06Å; Q85-P418 HydrophobicContact CG-CG 3.84Å; A88-P418 HydrophobicContact CB-CB 4.34Å; A88-P418 HydrophobicContact CB-CG 4.08Å; A304-P418 HydrophobicContact CB-CB 4.22Å; P305-P418 HydrophobicContact CG-CG 4.42Å; W308-P418 HydrophobicContact CB-CG 3.85Å; W308-P418 HydrophobicContact CD2-CG 3.95Å; W308-P418 HydrophobicContact CE3-CG 3.6Å; W308-P418 HydrophobicContact CG-CG 4.1Å; W308-P418 HydrophobicContact CZ3-CG 4.48Å; P418-Q422 VanDerWaalsContact O-CB 3.29Å; P418-Q422 WeakPolarHBondContact O-CB 3.19Å; P418-Q422 PolarHBondContact O-N 3.43Å |
| 419 | R | 86.9 | Confident | 89 | Confident | 79 Ų | 79 | 34.9 Ų | 34.9 | 30% | 0.298 | 19% | 0.186 | S | C | . | . | H | α-helix | trans | -65.5 | -45 | 172.1 | -77.3 | -69.6 | -170.1 | 177.9 | 16.1 | 113.6 | K303 A304 P305 S417 Q422 L423 | K303-R419 VanDerWaalsContact CA-NH2 3.31Å; A304-R419 HydrophobicContact CB-CG 3.92Å; A304-R419 WeakPolarHBondContact O-CD 3.47Å; A304-R419 WeakPolarHBondContact O-CG 3.32Å; A304-R419 PolarHBondContact O-NE 2.93Å; P305-R419 WeakPolarHBondContact O-CG 3.47Å; S417-R419 PolarHBondContact O-N 2.99Å; R419-Q422 PolarHBondContact O-N 3.38Å; R419-L423 PolarHBondContact O-N 3.37Å |
| 420 | L | 87.6 | Confident | 88.8 | Confident | 66 Ų | 66 | 29.9 Ų | 29.9 | 35% | 0.346 | 16% | 0.161 | S | C | . | . | H | α-helix | trans | -69.7 | -37.6 | 176.2 | -64.7 | 177.3 | 0 | 0 | 0 | 111.1 | W306 L414 S417 Q422 L423 L424 | W306-L420 HydrophobicContact CZ3-CD2 4.46Å; L414-L420 HydrophobicContact CD2-CB 3.75Å; L414-L420 HydrophobicContact CD2-CD1 4.43Å; S417-L420 PolarHBondContact O-N 3.25Å; S417-L420 WeakPolarHBondContact OG-CG 3.44Å; S417-L420 PolarHBondContact OG-N 3.2Å; L420-Q422 VanDerWaalsContact C-N 3.31Å; L420-Q422 PolarHBondContact O-N 3.15Å; L420-L423 WeakPolarHBondContact O-CB 3.33Å; L420-L423 PolarHBondContact O-N 3.48Å; L420-L423 VanDerWaalsContact O-N 3.15Å; L420-L424 PolarHBondContact O-N 2.98Å |
| 421 | A | 86.1 | Confident | 88.6 | Confident | 0 Ų | 0 | 26.9 Ų | 26.9 | 0% | 0 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -59.8 | -43.3 | 172.5 | 0 | 0 | 0 | 0 | 0 | 111.1 | L87 A88 F91 S417 L423 L424 | L87-A421 HydrophobicContact CB-CB 4.46Å; L87-A421 HydrophobicContact CD2-CB 4.08Å; L87-A421 VanDerWaalsContact CD2-O 3.3Å; L87-A421 WeakPolarHBondContact CD2-O 3.46Å; A88-A421 HydrophobicContact CB-CB 4.01Å; F91-A421 HydrophobicContact CD2-CB 4.13Å; F91-A421 HydrophobicContact CE2-CB 4.34Å; S417-A421 PolarHBondContact O-N 2.93Å; A421-L423 VanDerWaalsContact C-N 3.32Å; A421-L423 PolarHBondContact O-N 2.85Å; A421-L424 WeakPolarHBondContact O-CB 3.44Å; A421-L424 PolarHBondContact O-N 3.05Å |
| 422 | Q | 83.3 | Confident | 88.4 | Confident | 34 Ų | 34 | 27.5 Ų | 27.5 | 16% | 0.159 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -63.2 | -34.3 | 173.9 | -172.7 | 179.1 | 22.3 | 0 | 0 | 112.7 | P418 R419 L420 L424 T425 | P418-Q422 VanDerWaalsContact O-CB 3.29Å; P418-Q422 WeakPolarHBondContact O-CB 3.19Å; P418-Q422 PolarHBondContact O-N 3.43Å; R419-Q422 PolarHBondContact O-N 3.38Å; L420-Q422 VanDerWaalsContact C-N 3.31Å; L420-Q422 PolarHBondContact O-N 3.15Å; Q422-L424 PolarHBondContact O-N 3.2Å; Q422-T425 PolarHBondContact O-N 2.93Å; Q422-T425 VanDerWaalsContact O-N 3.11Å; Q422-T425 PolarHBondContact O-OG1 3.18Å |
| 423 | L | 84 | Confident | 88.2 | Confident | 95 Ų | 95 | 25 Ų | 25 | 50% | 0.497 | 14% | 0.136 | S | C | . | . | H | α-helix | trans | -60.1 | -35.9 | 175.6 | -176.5 | 65.5 | 0 | 0 | 0 | 111.6 | R419 L420 A421 T425 T426 | R419-L423 PolarHBondContact O-N 3.37Å; L420-L423 WeakPolarHBondContact O-CB 3.33Å; L420-L423 PolarHBondContact O-N 3.48Å; L420-L423 VanDerWaalsContact O-N 3.15Å; A421-L423 VanDerWaalsContact C-N 3.32Å; A421-L423 PolarHBondContact O-N 2.85Å; L423-T425 VanDerWaalsContact C-N 3.25Å; L423-T425 PolarHBondContact O-N 2.96Å; L423-T426 WeakPolarHBondContact O-CB 3.32Å; L423-T426 WeakPolarHBondContact O-CG2 3.49Å; L423-T426 PolarHBondContact O-N 3.22Å; L423-T426 PolarHBondContact O-OG1 2.87Å |
| 424 | L | 83.9 | Confident | 88.2 | Confident | 20 Ų | 20 | 23.2 Ų | 23.2 | 11% | 0.105 | 12% | 0.118 | C | C | . | . | H | α-helix | trans | -69.2 | -21.8 | 178.4 | -64.1 | 173.9 | 0 | 0 | 0 | 113.3 | L57 A60 F91 L414 L420 A421 Q422 T426 I427 | L57-L424 HydrophobicContact CD2-CD2 4.44Å; A60-L424 HydrophobicContact CB-CB 4.39Å; A60-L424 HydrophobicContact CB-CD1 4.07Å; F91-L424 HydrophobicContact CE1-CD1 4.28Å; F91-L424 HydrophobicContact CE2-CD1 3.95Å; F91-L424 HydrophobicContact CZ-CD1 3.61Å; L414-L424 HydrophobicContact CD1-CD1 3.79Å; L414-L424 HydrophobicContact CD2-CD1 4.24Å; L420-L424 PolarHBondContact O-N 2.98Å; A421-L424 WeakPolarHBondContact O-CB 3.44Å; A421-L424 PolarHBondContact O-N 3.05Å; Q422-L424 PolarHBondContact O-N 3.2Å; L424-T426 PolarHBondContact O-N 3.24Å; L424-I427 HydrophobicContact CD2-CD1 4.37Å; L424-I427 WeakPolarHBondContact O-CG1 3.36Å; L424-I427 PolarHBondContact O-N 2.98Å |
| 425 | T | 79.5 | Confident | 88.2 | Confident | 6 Ų | 6 | 22.6 Ų | 22.6 | 4% | 0.037 | 12% | 0.115 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -76.5 | -10 | 175.5 | 72 | 0 | 0 | 0 | 0 | 112.7 | L87 L298 Q422 L423 I427 | L87-T425 HydrophobicContact CD2-CG2 3.47Å; L87-T425 VanDerWaalsContact CD2-CG2 3.47Å; L298-T425 HydrophobicContact CB-CG2 4.24Å; L298-T425 HydrophobicContact CD2-CG2 3.73Å; Q422-T425 PolarHBondContact O-N 2.93Å; Q422-T425 VanDerWaalsContact O-N 3.11Å; Q422-T425 PolarHBondContact O-OG1 3.18Å; L423-T425 VanDerWaalsContact C-N 3.25Å; L423-T425 PolarHBondContact O-N 2.96Å; T425-I427 PolarHBondContact O-N 3.43Å |
| 426 | T | 83.3 | Confident | 88.2 | Confident | 37 Ų | 37 | 23 Ų | 23 | 23% | 0.227 | 12% | 0.118 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -77.9 | -8.4 | 173.8 | 71.4 | 0 | 0 | 0 | 0 | 113.2 | W283 L423 L424 P428 | W283-T426 WeakPolarHBondContact CZ2-OG1 3.41Å; W283-T426 PolarHBondContact NE1-O 2.92Å; L423-T426 WeakPolarHBondContact O-CB 3.32Å; L423-T426 WeakPolarHBondContact O-CG2 3.49Å; L423-T426 PolarHBondContact O-N 3.22Å; L423-T426 PolarHBondContact O-OG1 2.87Å; L424-T426 PolarHBondContact O-N 3.24Å; T426-P428 WeakPolarHBondContact O-CD 3.41Å |
| 427 | I | 86.7 | Confident | 88.1 | Confident | 13 Ų | 13 | 21.1 Ų | 21.1 | 7% | 0.067 | 11% | 0.112 | C | C | . | . | S | Bend | trans | -64.3 | 124.6 | 171.9 | -60.3 | 171.7 | 0 | 0 | 0 | 107.8 | L57 W283 L424 T425 L429 V431 V432 | L57-I427 HydrophobicContact CD2-CD1 3.72Å; W283-I427 HydrophobicContact CD2-CG1 4.31Å; W283-I427 HydrophobicContact CH2-CG1 4.25Å; W283-I427 HydrophobicContact CZ2-CG1 4.04Å; W283-I427 HydrophobicContact CZ3-CG1 4.47Å; L424-I427 HydrophobicContact CD2-CD1 4.37Å; L424-I427 WeakPolarHBondContact O-CG1 3.36Å; L424-I427 PolarHBondContact O-N 2.98Å; T425-I427 PolarHBondContact O-N 3.43Å; I427-L429 PolarHBondContact O-N 2.89Å; I427-V431 HydrophobicContact CG2-CB 4.09Å; I427-V431 HydrophobicContact CG2-CG1 4.02Å; I427-V432 HydrophobicContact CB-CG2 4.44Å; I427-V432 HydrophobicContact CG2-CG2 3.88Å |
| 428 | P | 87.4 | Confident | 88.2 | Confident | 2 Ų | 2 | 21.7 Ų | 21.7 | 1% | 0.013 | 12% | 0.115 | C | C | . | . | trans | -59.2 | 139 | -177.8 | -22.3 | 30.3 | 0 | 0 | 0 | 112.4 | S286 T426 P430 V431 V432 | S286-P428 VanDerWaalsContact OG-CG 3.27Å; S286-P428 WeakPolarHBondContact OG-CG 2.92Å; T426-P428 WeakPolarHBondContact O-CD 3.41Å; P428-P430 VanDerWaalsContact C-N 3.31Å; P428-V431 HydrophobicContact CB-CG2 4.1Å; P428-V431 HydrophobicContact CG-CG2 4.18Å; P428-V431 WeakPolarHBondContact O-CB 3.21Å; P428-V431 PolarHBondContact O-N 2.82Å; P428-V432 PolarHBondContact O-N 3.1Å | ||
| 429 | L | 86.5 | Confident | 88.4 | Confident | 35 Ų | 35 | 21.7 Ų | 21.7 | 18% | 0.183 | 12% | 0.115 | C | C | . | . | H | α-helix | trans | -49.5 | -42.4 | 175.1 | -88.1 | 68.5 | 0 | 0 | 0 | 113.8 | F223 A226 P295 I427 V431 V432 G433 | F223-L429 HydrophobicContact CD1-CB 4.48Å; F223-L429 HydrophobicContact CD1-CD2 3.97Å; F223-L429 HydrophobicContact CD1-CG 4.15Å; F223-L429 HydrophobicContact CE1-CD2 4.43Å; A226-L429 HydrophobicContact CB-CB 4.3Å; P295-L429 HydrophobicContact CB-CD1 4.21Å; P295-L429 HydrophobicContact CG-CD1 3.85Å; I427-L429 PolarHBondContact O-N 2.89Å; L429-V431 PolarHBondContact O-N 3.37Å; L429-V432 WeakPolarHBondContact O-CB 3.26Å; L429-V432 PolarHBondContact O-N 3.36Å; L429-G433 PolarHBondContact O-N 2.92Å |
| 430 | P | 91.2 | Very high | 88.7 | Confident | 0 Ų | 0 | 18.7 Ų | 18.7 | 0% | 0 | 11% | 0.105 | C | C | . | . | H | α-helix | trans | -59.3 | -33.7 | 176.6 | -22.9 | 30.9 | 0 | 0 | 0 | 113.9 | A226 H227 L230 A231 P428 G434 | A226-P430 HydrophobicContact CB-CG 3.92Å; H227-P430 HydrophobicContact CB-CB 4.47Å; H227-P430 HydrophobicContact CB-CG 3.79Å; L230-P430 HydrophobicContact CB-CB 4.02Å; L230-P430 HydrophobicContact CB-CG 4.5Å; A231-P430 HydrophobicContact CB-CB 4.07Å; P428-P430 VanDerWaalsContact C-N 3.31Å; P430-G434 PolarHBondContact O-N 3.47Å |
| 431 | V | 92.2 | Very high | 89 | Confident | 1 Ų | 1 | 17.9 Ų | 17.9 | 1% | 0.006 | 11% | 0.107 | C | C | . | . | H | α-helix | trans | -71.1 | -46.6 | 179 | 177.5 | 0 | 0 | 0 | 0 | 110 | V234 V279 V282 I427 P428 L429 G433 G434 V435 | V234-V431 HydrophobicContact CG2-CG1 4.32Å; V279-V431 HydrophobicContact CB-CG1 4.34Å; V279-V431 HydrophobicContact CG1-CG1 4.04Å; V279-V431 HydrophobicContact CG2-CG1 3.99Å; V282-V431 HydrophobicContact CB-CG2 4.21Å; V282-V431 HydrophobicContact CG1-CG2 3.61Å; I427-V431 HydrophobicContact CG2-CB 4.09Å; I427-V431 HydrophobicContact CG2-CG1 4.02Å; P428-V431 HydrophobicContact CB-CG2 4.1Å; P428-V431 HydrophobicContact CG-CG2 4.18Å; P428-V431 WeakPolarHBondContact O-CB 3.21Å; P428-V431 PolarHBondContact O-N 2.82Å; L429-V431 PolarHBondContact O-N 3.37Å; V431-G433 VanDerWaalsContact C-N 3.33Å; V431-G433 PolarHBondContact O-N 2.88Å; V431-G434 PolarHBondContact O-N 3.39Å; V431-V435 WeakPolarHBondContact O-CG2 3.15Å; V431-V435 PolarHBondContact O-N 3.19Å |
| 432 | V | 90.1 | Very high | 89.4 | Confident | 13 Ų | 13 | 19.4 Ų | 19.4 | 8% | 0.079 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -54.9 | -49.3 | 173.3 | 169.2 | 0 | 0 | 0 | 0 | 110.4 | S61 V65 I427 P428 L429 V435 L436 | S61-V432 VanDerWaalsContact CB-CG1 3.47Å; V65-V432 HydrophobicContact CG2-CG1 3.57Å; I427-V432 HydrophobicContact CB-CG2 4.44Å; I427-V432 HydrophobicContact CG2-CG2 3.88Å; P428-V432 PolarHBondContact O-N 3.1Å; L429-V432 WeakPolarHBondContact O-CB 3.26Å; L429-V432 PolarHBondContact O-N 3.36Å; V432-V435 PolarHBondContact O-N 3.24Å; V432-L436 HydrophobicContact CG1-CD1 4.09Å; V432-L436 WeakPolarHBondContact O-CB 3.24Å; V432-L436 WeakPolarHBondContact O-CG 3.12Å; V432-L436 PolarHBondContact O-N 3.46Å |
| 433 | G | 91.3 | Very high | 89.9 | Confident | 0 Ų | 0 | 17.8 Ų | 17.8 | 0% | 0 | 11% | 0.109 | C | C | . | . | H | α-helix | trans | -59.8 | -46 | 177.7 | 0 | 0 | 0 | 0 | 0 | 113 | L429 V431 L436 G437 | L429-G433 PolarHBondContact O-N 2.92Å; V431-G433 VanDerWaalsContact C-N 3.33Å; V431-G433 PolarHBondContact O-N 2.88Å; G433-L436 PolarHBondContact O-N 2.62Å; G433-G437 PolarHBondContact O-N 3.42Å |
| 434 | G | 93.4 | Very high | 90.4 | Very high | 0 Ų | 0 | 14.7 Ų | 14.7 | 0% | 0 | 9% | 0.093 | C | C | . | . | H | α-helix | trans | -62.9 | -42.9 | 178.9 | 0 | 0 | 0 | 0 | 0 | 113.5 | P430 V431 G437 V438 | P430-G434 PolarHBondContact O-N 3.47Å; V431-G434 PolarHBondContact O-N 3.39Å; G434-G437 PolarHBondContact O-N 2.89Å; G434-V438 WeakPolarHBondContact O-CG2 3.27Å; G434-V438 PolarHBondContact O-N 3.48Å; G434-V438 VanDerWaalsContact O-N 3.09Å |
| 435 | V | 92.9 | Very high | 90.9 | Very high | 6 Ų | 6 | 17.1 Ų | 17.1 | 4% | 0.036 | 11% | 0.111 | C | C | . | . | H | α-helix | trans | -64.2 | -46.7 | 176.8 | 173.2 | 0 | 0 | 0 | 0 | 111.4 | V58 V234 M238 V275 V279 V431 V432 G437 T439 | V58-V435 HydrophobicContact CG2-CG1 3.86Å; V234-V435 HydrophobicContact CG2-CG2 4.45Å; M238-V435 HydrophobicContact SD-CG2 4.33Å; V275-V435 HydrophobicContact CG1-CG1 3.76Å; V275-V435 HydrophobicContact CG1-CG2 4.05Å; V279-V435 HydrophobicContact CG2-CG2 3.41Å; V279-V435 VanDerWaalsContact CG2-CG2 3.41Å; V431-V435 WeakPolarHBondContact O-CG2 3.15Å; V431-V435 PolarHBondContact O-N 3.19Å; V432-V435 PolarHBondContact O-N 3.24Å; V435-G437 VanDerWaalsContact C-N 3.34Å; V435-G437 PolarHBondContact O-N 2.9Å; V435-T439 WeakPolarHBondContact O-CB 3.45Å; V435-T439 WeakPolarHBondContact O-CG2 3.35Å; V435-T439 PolarHBondContact O-N 3.22Å; V435-T439 VanDerWaalsContact O-N 3.07Å; V435-T439 PolarHBondContact O-OG1 3.03Å |
| 436 | L | 91.1 | Very high | 91.4 | Very high | 10 Ų | 10 | 17.5 Ų | 17.5 | 5% | 0.052 | 12% | 0.115 | C | C | . | . | H | α-helix | trans | -61.9 | -42.6 | 176.2 | -71.9 | 174.7 | 0 | 0 | 0 | 111.3 | L62 V65 V220 P388 V432 G433 T439 Q440 | L62-L436 HydrophobicContact CD1-CD2 4.38Å; V65-L436 HydrophobicContact CG2-CD1 4Å; V220-L436 HydrophobicContact CG2-CB 4.1Å; P388-L436 HydrophobicContact CB-CD2 4.15Å; P388-L436 HydrophobicContact CG-CD2 3.98Å; V432-L436 HydrophobicContact CG1-CD1 4.09Å; V432-L436 WeakPolarHBondContact O-CB 3.24Å; V432-L436 WeakPolarHBondContact O-CG 3.12Å; V432-L436 PolarHBondContact O-N 3.46Å; G433-L436 PolarHBondContact O-N 2.62Å; L436-T439 WeakPolarHBondContact CA-OG1 3.23Å; L436-T439 PolarHBondContact O-N 3.26Å; L436-T439 PolarHBondContact O-OG1 3.12Å; L436-T439 VanDerWaalsContact O-OG1 3.13Å; L436-Q440 VanDerWaalsContact O-CB 3.25Å; L436-Q440 WeakPolarHBondContact O-CB 3.39Å; L436-Q440 WeakPolarHBondContact O-CG 3.29Å; L436-Q440 PolarHBondContact O-N 2.82Å |
| 437 | G | 92.8 | Very high | 91.9 | Very high | 20 Ų | 20 | 15.7 Ų | 15.7 | 21% | 0.206 | 10% | 0.104 | C | C | . | . | H | α-helix | trans | -59.4 | -49.5 | 179.1 | 0 | 0 | 0 | 0 | 0 | 113.1 | G433 G434 V435 A441 | G433-G437 PolarHBondContact O-N 3.42Å; G434-G437 PolarHBondContact O-N 2.89Å; V435-G437 VanDerWaalsContact C-N 3.34Å; V435-G437 PolarHBondContact O-N 2.9Å; G437-A441 WeakPolarHBondContact O-CB 3.21Å; G437-A441 PolarHBondContact O-N 3.05Å |
| 438 | V | 94.3 | Very high | 92.3 | Very high | 18 Ų | 18 | 20.3 Ų | 20.3 | 11% | 0.109 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -68.4 | -43.3 | -180 | 176.1 | 0 | 0 | 0 | 0 | 111.6 | I235 M238 L395 G434 Q440 A441 V442 | I235-V438 HydrophobicContact CB-CG2 4.35Å; I235-V438 HydrophobicContact CG1-CG2 4.07Å; I235-V438 HydrophobicContact CG2-CG2 3.98Å; M238-V438 HydrophobicContact CE-CB 3.36Å; M238-V438 HydrophobicContact CE-CG1 3.35Å; M238-V438 HydrophobicContact CE-CG2 3.85Å; L395-V438 HydrophobicContact CD1-CG1 4.2Å; L395-V438 HydrophobicContact CD2-CG1 4.46Å; G434-V438 WeakPolarHBondContact O-CG2 3.27Å; G434-V438 PolarHBondContact O-N 3.48Å; G434-V438 VanDerWaalsContact O-N 3.09Å; V438-Q440 PolarHBondContact O-N 3.48Å; V438-A441 WeakPolarHBondContact O-CB 3.44Å; V438-A441 PolarHBondContact O-N 3.32Å; V438-V442 WeakPolarHBondContact O-CG2 3.39Å; V438-V442 PolarHBondContact O-N 2.75Å; V438-V442 VanDerWaalsContact O-N 3.14Å |
| 439 | T | 92.9 | Very high | 92.4 | Very high | 0 Ų | 0 | 23.7 Ų | 23.7 | 0% | 0 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -65.8 | -38.4 | 179.9 | 51 | 0 | 0 | 0 | 0 | 112.2 | P388 K392 L395 V435 L436 V442 V443 | P388-T439 WeakPolarHBondContact O-CB 3.39Å; K392-T439 HydrophobicContact CB-CG2 4.25Å; L395-T439 HydrophobicContact CD1-CG2 4.34Å; V435-T439 WeakPolarHBondContact O-CB 3.45Å; V435-T439 WeakPolarHBondContact O-CG2 3.35Å; V435-T439 PolarHBondContact O-N 3.22Å; V435-T439 VanDerWaalsContact O-N 3.07Å; V435-T439 PolarHBondContact O-OG1 3.03Å; L436-T439 WeakPolarHBondContact CA-OG1 3.23Å; L436-T439 PolarHBondContact O-N 3.26Å; L436-T439 PolarHBondContact O-OG1 3.12Å; L436-T439 VanDerWaalsContact O-OG1 3.13Å; T439-V442 PolarHBondContact O-N 3.12Å; T439-V443 WeakPolarHBondContact O-CG2 3.36Å; T439-V443 PolarHBondContact O-N 3.21Å |
| 440 | Q | 92.2 | Very high | 92.5 | Very high | 17 Ų | 17 | 22.1 Ų | 22.1 | 8% | 0.079 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -69.4 | -34.2 | 173.9 | -70.8 | -71.2 | 9.5 | 0 | 0 | 112.7 | A216 L436 V438 V442 V443 L444 | A216-Q440 HydrophobicContact CB-CG 4.07Å; L436-Q440 VanDerWaalsContact O-CB 3.25Å; L436-Q440 WeakPolarHBondContact O-CB 3.39Å; L436-Q440 WeakPolarHBondContact O-CG 3.29Å; L436-Q440 PolarHBondContact O-N 2.82Å; V438-Q440 PolarHBondContact O-N 3.48Å; Q440-V442 VanDerWaalsContact C-N 3.26Å; Q440-V442 PolarHBondContact O-N 3.49Å; Q440-V443 PolarHBondContact O-N 2.77Å; Q440-L444 WeakPolarHBondContact O-CB 3.41Å; Q440-L444 PolarHBondContact O-N 3.37Å |
| 441 | A | 94.3 | Very high | 92.4 | Very high | 48 Ų | 48 | 23.2 Ų | 23.2 | 40% | 0.397 | 14% | 0.144 | S | C | . | . | H | α-helix | trans | -60.6 | -37.6 | 172.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | G437 V438 L444 S445 | G437-A441 WeakPolarHBondContact O-CB 3.21Å; G437-A441 PolarHBondContact O-N 3.05Å; V438-A441 WeakPolarHBondContact O-CB 3.44Å; V438-A441 PolarHBondContact O-N 3.32Å; A441-L444 WeakPolarHBondContact O-CB 3.22Å; A441-L444 PolarHBondContact O-N 2.95Å; A441-S445 PolarHBondContact O-N 3.01Å; A441-S445 PolarHBondContact O-OG 2.92Å; A441-S445 VanDerWaalsContact O-OG 3.11Å |
| 442 | V | 93.7 | Very high | 92.2 | Very high | 32 Ų | 32 | 31 Ų | 31 | 19% | 0.194 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -66.8 | -40.6 | 174.6 | 176.7 | 0 | 0 | 0 | 0 | 111.8 | G391 L395 V438 T439 Q440 S445 A446 | G391-V442 WeakPolarHBondContact O-CG1 3.45Å; L395-V442 HydrophobicContact CD2-CG2 3.53Å; L395-V442 HydrophobicContact CG-CG2 3.87Å; V438-V442 WeakPolarHBondContact O-CG2 3.39Å; V438-V442 PolarHBondContact O-N 2.75Å; V438-V442 VanDerWaalsContact O-N 3.14Å; T439-V442 PolarHBondContact O-N 3.12Å; Q440-V442 VanDerWaalsContact C-N 3.26Å; Q440-V442 PolarHBondContact O-N 3.49Å; V442-S445 PolarHBondContact O-N 3.16Å; V442-A446 WeakPolarHBondContact O-CB 3.5Å; V442-A446 PolarHBondContact O-N 3.05Å |
| 443 | V | 93.9 | Very high | 92 | Very high | 0 Ų | 0 | 32.4 Ų | 32.4 | 0% | 0 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -61.3 | -45.3 | 174.8 | 175.5 | 0 | 0 | 0 | 0 | 110.8 | L209 A212 L345 F387 T439 Q440 S445 A446 G447 | L209-V443 HydrophobicContact CD2-CG1 4.45Å; A212-V443 HydrophobicContact CB-CG1 4.39Å; L345-V443 HydrophobicContact CD2-CG1 4.07Å; L345-V443 HydrophobicContact CD2-CG2 4.18Å; F387-V443 HydrophobicContact CB-CG1 4.44Å; F387-V443 HydrophobicContact CB-CG2 4.22Å; F387-V443 HydrophobicContact CD1-CG1 3.75Å; F387-V443 HydrophobicContact CD1-CG2 4.47Å; F387-V443 HydrophobicContact CE1-CG1 4.37Å; F387-V443 HydrophobicContact CG-CG1 4.27Å; F387-V443 WeakPolarHBondContact O-CG2 3.39Å; T439-V443 WeakPolarHBondContact O-CG2 3.36Å; T439-V443 PolarHBondContact O-N 3.21Å; Q440-V443 PolarHBondContact O-N 2.77Å; V443-S445 PolarHBondContact O-N 3.2Å; V443-A446 PolarHBondContact O-N 3.16Å; V443-G447 PolarHBondContact O-N 3.24Å |
| 444 | L | 95.9 | Very high | 92 | Very high | 31 Ų | 31 | 33 Ų | 33 | 16% | 0.162 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -56.1 | -50.3 | 174.1 | 171.9 | 58.4 | 0 | 0 | 0 | 111.6 | V210 L214 Q440 A441 A446 G447 F448 | V210-L444 HydrophobicContact CB-CD1 4.03Å; V210-L444 HydrophobicContact CG1-CD1 3.67Å; V210-L444 HydrophobicContact CG2-CD1 4.16Å; V210-L444 WeakPolarHBondContact O-CD1 3.34Å; L214-L444 HydrophobicContact CD1-CD1 4.4Å; L214-L444 HydrophobicContact CD2-CD1 4.36Å; L214-L444 HydrophobicContact CD2-CD2 3.86Å; L214-L444 HydrophobicContact CG-CD1 3.9Å; L214-L444 HydrophobicContact CG-CD2 4.24Å; Q440-L444 WeakPolarHBondContact O-CB 3.41Å; Q440-L444 PolarHBondContact O-N 3.37Å; A441-L444 WeakPolarHBondContact O-CB 3.22Å; A441-L444 PolarHBondContact O-N 2.95Å; L444-A446 VanDerWaalsContact C-N 3.33Å; L444-A446 PolarHBondContact O-N 3.04Å; L444-G447 WeakPolarHBondContact O-CA 3.47Å; L444-G447 PolarHBondContact O-N 3.1Å; L444-G447 VanDerWaalsContact O-N 3.1Å; L444-F448 HydrophobicContact CD1-CD2 4.34Å; L444-F448 HydrophobicContact CD1-CE1 4.45Å; L444-F448 HydrophobicContact CD1-CE2 3.63Å; L444-F448 HydrophobicContact CD1-CZ 3.69Å; L444-F448 HydrophobicContact CD2-CE2 4.34Å; L444-F448 HydrophobicContact CG-CD2 4.33Å; L444-F448 HydrophobicContact CG-CE2 3.75Å; L444-F448 HydrophobicContact CG-CZ 4.3Å; L444-F448 PolarHBondContact O-N 3.49Å; L444-F448 VanDerWaalsContact O-N 3.08Å |
| 445 | S | 93.3 | Very high | 91.8 | Very high | 70 Ų | 70 | 36.6 Ų | 36.6 | 49% | 0.49 | 21% | 0.206 | S | C | . | . | H | α-helix | trans | -62.3 | -37.4 | 178.3 | -63.8 | 0 | 0 | 0 | 0 | 112.9 | A441 V442 V443 G447 F448 S449 | A441-S445 PolarHBondContact O-N 3.01Å; A441-S445 PolarHBondContact O-OG 2.92Å; A441-S445 VanDerWaalsContact O-OG 3.11Å; V442-S445 PolarHBondContact O-N 3.16Å; V443-S445 PolarHBondContact O-N 3.2Å; S445-G447 VanDerWaalsContact C-N 3.29Å; S445-G447 PolarHBondContact O-N 3.01Å; S445-F448 PolarHBondContact O-N 3.04Å; S445-S449 PolarHBondContact O-N 2.89Å |
| 446 | A | 91.3 | Very high | 91.6 | Very high | 14 Ų | 14 | 39.3 Ų | 39.3 | 12% | 0.116 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -65.8 | -33.6 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | L345 L349 V442 V443 L444 S449 S450 | L345-A446 HydrophobicContact CD1-CB 3.37Å; L349-A446 HydrophobicContact CD2-CB 4.49Å; V442-A446 WeakPolarHBondContact O-CB 3.5Å; V442-A446 PolarHBondContact O-N 3.05Å; V443-A446 PolarHBondContact O-N 3.16Å; L444-A446 VanDerWaalsContact C-N 3.33Å; L444-A446 PolarHBondContact O-N 3.04Å; A446-S449 PolarHBondContact O-N 3.28Å; A446-S450 PolarHBondContact O-N 3.17Å; A446-S450 PolarHBondContact O-OG 3.25Å |
| 447 | G | 93.2 | Very high | 91.5 | Very high | 0 Ų | 0 | 45.5 Ų | 45.5 | 0% | 0 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -58.8 | -48.4 | 167.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | V443 L444 S445 S449 S450 | V443-G447 PolarHBondContact O-N 3.24Å; L444-G447 WeakPolarHBondContact O-CA 3.47Å; L444-G447 PolarHBondContact O-N 3.1Å; L444-G447 VanDerWaalsContact O-N 3.1Å; S445-G447 VanDerWaalsContact C-N 3.29Å; S445-G447 PolarHBondContact O-N 3.01Å; G447-S449 PolarHBondContact O-N 2.96Å; G447-S450 WeakPolarHBondContact O-CA 3.3Å; G447-S450 WeakPolarHBondContact O-CB 3.5Å; G447-S450 PolarHBondContact O-N 3.35Å |
| 448 | F | 94 | Very high | 91.6 | Very high | 110 Ų | 110 | 45.7 Ų | 45.7 | 48% | 0.482 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -61.9 | -43.3 | 176.1 | -66.9 | -45.3 | 0 | 0 | 0 | 113.2 | V210 L444 S445 S450 F451 | V210-F448 HydrophobicContact CG1-CE1 4.05Å; V210-F448 HydrophobicContact CG1-CZ 4.29Å; V210-F448 HydrophobicContact CG2-CD1 3.77Å; V210-F448 HydrophobicContact CG2-CE1 3.74Å; V210-F448 HydrophobicContact CG2-CG 4.43Å; V210-F448 HydrophobicContact CG2-CZ 4.41Å; L444-F448 HydrophobicContact CD1-CD2 4.34Å; L444-F448 HydrophobicContact CD1-CE1 4.45Å; L444-F448 HydrophobicContact CD1-CE2 3.63Å; L444-F448 HydrophobicContact CD1-CZ 3.69Å; L444-F448 HydrophobicContact CD2-CE2 4.34Å; L444-F448 HydrophobicContact CG-CD2 4.33Å; L444-F448 HydrophobicContact CG-CE2 3.75Å; L444-F448 HydrophobicContact CG-CZ 4.3Å; L444-F448 PolarHBondContact O-N 3.49Å; L444-F448 VanDerWaalsContact O-N 3.08Å; S445-F448 PolarHBondContact O-N 3.04Å; F448-S450 PolarHBondContact O-N 2.83Å; F448-S450 VanDerWaalsContact O-N 3.15Å; F448-F451 HydrophobicContact CD1-CD2 4.26Å; F448-F451 AromaticContact CD1-CE2 3.92Å; F448-F451 HydrophobicContact CD1-CE2 3.92Å; F448-F451 PolarHBondContact O-N 3.22Å; F448-F451 VanDerWaalsContact O-N 3.15Å |
| 449 | S | 90.3 | Very high | 91.5 | Very high | 73 Ų | 73 | 47.5 Ų | 47.5 | 51% | 0.51 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -61.1 | -22.7 | 174.5 | 176.4 | 0 | 0 | 0 | 0 | 112.5 | R348 S445 A446 G447 F451 Y452 | R348-S449 PolarHBondContact NH2-O 3.08Å; S445-S449 PolarHBondContact O-N 2.89Å; A446-S449 PolarHBondContact O-N 3.28Å; G447-S449 PolarHBondContact O-N 2.96Å; S449-F451 VanDerWaalsContact C-N 3.31Å; S449-F451 PolarHBondContact O-N 3.23Å; S449-Y452 WeakPolarHBondContact O-CB 3.26Å; S449-Y452 PolarHBondContact O-N 2.95Å |
| 450 | S | 88.1 | Confident | 91.6 | Very high | 1 Ų | 1 | 48.7 Ų | 48.7 | 1% | 0.007 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -71.8 | -24.1 | 178.4 | -58.5 | 0 | 0 | 0 | 0 | 113.9 | A206 R348 A446 G447 F448 Y452 L453 | A206-S450 VanDerWaalsContact CB-CB 3.46Å; R348-S450 VanDerWaalsContact NH1-CA 3.27Å; R348-S450 PolarHBondContact NH1-OG 3.22Å; A446-S450 PolarHBondContact O-N 3.17Å; A446-S450 PolarHBondContact O-OG 3.25Å; G447-S450 WeakPolarHBondContact O-CA 3.3Å; G447-S450 WeakPolarHBondContact O-CB 3.5Å; G447-S450 PolarHBondContact O-N 3.35Å; F448-S450 PolarHBondContact O-N 2.83Å; F448-S450 VanDerWaalsContact O-N 3.15Å; S450-Y452 PolarHBondContact O-N 2.95Å; S450-L453 PolarHBondContact O-N 3.46Å |
| 451 | F | 89.4 | Confident | 91.7 | Very high | 24 Ų | 24 | 47.9 Ų | 47.9 | 11% | 0.105 | 27% | 0.273 | C | S | . | . | G | 310 helix | trans | -67.9 | -22.5 | 175.9 | -63.8 | -54.4 | 0 | 0 | 0 | 113.3 | A206 P207 V210 F448 S449 L453 A454 I456 V465 I469 | A206-F451 HydrophobicContact CB-CD1 3.48Å; A206-F451 VanDerWaalsContact CB-CD1 3.48Å; A206-F451 HydrophobicContact CB-CE1 3.2Å; A206-F451 HydrophobicContact CB-CE2 4.29Å; A206-F451 HydrophobicContact CB-CG 4.13Å; A206-F451 HydrophobicContact CB-CZ 3.63Å; P207-F451 HydrophobicContact CG-CE1 4.04Å; P207-F451 HydrophobicContact CG-CZ 4.25Å; V210-F451 HydrophobicContact CG2-CE2 4Å; V210-F451 HydrophobicContact CG2-CZ 4.26Å; F448-F451 HydrophobicContact CD1-CD2 4.26Å; F448-F451 AromaticContact CD1-CE2 3.92Å; F448-F451 HydrophobicContact CD1-CE2 3.92Å; F448-F451 PolarHBondContact O-N 3.22Å; F448-F451 VanDerWaalsContact O-N 3.15Å; S449-F451 VanDerWaalsContact C-N 3.31Å; S449-F451 PolarHBondContact O-N 3.23Å; F451-L453 PolarHBondContact O-N 3.35Å; F451-L453 VanDerWaalsContact O-N 3.1Å; F451-A454 PolarHBondContact O-N 2.93Å; F451-I456 HydrophobicContact CB-CD1 4.47Å; F451-I456 HydrophobicContact CD1-CD1 4.27Å; F451-I456 HydrophobicContact CG-CD1 4.47Å; F451-V465 HydrophobicContact CD1-CG1 4.36Å; F451-V465 HydrophobicContact CD1-CG2 3.95Å; F451-V465 HydrophobicContact CE1-CB 4.14Å; F451-V465 HydrophobicContact CE1-CG1 3.5Å; F451-V465 HydrophobicContact CE1-CG2 3.45Å; F451-V465 VanDerWaalsContact CE1-CG2 3.45Å; F451-V465 HydrophobicContact CE2-CG1 4.18Å; F451-V465 HydrophobicContact CZ-CB 4.49Å; F451-V465 HydrophobicContact CZ-CG1 3.41Å; F451-V465 VanDerWaalsContact CZ-CG1 3.41Å; F451-V465 HydrophobicContact CZ-CG2 4.26Å; F451-I469 HydrophobicContact CZ-CD1 4.3Å |
| 452 | Y | 88.8 | Confident | 91.8 | Very high | 165 Ų | 165 | 50 Ų | 50 | 65% | 0.647 | 28% | 0.277 | S | S | * | . | G | 310 helix | trans | -62.8 | -16.9 | 176.9 | -176.1 | -112.8 | 0 | 0 | 0 | 113.7 | S449 S450 A454 P533 | S449-Y452 WeakPolarHBondContact O-CB 3.26Å; S449-Y452 PolarHBondContact O-N 2.95Å; S450-Y452 PolarHBondContact O-N 2.95Å; Y452-A454 VanDerWaalsContact C-N 3.32Å; Y452-P533 HydrophobicContact CD1-CG 4.09Å; Y452-P533 HydrophobicContact CE1-CB 4.29Å; Y452-P533 HydrophobicContact CE1-CG 3.31Å |
| 453 | L | 86.1 | Confident | 91.9 | Very high | 42 Ų | 42 | 53.8 Ų | 53.8 | 22% | 0.22 | 29% | 0.291 | C | S | . | . | G | 310 helix | trans | -79.7 | -14.1 | 176.8 | -60.4 | -179.2 | 0 | 0 | 0 | 113.3 | P202 S450 F451 G527 | P202-L453 HydrophobicContact CB-CB 4.01Å; P202-L453 HydrophobicContact CG-CB 3.78Å; P202-L453 HydrophobicContact CG-CD1 4.26Å; S450-L453 PolarHBondContact O-N 3.46Å; F451-L453 PolarHBondContact O-N 3.35Å; F451-L453 VanDerWaalsContact O-N 3.1Å; L453-G527 WeakPolarHBondContact O-CA 3.39Å |
| 454 | A | 89.6 | Confident | 91.9 | Very high | 12 Ų | 12 | 53.8 Ų | 53.8 | 10% | 0.099 | 29% | 0.291 | C | S | . | . | S | Bend | trans | -121.4 | 160 | -178.8 | 0 | 0 | 0 | 0 | 0 | 110.5 | P202 L203 F451 Y452 I456 | P202-A454 HydrophobicContact CB-CB 4.39Å; L203-A454 HydrophobicContact CD1-CB 4.36Å; L203-A454 HydrophobicContact CD2-CB 3.95Å; L203-A454 HydrophobicContact CG-CB 4.02Å; F451-A454 PolarHBondContact O-N 2.93Å; Y452-A454 VanDerWaalsContact C-N 3.32Å; A454-I456 PolarHBondContact O-N 3.29Å |
| 455 | D | 90.1 | Very high | 91.9 | Very high | 76 Ų | 76 | 53 Ų | 53 | 41% | 0.406 | 29% | 0.288 | S | S | . | . | trans | -76.6 | 90.4 | 176.3 | -177.6 | 3.8 | 0 | 0 | 0 | 110.2 | D457 S458 N461 E525 | D455-D457 PolarHBondContact O-N 3.28Å; D455-D457 PolarHBondContact OD1-N 2.7Å; D455-S458 PolarHBondContact O-N 2.75Å; D455-N461 WeakPolarHBondContact O-CB 3.5Å; D455-N461 PolarHBondContact O-ND2 2.97Å; D455-E525 HydrophobicContact CB-CG 4.39Å; D455-E525 PolarHBondContact N-O 3.41Å; D455-E525 VanDerWaalsContact N-O 3.15Å | ||
| 456 | I | 89.1 | Confident | 92 | Very high | 63 Ų | 63 | 51.5 Ų | 51.5 | 32% | 0.323 | 28% | 0.283 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -75.2 | -7.6 | -176.8 | -155.8 | 59.9 | 0 | 0 | 0 | 113.2 | F451 A454 S458 I462 V465 | F451-I456 HydrophobicContact CB-CD1 4.47Å; F451-I456 HydrophobicContact CD1-CD1 4.27Å; F451-I456 HydrophobicContact CG-CD1 4.47Å; A454-I456 PolarHBondContact O-N 3.29Å; I456-S458 VanDerWaalsContact C-N 3.32Å; I456-I462 WeakPolarHBondContact O-CD1 3.26Å; I456-I462 WeakPolarHBondContact O-CG1 3.13Å; I456-V465 HydrophobicContact CD1-CG2 3.99Å |
| 457 | D | 89.2 | Confident | 92.3 | Very high | 140 Ų | 140 | 54.7 Ų | 54.7 | 75% | 0.749 | 30% | 0.295 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -82.5 | -15.3 | 177.3 | -65.6 | -35.9 | 0 | 0 | 0 | 111.8 | D455 G459 | D455-D457 PolarHBondContact O-N 3.28Å; D455-D457 PolarHBondContact OD1-N 2.7Å; D457-G459 PolarHBondContact O-N 3.25Å |
| 458 | S | 93.6 | Very high | 92.5 | Very high | 24 Ų | 24 | 54.7 Ų | 54.7 | 17% | 0.168 | 30% | 0.295 | C | S | . | . | S | Bend | trans | -67.5 | 130.6 | 172.8 | 174.7 | 0 | 0 | 0 | 0 | 112.2 | D455 I456 R460 N461 I462 E525 | D455-S458 PolarHBondContact O-N 2.75Å; I456-S458 VanDerWaalsContact C-N 3.32Å; S458-R460 PolarHBondContact O-N 3.44Å; S458-R460 VanDerWaalsContact O-N 3.16Å; S458-R460 PolarHBondContact OG-N 2.99Å; S458-N461 PolarHBondContact O-N 2.9Å; S458-I462 WeakPolarHBondContact O-CG1 3.29Å; S458-I462 PolarHBondContact O-N 3.37Å; S458-E525 VanDerWaalsContact CB-OE1 3.28Å; S458-E525 WeakPolarHBondContact CB-OE1 3.44Å; S458-E525 PolarHBondContact OG-OE1 3.11Å |
| 459 | G | 93.6 | Very high | 92.6 | Very high | 56 Ų | 56 | 50.9 Ų | 50.9 | 58% | 0.577 | 28% | 0.279 | S | S | * | . | H | α-helix | trans | -56.3 | -31 | 174.7 | 0 | 0 | 0 | 0 | 0 | 113.8 | D457 F463 | D457-G459 PolarHBondContact O-N 3.25Å; G459-F463 WeakPolarHBondContact O-CB 3.44Å; G459-F463 PolarHBondContact O-N 2.92Å; G459-F463 VanDerWaalsContact O-N 3.11Å |
| 460 | R | 94.2 | Very high | 93 | Very high | 24 Ų | 24 | 53.7 Ų | 53.7 | 9% | 0.091 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -59 | -55.3 | 172.1 | 166.9 | -176.9 | -179.2 | -89.2 | 0.4 | 110.5 | S458 F463 I464 E516 I519 P520 R526 | S458-R460 PolarHBondContact O-N 3.44Å; S458-R460 VanDerWaalsContact O-N 3.16Å; S458-R460 PolarHBondContact OG-N 2.99Å; R460-F463 PolarHBondContact O-N 3.27Å; R460-I464 HydrophobicContact CG-CD1 3.7Å; R460-I464 VanDerWaalsContact O-CG1 3.28Å; R460-I464 WeakPolarHBondContact O-CG1 3.27Å; R460-I464 PolarHBondContact O-N 3.23Å; R460-E516 IonicContact CZ-OE1 3.9Å; R460-E516 IonicContact CZ-OE2 2.83Å; R460-E516 IonicContact NH1-OE1 3.1Å; R460-E516 PolarHBondContact NH1-OE1 3.39Å; R460-E516 IonicContact NH1-OE2 3.61Å; R460-E516 PolarHBondContact NH2-O 3.49Å; R460-E516 IonicContact NH2-OE1 3.81Å; R460-E516 PolarHBondContact NH2-OE1 2.93Å; R460-E516 IonicContact NH2-OE2 3.71Å; R460-E516 PolarHBondContact NH2-OE2 2.81Å; R460-I519 HydrophobicContact CG-CG2 3.76Å; R460-I519 PolarHBondContact NE-O 3.46Å; R460-I519 PolarHBondContact NH2-O 2.78Å; R460-P520 WeakPolarHBondContact CD-O 3.1Å; R460-P520 PolarHBondContact NE-O 2.78Å; R460-R526 VanDerWaalsContact NH2-NE 3.17Å |
| 461 | N | 94.8 | Very high | 93.3 | Very high | 0 Ų | 0 | 56.7 Ų | 56.7 | 0% | 0 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -69.4 | -39.1 | -173.1 | -69.9 | -2.5 | 0 | 0 | 0 | 111.3 | L203 D455 S458 F463 I464 V465 E525 | L203-N461 HydrophobicContact CD1-CB 4.28Å; L203-N461 VanDerWaalsContact CD1-CG 3.45Å; L203-N461 WeakPolarHBondContact CD1-OD1 3.19Å; L203-N461 HydrophobicContact CD2-CB 4Å; D455-N461 WeakPolarHBondContact O-CB 3.5Å; D455-N461 PolarHBondContact O-ND2 2.97Å; S458-N461 PolarHBondContact O-N 2.9Å; N461-F463 VanDerWaalsContact C-N 3.3Å; N461-F463 PolarHBondContact O-N 2.87Å; N461-I464 PolarHBondContact O-N 3.37Å; N461-V465 WeakPolarHBondContact O-CB 3.31Å; N461-V465 VanDerWaalsContact O-CG2 3.31Å; N461-V465 WeakPolarHBondContact O-CG2 3.48Å; N461-V465 PolarHBondContact O-N 3.41Å; N461-E525 PolarHBondContact ND2-O 3.3Å |
| 462 | I | 95 | Very high | 93.7 | Very high | 93 Ų | 93 | 55.6 Ų | 55.6 | 48% | 0.477 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -55.8 | -47 | 172.5 | -65 | 170.1 | 0 | 0 | 0 | 110.4 | I456 S458 G466 | I456-I462 WeakPolarHBondContact O-CD1 3.26Å; I456-I462 WeakPolarHBondContact O-CG1 3.13Å; S458-I462 WeakPolarHBondContact O-CG1 3.29Å; S458-I462 PolarHBondContact O-N 3.37Å; I462-G466 PolarHBondContact O-N 2.95Å |
| 463 | F | 95.7 | Very high | 93.9 | Very high | 111 Ų | 111 | 50.6 Ų | 50.6 | 49% | 0.487 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -64 | -48.8 | 178.3 | -179.8 | -96.4 | 0 | 0 | 0 | 112 | G459 R460 N461 V465 G466 F467 I519 | G459-F463 WeakPolarHBondContact O-CB 3.44Å; G459-F463 PolarHBondContact O-N 2.92Å; G459-F463 VanDerWaalsContact O-N 3.11Å; R460-F463 PolarHBondContact O-N 3.27Å; N461-F463 VanDerWaalsContact C-N 3.3Å; N461-F463 PolarHBondContact O-N 2.87Å; F463-V465 PolarHBondContact O-N 3.25Å; F463-G466 PolarHBondContact O-N 3.22Å; F463-F467 HydrophobicContact CE1-CB 4.42Å; F463-F467 HydrophobicContact CZ-CB 4.34Å; F463-F467 HydrophobicContact CZ-CD2 4.13Å; F463-F467 HydrophobicContact CZ-CG 4.32Å; F463-F467 WeakPolarHBondContact O-CB 3.08Å; F463-F467 PolarHBondContact O-N 3.43Å; F463-I519 HydrophobicContact CD1-CD1 4.24Å |
| 464 | I | 95.7 | Very high | 94.3 | Very high | 0 Ų | 0 | 52.5 Ų | 52.5 | 0% | 0 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -56.2 | -51.2 | 180 | -67 | 169.2 | 0 | 0 | 0 | 110.5 | L203 R460 N461 S468 L515 E516 I519 | L203-I464 HydrophobicContact CB-CG2 4.48Å; R460-I464 HydrophobicContact CG-CD1 3.7Å; R460-I464 VanDerWaalsContact O-CG1 3.28Å; R460-I464 WeakPolarHBondContact O-CG1 3.27Å; R460-I464 PolarHBondContact O-N 3.23Å; N461-I464 PolarHBondContact O-N 3.37Å; I464-S468 WeakPolarHBondContact O-CB 3.14Å; I464-S468 PolarHBondContact O-N 2.88Å; I464-S468 PolarHBondContact O-OG 2.88Å; I464-L515 HydrophobicContact CG1-CB 3.99Å; I464-L515 HydrophobicContact CG2-CB 4.17Å; I464-E516 WeakPolarHBondContact CD1-OE2 3.38Å; I464-I519 HydrophobicContact CD1-CD1 4.25Å; I464-I519 HydrophobicContact CG1-CD1 3.88Å |
| 465 | V | 95.5 | Very high | 94.3 | Very high | 14 Ų | 14 | 54.1 Ų | 54.1 | 9% | 0.085 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -65 | -51.7 | -177.9 | 171.5 | 0 | 0 | 0 | 0 | 111 | L203 P207 F451 I456 N461 F463 S468 I469 | L203-V465 HydrophobicContact CD2-CG2 3.74Å; P207-V465 HydrophobicContact CG-CG1 4.45Å; P207-V465 HydrophobicContact CG-CG2 4.24Å; F451-V465 HydrophobicContact CD1-CG1 4.36Å; F451-V465 HydrophobicContact CD1-CG2 3.95Å; F451-V465 HydrophobicContact CE1-CB 4.14Å; F451-V465 HydrophobicContact CE1-CG1 3.5Å; F451-V465 HydrophobicContact CE1-CG2 3.45Å; F451-V465 VanDerWaalsContact CE1-CG2 3.45Å; F451-V465 HydrophobicContact CE2-CG1 4.18Å; F451-V465 HydrophobicContact CZ-CB 4.49Å; F451-V465 HydrophobicContact CZ-CG1 3.41Å; F451-V465 VanDerWaalsContact CZ-CG1 3.41Å; F451-V465 HydrophobicContact CZ-CG2 4.26Å; I456-V465 HydrophobicContact CD1-CG2 3.99Å; N461-V465 WeakPolarHBondContact O-CB 3.31Å; N461-V465 VanDerWaalsContact O-CG2 3.31Å; N461-V465 WeakPolarHBondContact O-CG2 3.48Å; N461-V465 PolarHBondContact O-N 3.41Å; F463-V465 PolarHBondContact O-N 3.25Å; V465-S468 PolarHBondContact O-N 2.87Å; V465-I469 HydrophobicContact CG1-CD1 3.72Å; V465-I469 WeakPolarHBondContact O-CG1 3.38Å; V465-I469 PolarHBondContact O-N 2.91Å; V465-I469 VanDerWaalsContact O-N 3.08Å |
| 466 | G | 95.8 | Very high | 94.3 | Very high | 39 Ų | 39 | 50.8 Ų | 50.8 | 40% | 0.402 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -61.4 | -47.4 | -177.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | I462 F463 F470 | I462-G466 PolarHBondContact O-N 2.95Å; F463-G466 PolarHBondContact O-N 3.22Å; G466-F470 WeakPolarHBondContact O-CB 3.13Å; G466-F470 PolarHBondContact O-N 3.23Å |
| 467 | F | 96.9 | Very high | 94.2 | Very high | 82 Ų | 82 | 55.5 Ų | 55.5 | 36% | 0.36 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -64.4 | -45.2 | 179.3 | -175.8 | -90.7 | 0 | 0 | 0 | 111.8 | F463 F470 M471 L515 | F463-F467 HydrophobicContact CE1-CB 4.42Å; F463-F467 HydrophobicContact CZ-CB 4.34Å; F463-F467 HydrophobicContact CZ-CD2 4.13Å; F463-F467 HydrophobicContact CZ-CG 4.32Å; F463-F467 WeakPolarHBondContact O-CB 3.08Å; F463-F467 PolarHBondContact O-N 3.43Å; F467-F470 PolarHBondContact O-N 2.91Å; F467-M471 HydrophobicContact CD1-CG 4.02Å; F467-M471 HydrophobicContact CD2-CG 4.09Å; F467-M471 HydrophobicContact CE1-CB 4.49Å; F467-M471 HydrophobicContact CE1-CG 3.74Å; F467-M471 HydrophobicContact CE2-CG 3.79Å; F467-M471 HydrophobicContact CE2-SD 4.32Å; F467-M471 HydrophobicContact CG-CG 4.22Å; F467-M471 HydrophobicContact CZ-CE 4.17Å; F467-M471 HydrophobicContact CZ-CG 3.62Å; F467-M471 HydrophobicContact CZ-SD 4.36Å; F467-M471 WeakPolarHBondContact O-CB 3.38Å; F467-M471 WeakPolarHBondContact O-CG 3.2Å; F467-M471 PolarHBondContact O-N 2.99Å; F467-L515 HydrophobicContact CB-CD1 4.4Å; F467-L515 HydrophobicContact CD1-CD1 3.55Å; F467-L515 HydrophobicContact CE1-CD1 4.2Å; F467-L515 HydrophobicContact CG-CD1 4.3Å |
| 468 | S | 97 | Very high | 94.1 | Very high | 0 Ų | 0 | 55.7 Ų | 55.7 | 0% | 0 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -63.1 | -46 | -178.1 | -56.5 | 0 | 0 | 0 | 0 | 111.8 | I464 V465 A472 S511 G512 | I464-S468 WeakPolarHBondContact O-CB 3.14Å; I464-S468 PolarHBondContact O-N 2.88Å; I464-S468 PolarHBondContact O-OG 2.88Å; V465-S468 PolarHBondContact O-N 2.87Å; S468-A472 WeakPolarHBondContact O-CB 3.37Å; S468-A472 PolarHBondContact O-N 3.45Å; S468-A472 VanDerWaalsContact O-N 3.1Å; S468-S511 WeakPolarHBondContact CA-OG 3.35Å; S468-S511 WeakPolarHBondContact CB-OG 3.5Å; S468-S511 PolarHBondContact OG-OG 2.94Å; S468-G512 WeakPolarHBondContact OG-CA 3.47Å; S468-G512 PolarHBondContact OG-N 2.93Å |
| 469 | I | 97.1 | Very high | 93.6 | Very high | 29 Ų | 29 | 55.2 Ų | 55.2 | 15% | 0.149 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -65.1 | -47.9 | 177.6 | -63.9 | 168.4 | 0 | 0 | 0 | 110.6 | P207 V210 V211 F451 V465 A472 L473 | P207-I469 HydrophobicContact CB-CD1 4.47Å; P207-I469 HydrophobicContact CB-CG1 3.84Å; V210-I469 HydrophobicContact CB-CD1 4.27Å; V210-I469 HydrophobicContact CG1-CD1 3.86Å; V210-I469 HydrophobicContact CG1-CG1 4.3Å; V210-I469 HydrophobicContact CG1-CG2 4.29Å; V211-I469 HydrophobicContact CG2-CB 4.3Å; V211-I469 HydrophobicContact CG2-CG1 4.29Å; V211-I469 HydrophobicContact CG2-CG2 4.08Å; F451-I469 HydrophobicContact CZ-CD1 4.3Å; V465-I469 HydrophobicContact CG1-CD1 3.72Å; V465-I469 WeakPolarHBondContact O-CG1 3.38Å; V465-I469 PolarHBondContact O-N 2.91Å; V465-I469 VanDerWaalsContact O-N 3.08Å; I469-A472 PolarHBondContact O-N 3.28Å; I469-L473 HydrophobicContact CG2-CD1 4.08Å; I469-L473 WeakPolarHBondContact O-CG 3.34Å; I469-L473 PolarHBondContact O-N 2.84Å |
| 470 | F | 96.9 | Very high | 92.8 | Very high | 133 Ų | 133 | 58 Ų | 58 | 58% | 0.583 | 27% | 0.268 | S | S | * | . | H | α-helix | trans | -62.9 | -49 | -176.1 | -177.5 | -102.8 | 0 | 0 | 0 | 111.8 | G466 F467 A472 L473 L474 | G466-F470 WeakPolarHBondContact O-CB 3.13Å; G466-F470 PolarHBondContact O-N 3.23Å; F467-F470 PolarHBondContact O-N 2.91Å; F470-A472 PolarHBondContact O-N 3.42Å; F470-L473 PolarHBondContact O-N 2.79Å; F470-L474 HydrophobicContact CD1-CD2 4.38Å; F470-L474 HydrophobicContact CE1-CB 4.5Å; F470-L474 HydrophobicContact CE1-CD2 3.7Å; F470-L474 HydrophobicContact CZ-CD2 4.19Å; F470-L474 VanDerWaalsContact O-CB 3.22Å; F470-L474 WeakPolarHBondContact O-CB 3.37Å; F470-L474 PolarHBondContact O-N 3.43Å |
| 471 | M | 96.1 | Very high | 92.1 | Very high | 64 Ų | 64 | 63 Ų | 63 | 32% | 0.315 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -66.4 | -37.6 | -179.8 | -69 | -61.7 | -84.7 | 0 | 0 | 112.2 | F467 L473 L474 L475 | F467-M471 HydrophobicContact CD1-CG 4.02Å; F467-M471 HydrophobicContact CD2-CG 4.09Å; F467-M471 HydrophobicContact CE1-CB 4.49Å; F467-M471 HydrophobicContact CE1-CG 3.74Å; F467-M471 HydrophobicContact CE2-CG 3.79Å; F467-M471 HydrophobicContact CE2-SD 4.32Å; F467-M471 HydrophobicContact CG-CG 4.22Å; F467-M471 HydrophobicContact CZ-CE 4.17Å; F467-M471 HydrophobicContact CZ-CG 3.62Å; F467-M471 HydrophobicContact CZ-SD 4.36Å; F467-M471 WeakPolarHBondContact O-CB 3.38Å; F467-M471 WeakPolarHBondContact O-CG 3.2Å; F467-M471 PolarHBondContact O-N 2.99Å; M471-L473 PolarHBondContact O-N 3.32Å; M471-L474 PolarHBondContact O-N 3Å; M471-L474 HydrophobicContact SD-CD2 4.19Å; M471-L475 VanDerWaalsContact O-CB 3.3Å; M471-L475 WeakPolarHBondContact O-CB 3.42Å; M471-L475 PolarHBondContact O-N 3.47Å |
| 472 | A | 96.2 | Very high | 91.2 | Very high | 0 Ų | 0 | 64 Ų | 64 | 0% | 0 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -66.5 | -23.3 | 177.5 | 0 | 0 | 0 | 0 | 0 | 114 | V211 S468 I469 F470 P476 P504 L507 A508 | V211-A472 HydrophobicContact CG1-CB 4.05Å; V211-A472 HydrophobicContact CG2-CB 3.94Å; S468-A472 WeakPolarHBondContact O-CB 3.37Å; S468-A472 PolarHBondContact O-N 3.45Å; S468-A472 VanDerWaalsContact O-N 3.1Å; I469-A472 PolarHBondContact O-N 3.28Å; F470-A472 PolarHBondContact O-N 3.42Å; A472-P476 WeakPolarHBondContact O-CD 3.45Å; A472-P476 VanDerWaalsContact O-CG 3.22Å; A472-P476 WeakPolarHBondContact O-CG 3.43Å; A472-P504 WeakPolarHBondContact CB-O 3.33Å; A472-P504 WeakPolarHBondContact O-CB 3.47Å; A472-L507 HydrophobicContact CB-CB 4.05Å; A472-A508 HydrophobicContact CB-CB 3.69Å |
| 473 | L | 93.9 | Very high | 89.2 | Confident | 60 Ų | 60 | 65.3 Ų | 65.3 | 31% | 0.314 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -92.6 | -37.8 | 173.1 | -64.6 | 175.4 | 0 | 0 | 0 | 112.3 | V211 L214 I469 F470 M471 R477 | V211-L473 HydrophobicContact CG1-CD2 4.26Å; L214-L473 HydrophobicContact CB-CD2 4.28Å; L214-L473 HydrophobicContact CD1-CD1 4Å; I469-L473 HydrophobicContact CG2-CD1 4.08Å; I469-L473 WeakPolarHBondContact O-CG 3.34Å; I469-L473 PolarHBondContact O-N 2.84Å; F470-L473 PolarHBondContact O-N 2.79Å; M471-L473 PolarHBondContact O-N 3.32Å; L473-R477 WeakPolarHBondContact O-CB 3.19Å |
| 474 | L | 93.4 | Very high | 87.3 | Confident | 82 Ų | 82 | 64.8 Ų | 64.8 | 43% | 0.429 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -67.6 | -51.4 | -178.1 | 177.8 | 67.8 | 0 | 0 | 0 | 111.8 | F470 M471 R477 W478 | F470-L474 HydrophobicContact CD1-CD2 4.38Å; F470-L474 HydrophobicContact CE1-CB 4.5Å; F470-L474 HydrophobicContact CE1-CD2 3.7Å; F470-L474 HydrophobicContact CZ-CD2 4.19Å; F470-L474 VanDerWaalsContact O-CB 3.22Å; F470-L474 WeakPolarHBondContact O-CB 3.37Å; F470-L474 PolarHBondContact O-N 3.43Å; M471-L474 PolarHBondContact O-N 3Å; M471-L474 HydrophobicContact SD-CD2 4.19Å; L474-R477 WeakPolarHBondContact O-CB 3.44Å; L474-R477 PolarHBondContact O-N 3.1Å; L474-W478 PolarHBondContact O-N 3.22Å |
| 475 | L | 91.2 | Very high | 85.9 | Confident | 46 Ų | 46 | 67.3 Ų | 67.3 | 24% | 0.241 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -67.1 | -47.6 | -168.3 | -169.1 | 66 | 0 | 0 | 0 | 112.2 | M471 R477 W478 F479 L501 L507 | M471-L475 VanDerWaalsContact O-CB 3.3Å; M471-L475 WeakPolarHBondContact O-CB 3.42Å; M471-L475 PolarHBondContact O-N 3.47Å; L475-R477 VanDerWaalsContact C-N 3.25Å; L475-R477 PolarHBondContact O-N 3.19Å; L475-W478 HydrophobicContact CD1-CE3 4.49Å; L475-W478 PolarHBondContact O-N 3.26Å; L475-F479 HydrophobicContact CD1-CD2 4.03Å; L475-F479 HydrophobicContact CD1-CE2 3.53Å; L475-F479 HydrophobicContact CD1-CZ 4.48Å; L475-F479 HydrophobicContact CD2-CE2 4.16Å; L475-F479 HydrophobicContact CG-CD2 3.84Å; L475-F479 HydrophobicContact CG-CE2 3.6Å; L475-F479 VanDerWaalsContact O-CD2 3.26Å; L475-F479 WeakPolarHBondContact O-CD2 3.32Å; L475-F479 PolarHBondContact O-N 2.86Å; L475-L501 HydrophobicContact CD2-CB 4.32Å; L475-L501 HydrophobicContact CD2-CD2 3.93Å; L475-L507 HydrophobicContact CB-CD1 4.08Å; L475-L507 HydrophobicContact CD2-CD1 3.99Å; L475-L507 HydrophobicContact CD2-CD2 4.2Å; L475-L507 HydrophobicContact CG-CD1 4.4Å |
| 476 | P | 89.4 | Confident | 84.5 | Confident | 6 Ų | 6 | 70.3 Ų | 70.3 | 4% | 0.039 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -59.7 | -35.3 | 174.1 | -28.2 | 39.4 | 0 | 0 | 0 | 113.5 | A472 R480 T502 P504 L507 | A472-P476 WeakPolarHBondContact O-CD 3.45Å; A472-P476 VanDerWaalsContact O-CG 3.22Å; A472-P476 WeakPolarHBondContact O-CG 3.43Å; P476-R480 WeakPolarHBondContact O-CB 3.39Å; P476-R480 PolarHBondContact O-N 3.44Å; P476-R480 VanDerWaalsContact O-N 3.1Å; P476-T502 HydrophobicContact CB-CG2 4.46Å; P476-P504 HydrophobicContact CG-CB 4.18Å; P476-L507 HydrophobicContact CG-CD1 3.7Å |
| 477 | R | 87.2 | Confident | 83.3 | Confident | 162 Ų | 162 | 73.6 Ų | 73.6 | 61% | 0.611 | 36% | 0.363 | S | S | * | . | H | α-helix | trans | -66.7 | -45.5 | 177.7 | -177.4 | 178.3 | 177.2 | 176.4 | -2.6 | 111.2 | L473 L474 L475 R480 E481 | L473-R477 WeakPolarHBondContact O-CB 3.19Å; L474-R477 WeakPolarHBondContact O-CB 3.44Å; L474-R477 PolarHBondContact O-N 3.1Å; L475-R477 VanDerWaalsContact C-N 3.25Å; L475-R477 PolarHBondContact O-N 3.19Å; R477-R480 PolarHBondContact O-N 3.49Å; R477-E481 WeakPolarHBondContact CG-OE1 3.32Å; R477-E481 IonicContact CZ-OE1 3.42Å; R477-E481 IonicContact NE-OE1 2.74Å; R477-E481 PolarHBondContact NE-OE1 3.47Å; R477-E481 VanDerWaalsContact NE-OE1 3.08Å; R477-E481 IonicContact NH2-OE1 3.8Å; R477-E481 PolarHBondContact O-N 3.12Å |
| 478 | W | 86.6 | Confident | 82.5 | Confident | 144 Ų | 144 | 72.9 Ų | 72.9 | 55% | 0.545 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -59.9 | -46.6 | 176.7 | -179.4 | 80.4 | 0 | 0 | 0 | 111.5 | L474 L475 R480 E481 A482 | L474-W478 PolarHBondContact O-N 3.22Å; L475-W478 HydrophobicContact CD1-CE3 4.49Å; L475-W478 PolarHBondContact O-N 3.26Å; W478-R480 VanDerWaalsContact C-N 3.26Å; W478-R480 PolarHBondContact O-N 2.99Å; W478-E481 PolarHBondContact O-N 3.28Å; W478-A482 HydrophobicContact CD2-CB 4.43Å; W478-A482 HydrophobicContact CZ2-CB 4.3Å; W478-A482 WeakPolarHBondContact O-CB 3.19Å; W478-A482 PolarHBondContact O-N 3.11Å |
| 479 | F | 83.4 | Confident | 81.7 | Confident | 15 Ų | 15 | 76.2 Ų | 76.2 | 7% | 0.066 | 40% | 0.4 | C | S | . | . | H | α-helix | trans | -61 | -33 | 176.8 | -84.2 | -66.2 | 0 | 0 | 0 | 113.5 | L475 E481 F486 H498 L501 | L475-F479 HydrophobicContact CD1-CD2 4.03Å; L475-F479 HydrophobicContact CD1-CE2 3.53Å; L475-F479 HydrophobicContact CD1-CZ 4.48Å; L475-F479 HydrophobicContact CD2-CE2 4.16Å; L475-F479 HydrophobicContact CG-CD2 3.84Å; L475-F479 HydrophobicContact CG-CE2 3.6Å; L475-F479 VanDerWaalsContact O-CD2 3.26Å; L475-F479 WeakPolarHBondContact O-CD2 3.32Å; L475-F479 PolarHBondContact O-N 2.86Å; F479-E481 VanDerWaalsContact C-N 3.31Å; F479-E481 PolarHBondContact O-N 2.82Å; F479-F486 HydrophobicContact CD1-CE2 4.37Å; F479-F486 HydrophobicContact CE1-CD2 4.07Å; F479-F486 AromaticContact CE1-CE2 3.24Å; F479-F486 HydrophobicContact CE1-CE2 3.24Å; F479-F486 AromaticContact CE1-CZ 3.72Å; F479-F486 HydrophobicContact CE1-CZ 3.72Å; F479-F486 AromaticContact CZ-CE2 3.48Å; F479-F486 HydrophobicContact CZ-CE2 3.48Å; F479-F486 VanDerWaalsContact CZ-CE2 3.48Å; F479-F486 AromaticContact CZ-CZ 3.61Å; F479-F486 HydrophobicContact CZ-CZ 3.61Å; F479-H498 AromaticContact CD1-CD2 3.82Å; F479-L501 HydrophobicContact CD2-CB 3.77Å; F479-L501 HydrophobicContact CE2-CB 3.41Å; F479-L501 VanDerWaalsContact CE2-CB 3.41Å; F479-L501 HydrophobicContact CE2-CD1 3.67Å; F479-L501 HydrophobicContact CE2-CG 4.14Å; F479-L501 HydrophobicContact CZ-CB 4.03Å; F479-L501 HydrophobicContact CZ-CD1 3.53Å; F479-L501 HydrophobicContact CZ-CG 4.44Å |
| 480 | R | 77.1 | Confident | 81.2 | Confident | 115 Ų | 115 | 84 Ų | 84 | 43% | 0.434 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -71.9 | -24 | 176.7 | -132.8 | -176.1 | -81 | -171.2 | -3.1 | 113.3 | E219 P476 R477 W478 | E219-R480 IonicContact OE1-NH1 2.73Å; P476-R480 WeakPolarHBondContact O-CB 3.39Å; P476-R480 PolarHBondContact O-N 3.44Å; P476-R480 VanDerWaalsContact O-N 3.1Å; R477-R480 PolarHBondContact O-N 3.49Å; W478-R480 VanDerWaalsContact C-N 3.26Å; W478-R480 PolarHBondContact O-N 2.99Å |
| 481 | E | 79.7 | Confident | 80.7 | Confident | 128 Ų | 128 | 80.6 Ų | 80.6 | 60% | 0.598 | 42% | 0.42 | S | S | * | . | H | α-helix | trans | -104.9 | -19.6 | -175.7 | -67.4 | 176.9 | -164 | 0 | 0 | 113.2 | R477 W478 F479 | R477-E481 WeakPolarHBondContact CG-OE1 3.32Å; R477-E481 IonicContact CZ-OE1 3.42Å; R477-E481 IonicContact NE-OE1 2.74Å; R477-E481 PolarHBondContact NE-OE1 3.47Å; R477-E481 VanDerWaalsContact NE-OE1 3.08Å; R477-E481 IonicContact NH2-OE1 3.8Å; R477-E481 PolarHBondContact O-N 3.12Å; W478-E481 PolarHBondContact O-N 3.28Å; F479-E481 VanDerWaalsContact C-N 3.31Å; F479-E481 PolarHBondContact O-N 2.82Å |
| 482 | A | 75.3 | Confident | 80.5 | Confident | 21 Ų | 21 | 79.2 Ų | 79.2 | 17% | 0.174 | 42% | 0.416 | C | S | . | . | trans | -68.8 | 131.1 | -175.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | W478 | W478-A482 HydrophobicContact CD2-CB 4.43Å; W478-A482 HydrophobicContact CZ2-CB 4.3Å; W478-A482 WeakPolarHBondContact O-CB 3.19Å; W478-A482 PolarHBondContact O-N 3.11Å | ||
| 483 | P | 52.6 | Low | 80.2 | Confident | 120 Ų | 120 | 82.6 Ų | 82.6 | 78% | 0.779 | 43% | 0.433 | S | S | * | . | S | Bend | trans | -80.4 | -13.1 | -174.6 | 30.2 | -35.1 | 0 | 0 | 0 | 115.1 | ||
| 484 | V | 56.9 | Low | 80 | Confident | 101 Ų | 101 | 80.4 Ų | 80.4 | 61% | 0.612 | 42% | 0.422 | S | S | * | . | S | Bend | trans | -129.2 | 109.3 | 179.3 | -171.7 | 0 | 0 | 0 | 0 | 109 | ||
| 485 | L | 64.9 | Low | 79.8 | Confident | 52 Ų | 52 | 76.5 Ų | 76.5 | 27% | 0.272 | 40% | 0.402 | S | S | . | . | trans | -70.8 | 157.7 | 171.4 | -106.5 | 71.2 | 0 | 0 | 0 | 110.6 | Q128 S487 H498 | Q128-L485 HydrophobicContact CG-CD2 4.08Å; L485-S487 PolarHBondContact O-N 3.22Å; L485-S487 PolarHBondContact O-OG 3.32Å; L485-H498 HydrophobicContact CD2-CB 4.46Å; L485-H498 WeakPolarHBondContact CD2-ND1 3.49Å | ||
| 486 | F | 66.7 | Low | 79.9 | Confident | 78 Ų | 78 | 76.2 Ų | 76.2 | 34% | 0.342 | 40% | 0.4 | S | S | . | . | trans | -40.7 | 125.1 | 167.4 | -65 | -71.7 | 0 | 0 | 0 | 110.8 | F479 T488 D494 L497 L501 | F479-F486 HydrophobicContact CD1-CE2 4.37Å; F479-F486 HydrophobicContact CE1-CD2 4.07Å; F479-F486 AromaticContact CE1-CE2 3.24Å; F479-F486 HydrophobicContact CE1-CE2 3.24Å; F479-F486 AromaticContact CE1-CZ 3.72Å; F479-F486 HydrophobicContact CE1-CZ 3.72Å; F479-F486 AromaticContact CZ-CE2 3.48Å; F479-F486 HydrophobicContact CZ-CE2 3.48Å; F479-F486 VanDerWaalsContact CZ-CE2 3.48Å; F479-F486 AromaticContact CZ-CZ 3.61Å; F479-F486 HydrophobicContact CZ-CZ 3.61Å; F486-T488 HydrophobicContact CB-CG2 4.47Å; F486-D494 HydrophobicContact CB-CB 4.46Å; F486-D494 WeakPolarHBondContact CB-OD1 3.25Å; F486-L497 HydrophobicContact CD2-CB 4.4Å; F486-L497 HydrophobicContact CE2-CB 4.39Å; F486-L501 HydrophobicContact CE2-CD1 3.93Å; F486-L501 HydrophobicContact CZ-CD1 4Å | ||
| 487 | S | 71.6 | Confident | 80 | Confident | 108 Ų | 108 | 78.8 Ų | 78.8 | 76% | 0.755 | 41% | 0.413 | S | S | * | . | trans | -119.5 | 69.1 | 172 | -64.6 | 0 | 0 | 0 | 0 | 106.7 | L485 G489 | L485-S487 PolarHBondContact O-N 3.22Å; L485-S487 PolarHBondContact O-OG 3.32Å; S487-G489 PolarHBondContact O-N 2.61Å | ||
| 488 | T | 78.9 | Confident | 80.1 | Confident | 66 Ų | 66 | 71.8 Ų | 71.8 | 41% | 0.405 | 39% | 0.387 | S | S | . | . | trans | -71.8 | -8.5 | 177.7 | 59.8 | 0 | 0 | 0 | 0 | 112.2 | F486 W490 L493 D494 | F486-T488 HydrophobicContact CB-CG2 4.47Å; T488-W490 PolarHBondContact OG1-N 3.29Å; T488-L493 HydrophobicContact CG2-CD2 4.34Å; T488-D494 VanDerWaalsContact CB-OD1 3.31Å; T488-D494 WeakPolarHBondContact CB-OD1 3.27Å; T488-D494 VanDerWaalsContact CG2-OD1 3.26Å; T488-D494 WeakPolarHBondContact CG2-OD1 3.44Å; T488-D494 PolarHBondContact N-OD1 3.47Å; T488-D494 VanDerWaalsContact N-OD1 3.1Å; T488-D494 VanDerWaalsContact OG1-CG 3.31Å; T488-D494 PolarHBondContact OG1-OD1 3.2Å | ||
| 489 | G | 80.3 | Confident | 80.4 | Confident | 71 Ų | 71 | 64.9 Ų | 64.9 | 73% | 0.732 | 36% | 0.361 | S | S | * | . | S | Bend | trans | 84.3 | -6.3 | -171.4 | 0 | 0 | 0 | 0 | 0 | 113 | S487 | S487-G489 PolarHBondContact O-N 2.61Š|
| 490 | W | 87.9 | Confident | 80.8 | Confident | 192 Ų | 192 | 65.3 Ų | 65.3 | 73% | 0.727 | 36% | 0.364 | S | S | * | . | trans | -118.6 | 93 | -179.2 | -78.2 | 56 | 0 | 0 | 0 | 110.4 | T488 P492 L493 D494 | T488-W490 PolarHBondContact OG1-N 3.29Å; W490-P492 VanDerWaalsContact C-N 3.31Å; W490-P492 VanDerWaalsContact O-N 3.11Å; W490-L493 HydrophobicContact CB-CB 3.97Å; W490-L493 WeakPolarHBondContact O-CB 3.48Å; W490-L493 PolarHBondContact O-N 3.03Å; W490-D494 PolarHBondContact O-N 2.89Å; W490-D494 VanDerWaalsContact O-N 3.1Å | ||
| 491 | S | 85.7 | Confident | 81.5 | Confident | 62 Ų | 62 | 62 Ų | 62 | 43% | 0.434 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -51.8 | -36.7 | -175.6 | 70.1 | 0 | 0 | 0 | 0 | 115.6 | D494 V495 | S491-D494 PolarHBondContact O-N 3.45Å; S491-V495 WeakPolarHBondContact O-CG2 3.44Å; S491-V495 PolarHBondContact O-N 3.32Å; S491-V495 VanDerWaalsContact O-N 3.11Å |
| 492 | P | 90.9 | Very high | 82.1 | Confident | 34 Ų | 34 | 56.3 Ų | 56.3 | 22% | 0.221 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -67.3 | -36.4 | 176.2 | -21.5 | 37.2 | 0 | 0 | 0 | 112.6 | P322 A326 W490 V495 L496 | P322-P492 HydrophobicContact CB-CB 4.24Å; P322-P492 HydrophobicContact CB-CG 3.58Å; A326-P492 HydrophobicContact CB-CB 4.12Å; A326-P492 WeakPolarHBondContact CB-O 3.5Å; W490-P492 VanDerWaalsContact C-N 3.31Å; W490-P492 VanDerWaalsContact O-N 3.11Å; P492-V495 PolarHBondContact O-N 2.99Å; P492-L496 WeakPolarHBondContact O-CB 3.3Å; P492-L496 PolarHBondContact O-N 2.66Å |
| 493 | L | 90.9 | Very high | 82.9 | Confident | 71 Ų | 71 | 55.3 Ų | 55.3 | 37% | 0.372 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -68.5 | -41.5 | 178.7 | -176.9 | 63.2 | 0 | 0 | 0 | 110.7 | T488 W490 V495 L496 L497 | T488-L493 HydrophobicContact CG2-CD2 4.34Å; W490-L493 HydrophobicContact CB-CB 3.97Å; W490-L493 WeakPolarHBondContact O-CB 3.48Å; W490-L493 PolarHBondContact O-N 3.03Å; L493-V495 VanDerWaalsContact C-N 3.33Å; L493-V495 PolarHBondContact O-N 3.37Å; L493-L496 PolarHBondContact O-N 3.32Å; L493-L497 HydrophobicContact CD1-CD1 4.15Å; L493-L497 HydrophobicContact CD1-CG 4.17Å; L493-L497 HydrophobicContact CG-CD1 3.98Å; L493-L497 HydrophobicContact CG-CG 4.39Å; L493-L497 WeakPolarHBondContact O-CB 3.1Å; L493-L497 WeakPolarHBondContact O-CG 3.21Å; L493-L497 PolarHBondContact O-N 3.15Å |
| 494 | D | 89.3 | Confident | 84.9 | Confident | 14 Ų | 14 | 50.1 Ų | 50.1 | 8% | 0.075 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -60.6 | -43.2 | 175.7 | -62.8 | -32.1 | 0 | 0 | 0 | 111 | F486 T488 W490 S491 H498 | F486-D494 HydrophobicContact CB-CB 4.46Å; F486-D494 WeakPolarHBondContact CB-OD1 3.25Å; T488-D494 VanDerWaalsContact CB-OD1 3.31Å; T488-D494 WeakPolarHBondContact CB-OD1 3.27Å; T488-D494 VanDerWaalsContact CG2-OD1 3.26Å; T488-D494 WeakPolarHBondContact CG2-OD1 3.44Å; T488-D494 PolarHBondContact N-OD1 3.47Å; T488-D494 VanDerWaalsContact N-OD1 3.1Å; T488-D494 VanDerWaalsContact OG1-CG 3.31Å; T488-D494 PolarHBondContact OG1-OD1 3.2Å; W490-D494 PolarHBondContact O-N 2.89Å; W490-D494 VanDerWaalsContact O-N 3.1Å; S491-D494 PolarHBondContact O-N 3.45Å; D494-H498 WeakPolarHBondContact O-CB 3.44Å; D494-H498 PolarHBondContact O-N 3.25Å |
| 495 | V | 89.9 | Confident | 86.8 | Confident | 0 Ų | 0 | 45.9 Ų | 45.9 | 0% | 0 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -61.7 | -47.1 | 174 | 172.7 | 0 | 0 | 0 | 0 | 111.2 | L125 R323 A326 A327 S491 P492 L493 S499 | L125-V495 HydrophobicContact CD1-CG1 4.41Å; R323-V495 HydrophobicContact CB-CG2 4.27Å; R323-V495 HydrophobicContact CG-CG2 4.17Å; A326-V495 HydrophobicContact CB-CB 4.28Å; A326-V495 HydrophobicContact CB-CG1 4.24Å; A327-V495 HydrophobicContact CB-CG1 3.94Å; S491-V495 WeakPolarHBondContact O-CG2 3.44Å; S491-V495 PolarHBondContact O-N 3.32Å; S491-V495 VanDerWaalsContact O-N 3.11Å; P492-V495 PolarHBondContact O-N 2.99Å; L493-V495 VanDerWaalsContact C-N 3.33Å; L493-V495 PolarHBondContact O-N 3.37Å; V495-S499 WeakPolarHBondContact O-CB 3.23Å; V495-S499 PolarHBondContact O-N 3.3Å; V495-S499 PolarHBondContact O-OG 2.86Å |
| 496 | L | 93.3 | Very high | 88.2 | Confident | 40 Ų | 40 | 44.7 Ų | 44.7 | 21% | 0.209 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -59.8 | -52.6 | -178.4 | -179.1 | 67.5 | 0 | 0 | 0 | 111.2 | A326 I329 P492 L493 S499 L500 | A326-L496 HydrophobicContact CB-CB 3.98Å; A326-L496 VanDerWaalsContact O-CD1 3.3Å; A326-L496 WeakPolarHBondContact O-CD1 3.48Å; I329-L496 HydrophobicContact CB-CD1 3.97Å; I329-L496 HydrophobicContact CG2-CD1 3.83Å; P492-L496 WeakPolarHBondContact O-CB 3.3Å; P492-L496 PolarHBondContact O-N 2.66Å; L493-L496 PolarHBondContact O-N 3.32Å; L496-S499 PolarHBondContact O-N 2.94Å; L496-L500 HydrophobicContact CD1-CD1 4.04Å; L496-L500 HydrophobicContact CG-CD1 4.14Å; L496-L500 WeakPolarHBondContact O-CB 3.28Å; L496-L500 WeakPolarHBondContact O-CG 3.5Å; L496-L500 PolarHBondContact O-N 3.07Å |
| 497 | L | 91.3 | Very high | 89.7 | Confident | 60 Ų | 60 | 42 Ų | 42 | 31% | 0.314 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -65.1 | -49 | -177.6 | -69.6 | 175.1 | 0 | 0 | 0 | 111.1 | F486 L493 S499 L500 L501 | F486-L497 HydrophobicContact CD2-CB 4.4Å; F486-L497 HydrophobicContact CE2-CB 4.39Å; L493-L497 HydrophobicContact CD1-CD1 4.15Å; L493-L497 HydrophobicContact CD1-CG 4.17Å; L493-L497 HydrophobicContact CG-CD1 3.98Å; L493-L497 HydrophobicContact CG-CG 4.39Å; L493-L497 WeakPolarHBondContact O-CB 3.1Å; L493-L497 WeakPolarHBondContact O-CG 3.21Å; L493-L497 PolarHBondContact O-N 3.15Å; L497-S499 VanDerWaalsContact C-N 3.32Å; L497-S499 PolarHBondContact O-N 3.22Å; L497-L500 PolarHBondContact O-N 3.3Å; L497-L501 WeakPolarHBondContact O-CB 3.48Å; L497-L501 WeakPolarHBondContact O-CG 3.45Å; L497-L501 PolarHBondContact O-N 3.1Å |
| 498 | H | 90 | Very high | 90.9 | Very high | 15 Ų | 15 | 36.8 Ų | 36.8 | 7% | 0.069 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -63.1 | -40.8 | 179.9 | -176 | -155.1 | 0 | 0 | 0 | 111.6 | V124 F479 L485 D494 T502 | V124-H498 HydrophobicContact CG1-CB 4.12Å; V124-H498 WeakPolarHBondContact CG1-ND1 3.19Å; F479-H498 AromaticContact CD1-CD2 3.82Å; L485-H498 HydrophobicContact CD2-CB 4.46Å; L485-H498 WeakPolarHBondContact CD2-ND1 3.49Å; D494-H498 WeakPolarHBondContact O-CB 3.44Å; D494-H498 PolarHBondContact O-N 3.25Å; H498-T502 PolarHBondContact CD2-OG1 3.42Å; H498-T502 WeakPolarHBondContact O-CB 3.09Å; H498-T502 PolarHBondContact O-N 3.3Å; H498-T502 VanDerWaalsContact O-N 3.15Å; H498-T502 PolarHBondContact O-OG1 3.39Å |
| 499 | S | 91.4 | Very high | 91.6 | Very high | 0 Ų | 0 | 33.9 Ų | 33.9 | 0% | 0 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -62.5 | -51 | 177.1 | -58.9 | 0 | 0 | 0 | 0 | 111 | V124 S330 V495 L496 L497 L501 T502 Q503 | V124-S499 WeakPolarHBondContact CG1-OG 3.48Å; S330-S499 WeakPolarHBondContact OG-CB 3.45Å; V495-S499 WeakPolarHBondContact O-CB 3.23Å; V495-S499 PolarHBondContact O-N 3.3Å; V495-S499 PolarHBondContact O-OG 2.86Å; L496-S499 PolarHBondContact O-N 2.94Å; L497-S499 VanDerWaalsContact C-N 3.32Å; L497-S499 PolarHBondContact O-N 3.22Å; S499-L501 PolarHBondContact O-N 3.29Å; S499-T502 PolarHBondContact O-N 3.48Å; S499-Q503 VanDerWaalsContact O-CG 3.23Å; S499-Q503 WeakPolarHBondContact O-CG 3.41Å |
| 500 | L | 93.1 | Very high | 92.3 | Very high | 24 Ų | 24 | 34 Ų | 34 | 13% | 0.126 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -63 | -42.9 | -179.3 | -75.2 | 172.1 | 0 | 0 | 0 | 113.3 | S330 L333 L496 L497 T502 Q503 F506 | S330-L500 PolarHBondContact OG-N 2.79Å; L333-L500 HydrophobicContact CB-CD2 4.23Å; L333-L500 HydrophobicContact CD1-CD1 4.49Å; L333-L500 HydrophobicContact CD1-CD2 4.16Å; L496-L500 HydrophobicContact CD1-CD1 4.04Å; L496-L500 HydrophobicContact CG-CD1 4.14Å; L496-L500 WeakPolarHBondContact O-CB 3.28Å; L496-L500 WeakPolarHBondContact O-CG 3.5Å; L496-L500 PolarHBondContact O-N 3.07Å; L497-L500 PolarHBondContact O-N 3.3Å; L500-T502 PolarHBondContact O-N 3.21Å; L500-Q503 WeakPolarHBondContact O-CB 3.13Å; L500-Q503 PolarHBondContact O-N 3.24Å; L500-Q503 VanDerWaalsContact O-N 3.16Å; L500-F506 HydrophobicContact CB-CE1 4.39Å; L500-F506 HydrophobicContact CD2-CD1 4.09Å; L500-F506 HydrophobicContact CD2-CE1 3.84Å; L500-F506 HydrophobicContact CD2-CZ 4.06Å |
| 501 | L | 91.8 | Very high | 92.7 | Very high | 46 Ų | 46 | 25.8 Ų | 25.8 | 24% | 0.241 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -75.5 | -9.1 | -178.6 | -60.6 | 174.8 | 0 | 0 | 0 | 113.2 | L475 F479 F486 L497 S499 L507 | L475-L501 HydrophobicContact CD2-CB 4.32Å; L475-L501 HydrophobicContact CD2-CD2 3.93Å; F479-L501 HydrophobicContact CD2-CB 3.77Å; F479-L501 HydrophobicContact CE2-CB 3.41Å; F479-L501 VanDerWaalsContact CE2-CB 3.41Å; F479-L501 HydrophobicContact CE2-CD1 3.67Å; F479-L501 HydrophobicContact CE2-CG 4.14Å; F479-L501 HydrophobicContact CZ-CB 4.03Å; F479-L501 HydrophobicContact CZ-CD1 3.53Å; F479-L501 HydrophobicContact CZ-CG 4.44Å; F486-L501 HydrophobicContact CE2-CD1 3.93Å; F486-L501 HydrophobicContact CZ-CD1 4Å; L497-L501 WeakPolarHBondContact O-CB 3.48Å; L497-L501 WeakPolarHBondContact O-CG 3.45Å; L497-L501 PolarHBondContact O-N 3.1Å; S499-L501 PolarHBondContact O-N 3.29Å; L501-L507 HydrophobicContact CD2-CD2 4.11Å; L501-L507 WeakPolarHBondContact O-CD1 3.31Å |
| 502 | T | 91.2 | Very high | 93.2 | Very high | 7 Ų | 7 | 22.8 Ų | 22.8 | 4% | 0.043 | 12% | 0.124 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -94 | -3.4 | 172.2 | -50.4 | 0 | 0 | 0 | 0 | 112.1 | I120 P476 H498 S499 L500 P504 | I120-T502 HydrophobicContact CG2-CG2 3.68Å; P476-T502 HydrophobicContact CB-CG2 4.46Å; H498-T502 PolarHBondContact CD2-OG1 3.42Å; H498-T502 WeakPolarHBondContact O-CB 3.09Å; H498-T502 PolarHBondContact O-N 3.3Å; H498-T502 VanDerWaalsContact O-N 3.15Å; H498-T502 PolarHBondContact O-OG1 3.39Å; S499-T502 PolarHBondContact O-N 3.48Å; L500-T502 PolarHBondContact O-N 3.21Å; T502-P504 WeakPolarHBondContact O-CD 3.22Å |
| 503 | Q | 93.1 | Very high | 93.4 | Very high | 1 Ų | 1 | 24.1 Ų | 24.1 | 1% | 0.005 | 13% | 0.126 | C | C | . | . | trans | -90.7 | 103.4 | -178.8 | -65.6 | -77.6 | -9.5 | 0 | 0 | 110.8 | E117 I120 S121 A334 S499 L500 I505 F506 L507 | E117-Q503 VanDerWaalsContact CA-OE1 3.28Å; E117-Q503 PolarHBondContact O-NE2 2.94Å; I120-Q503 HydrophobicContact CG2-CG 4.49Å; S121-Q503 PolarHBondContact OG-NE2 3.29Å; A334-Q503 HydrophobicContact CB-CB 4.16Å; A334-Q503 HydrophobicContact CB-CG 3.76Å; S499-Q503 VanDerWaalsContact O-CG 3.23Å; S499-Q503 WeakPolarHBondContact O-CG 3.41Å; L500-Q503 WeakPolarHBondContact O-CB 3.13Å; L500-Q503 PolarHBondContact O-N 3.24Å; L500-Q503 VanDerWaalsContact O-N 3.16Å; Q503-I505 PolarHBondContact O-N 2.64Å; Q503-F506 HydrophobicContact CB-CB 3.69Å; Q503-F506 PolarHBondContact O-N 3.29Å; Q503-L507 WeakPolarHBondContact O-CG 3.33Å; Q503-L507 PolarHBondContact O-N 3.36Å | ||
| 504 | P | 94.9 | Very high | 93.6 | Very high | 11 Ų | 11 | 25 Ų | 25 | 7% | 0.071 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -66.2 | -43.1 | -172.9 | 26.6 | -34.3 | 0 | 0 | 0 | 112.3 | V211 A472 P476 T502 L507 A508 | V211-P504 HydrophobicContact CG1-CB 3.65Å; A472-P504 WeakPolarHBondContact CB-O 3.33Å; A472-P504 WeakPolarHBondContact O-CB 3.47Å; P476-P504 HydrophobicContact CG-CB 4.18Å; T502-P504 WeakPolarHBondContact O-CD 3.22Å; P504-L507 PolarHBondContact O-N 3.41Å; P504-A508 WeakPolarHBondContact O-CB 3.27Å; P504-A508 PolarHBondContact O-N 3.03Å |
| 505 | I | 95.1 | Very high | 93.9 | Very high | 12 Ų | 12 | 25.7 Ų | 25.7 | 6% | 0.062 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -68 | -41.5 | -177.7 | -59.9 | 166.7 | 0 | 0 | 0 | 110.9 | E117 A212 F387 Q503 A508 G509 | E117-I505 VanDerWaalsContact OE1-CD1 3.29Å; E117-I505 WeakPolarHBondContact OE1-CD1 3.36Å; A212-I505 HydrophobicContact CB-CD1 3.7Å; A212-I505 HydrophobicContact CB-CG1 3.88Å; F387-I505 HydrophobicContact CD2-CD1 4.33Å; F387-I505 HydrophobicContact CE2-CD1 4.01Å; Q503-I505 PolarHBondContact O-N 2.64Å; I505-A508 PolarHBondContact O-N 2.99Å; I505-G509 PolarHBondContact O-N 3.28Å |
| 506 | F | 95.9 | Very high | 94.1 | Very high | 27 Ų | 27 | 25.8 Ų | 25.8 | 12% | 0.118 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -60.7 | -45.3 | 174.7 | 177.3 | -101.1 | 0 | 0 | 0 | 111.3 | L333 A334 L500 Q503 G509 L510 | L333-F506 HydrophobicContact CB-CD2 4.37Å; L333-F506 HydrophobicContact CB-CE2 3.96Å; A334-F506 HydrophobicContact CB-CB 4.22Å; L500-F506 HydrophobicContact CB-CE1 4.39Å; L500-F506 HydrophobicContact CD2-CD1 4.09Å; L500-F506 HydrophobicContact CD2-CE1 3.84Å; L500-F506 HydrophobicContact CD2-CZ 4.06Å; Q503-F506 HydrophobicContact CB-CB 3.69Å; Q503-F506 PolarHBondContact O-N 3.29Å; F506-G509 PolarHBondContact O-N 3.41Å; F506-L510 HydrophobicContact CE1-CB 4.5Å; F506-L510 HydrophobicContact CE1-CD2 3.81Å; F506-L510 HydrophobicContact CZ-CD2 3.99Å; F506-L510 VanDerWaalsContact O-CB 3.24Å; F506-L510 WeakPolarHBondContact O-CB 3.36Å; F506-L510 PolarHBondContact O-N 2.95Å |
| 507 | L | 96.3 | Very high | 94 | Very high | 20 Ų | 20 | 27 Ų | 27 | 11% | 0.105 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -63.5 | -42.1 | 177.8 | -75.1 | 175.1 | 0 | 0 | 0 | 112.6 | A472 L475 P476 L501 Q503 P504 L510 S511 | A472-L507 HydrophobicContact CB-CB 4.05Å; L475-L507 HydrophobicContact CB-CD1 4.08Å; L475-L507 HydrophobicContact CD2-CD1 3.99Å; L475-L507 HydrophobicContact CD2-CD2 4.2Å; L475-L507 HydrophobicContact CG-CD1 4.4Å; P476-L507 HydrophobicContact CG-CD1 3.7Å; L501-L507 HydrophobicContact CD2-CD2 4.11Å; L501-L507 WeakPolarHBondContact O-CD1 3.31Å; Q503-L507 WeakPolarHBondContact O-CG 3.33Å; Q503-L507 PolarHBondContact O-N 3.36Å; P504-L507 PolarHBondContact O-N 3.41Å; L507-L510 PolarHBondContact O-N 3.48Å; L507-S511 VanDerWaalsContact O-CB 3.28Å; L507-S511 WeakPolarHBondContact O-CB 3.4Å; L507-S511 PolarHBondContact O-N 3.3Å; L507-S511 PolarHBondContact O-OG 2.99Å |
| 508 | A | 96.9 | Very high | 94.1 | Very high | 0 Ų | 0 | 29 Ų | 29 | 0% | 0 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -61.9 | -46 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.2 | V211 A472 P504 I505 S511 G512 | V211-A508 HydrophobicContact CB-CB 3.9Å; V211-A508 HydrophobicContact CG1-CB 4.17Å; V211-A508 HydrophobicContact CG2-CB 3.85Å; A472-A508 HydrophobicContact CB-CB 3.69Å; P504-A508 WeakPolarHBondContact O-CB 3.27Å; P504-A508 PolarHBondContact O-N 3.03Å; I505-A508 PolarHBondContact O-N 2.99Å; A508-S511 PolarHBondContact O-OG 3.45Å; A508-G512 PolarHBondContact O-N 3.45Å |
| 509 | G | 94.9 | Very high | 94.3 | Very high | 5 Ų | 5 | 30.3 Ų | 30.3 | 5% | 0.052 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -65.8 | -43.8 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | V204 S208 I505 F506 F513 | V204-G509 WeakPolarHBondContact CG1-O 3.48Å; S208-G509 WeakPolarHBondContact OG-CA 3.46Å; S208-G509 PolarHBondContact OG-N 3.19Å; I505-G509 PolarHBondContact O-N 3.28Å; F506-G509 PolarHBondContact O-N 3.41Å; G509-F513 WeakPolarHBondContact O-CB 3.49Å; G509-F513 PolarHBondContact O-N 2.83Å |
| 510 | L | 95.5 | Very high | 94.4 | Very high | 72 Ų | 72 | 35.8 Ų | 35.8 | 38% | 0.377 | 20% | 0.199 | S | C | . | . | H | α-helix | trans | -67.9 | -48.4 | -179.9 | -179.1 | 64.3 | 0 | 0 | 0 | 111.9 | F506 L507 F513 L514 | F506-L510 HydrophobicContact CE1-CB 4.5Å; F506-L510 HydrophobicContact CE1-CD2 3.81Å; F506-L510 HydrophobicContact CZ-CD2 3.99Å; F506-L510 VanDerWaalsContact O-CB 3.24Å; F506-L510 WeakPolarHBondContact O-CB 3.36Å; F506-L510 PolarHBondContact O-N 2.95Å; L507-L510 PolarHBondContact O-N 3.48Å; L510-F513 PolarHBondContact O-N 3.1Å; L510-L514 HydrophobicContact CD1-CD1 4.09Å; L510-L514 HydrophobicContact CD1-CG 4.23Å; L510-L514 HydrophobicContact CG-CD1 4.08Å; L510-L514 WeakPolarHBondContact O-CB 3.35Å; L510-L514 VanDerWaalsContact O-CG 3.28Å; L510-L514 WeakPolarHBondContact O-CG 3.39Å; L510-L514 PolarHBondContact O-N 3.23Å |
| 511 | S | 96.4 | Very high | 94.1 | Very high | 20 Ų | 20 | 36 Ų | 36 | 14% | 0.14 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -64.1 | -45.7 | 178.2 | 56 | 0 | 0 | 0 | 0 | 111.5 | S468 L507 A508 F513 L514 L515 | S468-S511 WeakPolarHBondContact CA-OG 3.35Å; S468-S511 WeakPolarHBondContact CB-OG 3.5Å; S468-S511 PolarHBondContact OG-OG 2.94Å; L507-S511 VanDerWaalsContact O-CB 3.28Å; L507-S511 WeakPolarHBondContact O-CB 3.4Å; L507-S511 PolarHBondContact O-N 3.3Å; L507-S511 PolarHBondContact O-OG 2.99Å; A508-S511 PolarHBondContact O-OG 3.45Å; S511-F513 PolarHBondContact O-N 2.86Å; S511-L514 PolarHBondContact O-N 2.87Å; S511-L515 WeakPolarHBondContact O-CB 3.36Å; S511-L515 WeakPolarHBondContact O-CG 3.4Å; S511-L515 PolarHBondContact O-N 3.47Å |
| 512 | G | 95.5 | Very high | 93.9 | Very high | 0 Ų | 0 | 38 Ų | 38 | 0% | 0 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -58.1 | -48 | 174.1 | 0 | 0 | 0 | 0 | 0 | 111.5 | S468 A508 L514 L515 E516 | S468-G512 WeakPolarHBondContact OG-CA 3.47Å; S468-G512 PolarHBondContact OG-N 2.93Å; A508-G512 PolarHBondContact O-N 3.45Å; G512-L514 PolarHBondContact O-N 2.82Å; G512-L515 PolarHBondContact O-N 2.92Å; G512-E516 WeakPolarHBondContact O-CB 3.35Å; G512-E516 PolarHBondContact O-N 3.26Å |
| 513 | F | 94.9 | Very high | 93.7 | Very high | 61 Ų | 61 | 43.1 Ų | 43.1 | 27% | 0.268 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -60.7 | -47.2 | 179.1 | 178.7 | -93.1 | 0 | 0 | 0 | 112.8 | V196 H199 V204 G509 L510 S511 N517 | V196-F513 HydrophobicContact CG1-CE2 4.18Å; H199-F513 HydrophobicContact CB-CE2 3.89Å; V204-F513 HydrophobicContact CG1-CB 4.05Å; V204-F513 HydrophobicContact CG2-CB 4.35Å; G509-F513 WeakPolarHBondContact O-CB 3.49Å; G509-F513 PolarHBondContact O-N 2.83Å; L510-F513 PolarHBondContact O-N 3.1Å; S511-F513 PolarHBondContact O-N 2.86Å; F513-N517 WeakPolarHBondContact CE2-ND2 3.43Å; F513-N517 WeakPolarHBondContact O-CB 3.38Å; F513-N517 PolarHBondContact O-N 2.87Å; F513-N517 PolarHBondContact O-ND2 3.37Å |
| 514 | L | 95.7 | Very high | 93.3 | Very high | 89 Ų | 89 | 48.1 Ų | 48.1 | 47% | 0.466 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -64 | -49 | 179.9 | -71.9 | 173.7 | 0 | 0 | 0 | 110.9 | L510 S511 G512 N517 T518 | L510-L514 HydrophobicContact CD1-CD1 4.09Å; L510-L514 HydrophobicContact CD1-CG 4.23Å; L510-L514 HydrophobicContact CG-CD1 4.08Å; L510-L514 WeakPolarHBondContact O-CB 3.35Å; L510-L514 VanDerWaalsContact O-CG 3.28Å; L510-L514 WeakPolarHBondContact O-CG 3.39Å; L510-L514 PolarHBondContact O-N 3.23Å; S511-L514 PolarHBondContact O-N 2.87Å; G512-L514 PolarHBondContact O-N 2.82Å; L514-N517 PolarHBondContact O-N 3.23Å; L514-T518 VanDerWaalsContact O-CB 3.28Å; L514-T518 WeakPolarHBondContact O-CB 3.11Å; L514-T518 WeakPolarHBondContact O-CG2 3.31Å; L514-T518 PolarHBondContact O-N 3.49Å; L514-T518 PolarHBondContact O-OG1 2.98Å |
| 515 | L | 95.6 | Very high | 92.9 | Very high | 30 Ų | 30 | 49.2 Ų | 49.2 | 16% | 0.157 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -67.3 | -39.6 | -177.7 | -64.8 | 172.2 | 0 | 0 | 0 | 111.8 | I464 F467 S511 G512 N517 T518 I519 | I464-L515 HydrophobicContact CG1-CB 3.99Å; I464-L515 HydrophobicContact CG2-CB 4.17Å; F467-L515 HydrophobicContact CB-CD1 4.4Å; F467-L515 HydrophobicContact CD1-CD1 3.55Å; F467-L515 HydrophobicContact CE1-CD1 4.2Å; F467-L515 HydrophobicContact CG-CD1 4.3Å; S511-L515 WeakPolarHBondContact O-CB 3.36Å; S511-L515 WeakPolarHBondContact O-CG 3.4Å; S511-L515 PolarHBondContact O-N 3.47Å; G512-L515 PolarHBondContact O-N 2.92Å; L515-N517 VanDerWaalsContact C-N 3.32Å; L515-N517 PolarHBondContact O-N 3.14Å; L515-T518 PolarHBondContact O-N 2.84Å; L515-I519 HydrophobicContact CB-CD1 4.09Å; L515-I519 HydrophobicContact CD2-CD1 4.07Å; L515-I519 VanDerWaalsContact O-CB 3.28Å; L515-I519 WeakPolarHBondContact O-CB 3.25Å; L515-I519 VanDerWaalsContact O-CG1 3.28Å; L515-I519 WeakPolarHBondContact O-CG1 3.38Å; L515-I519 PolarHBondContact O-N 3.47Å |
| 516 | E | 93.3 | Very high | 92.5 | Very high | 2 Ų | 2 | 50.4 Ų | 50.4 | 1% | 0.009 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -60.4 | -42.4 | 177.8 | -174.8 | 55.8 | -146.1 | 0 | 0 | 112.3 | L203 V204 R460 I464 G512 R526 | L203-E516 HydrophobicContact CB-CG 4.48Å; L203-E516 WeakPolarHBondContact CB-OE2 3.14Å; L203-E516 WeakPolarHBondContact CD1-OE2 3.25Å; V204-E516 HydrophobicContact CG2-CB 3.97Å; V204-E516 HydrophobicContact CG2-CG 4.16Å; R460-E516 IonicContact CZ-OE1 3.9Å; R460-E516 IonicContact CZ-OE2 2.83Å; R460-E516 IonicContact NH1-OE1 3.1Å; R460-E516 PolarHBondContact NH1-OE1 3.39Å; R460-E516 IonicContact NH1-OE2 3.61Å; R460-E516 PolarHBondContact NH2-O 3.49Å; R460-E516 IonicContact NH2-OE1 3.81Å; R460-E516 PolarHBondContact NH2-OE1 2.93Å; R460-E516 IonicContact NH2-OE2 3.71Å; R460-E516 PolarHBondContact NH2-OE2 2.81Å; I464-E516 WeakPolarHBondContact CD1-OE2 3.38Å; G512-E516 WeakPolarHBondContact O-CB 3.35Å; G512-E516 PolarHBondContact O-N 3.26Å; E516-R526 PolarHBondContact O-NH2 2.89Å; E516-R526 WeakPolarHBondContact OE1-CB 3.44Å; E516-R526 WeakPolarHBondContact OE1-CD 3.44Å; E516-R526 WeakPolarHBondContact OE1-CG 3.4Å; E516-R526 IonicContact OE1-NE 3.71Å |
| 517 | N | 91.9 | Very high | 91.9 | Very high | 64 Ų | 64 | 49.7 Ų | 49.7 | 34% | 0.342 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -85.6 | -23.9 | -177 | -72.2 | -76.5 | 0 | 0 | 0 | 113.6 | F513 L514 L515 | F513-N517 WeakPolarHBondContact CE2-ND2 3.43Å; F513-N517 WeakPolarHBondContact O-CB 3.38Å; F513-N517 PolarHBondContact O-N 2.87Å; F513-N517 PolarHBondContact O-ND2 3.37Å; L514-N517 PolarHBondContact O-N 3.23Å; L515-N517 VanDerWaalsContact C-N 3.32Å; L515-N517 PolarHBondContact O-N 3.14Å |
| 518 | T | 93.6 | Very high | 91 | Very high | 102 Ų | 102 | 52 Ų | 52 | 63% | 0.626 | 29% | 0.291 | S | S | * | . | H | α-helix | trans | -92.8 | -30.3 | -179.6 | 56.1 | 0 | 0 | 0 | 0 | 113.6 | L514 L515 | L514-T518 VanDerWaalsContact O-CB 3.28Å; L514-T518 WeakPolarHBondContact O-CB 3.11Å; L514-T518 WeakPolarHBondContact O-CG2 3.31Å; L514-T518 PolarHBondContact O-N 3.49Å; L514-T518 PolarHBondContact O-OG1 2.98Å; L515-T518 PolarHBondContact O-N 2.84Å |
| 519 | I | 94.1 | Very high | 89.1 | Confident | 44 Ų | 44 | 54.4 Ų | 54.4 | 23% | 0.226 | 32% | 0.316 | C | S | . | . | S | Bend | trans | -85.4 | 123.3 | 179.6 | -57.7 | 173.4 | 0 | 0 | 0 | 109.7 | R460 F463 I464 L515 R526 | R460-I519 HydrophobicContact CG-CG2 3.76Å; R460-I519 PolarHBondContact NE-O 3.46Å; R460-I519 PolarHBondContact NH2-O 2.78Å; F463-I519 HydrophobicContact CD1-CD1 4.24Å; I464-I519 HydrophobicContact CD1-CD1 4.25Å; I464-I519 HydrophobicContact CG1-CD1 3.88Å; L515-I519 HydrophobicContact CB-CD1 4.09Å; L515-I519 HydrophobicContact CD2-CD1 4.07Å; L515-I519 VanDerWaalsContact O-CB 3.28Å; L515-I519 WeakPolarHBondContact O-CB 3.25Å; L515-I519 VanDerWaalsContact O-CG1 3.28Å; L515-I519 WeakPolarHBondContact O-CG1 3.38Å; L515-I519 PolarHBondContact O-N 3.47Å; I519-R526 PolarHBondContact O-NH2 2.66Å; I519-R526 VanDerWaalsContact O-NH2 3.14Å |
| 520 | P | 91.9 | Very high | 86.8 | Confident | 114 Ų | 114 | 59.3 Ų | 59.3 | 74% | 0.74 | 34% | 0.337 | S | S | * | . | trans | -61.6 | 138.6 | -179.2 | 26.5 | -34.8 | 0 | 0 | 0 | 110.9 | R460 | R460-P520 WeakPolarHBondContact CD-O 3.1Å; R460-P520 PolarHBondContact NE-O 2.78Å | ||
| 521 | G | 87.4 | Confident | 84.4 | Confident | 29 Ų | 29 | 59.1 Ų | 59.1 | 30% | 0.299 | 35% | 0.352 | S | S | . | . | trans | -174.2 | 156.9 | 179.4 | 0 | 0 | 0 | 0 | 0 | 111 | E525 R526 | G521-E525 VanDerWaalsContact CA-OE2 3.31Å; G521-E525 WeakPolarHBondContact CA-OE2 3.44Å; G521-R526 PolarHBondContact O-NE 3.42Å | ||
| 522 | T | 88.8 | Confident | 81.5 | Confident | 88 Ų | 88 | 61.8 Ų | 61.8 | 54% | 0.54 | 37% | 0.365 | S | S | . | . | trans | -80.8 | 153.7 | -175.7 | 67.4 | 0 | 0 | 0 | 0 | 112.2 | L524 E525 R526 | T522-L524 PolarHBondContact O-N 3.28Å; T522-L524 VanDerWaalsContact O-N 3.16Å; T522-E525 PolarHBondContact N-OE2 3.19Å; T522-E525 VanDerWaalsContact N-OE2 3.11Å; T522-E525 WeakPolarHBondContact O-CB 3.44Å; T522-E525 PolarHBondContact O-N 3.48Å; T522-E525 VanDerWaalsContact O-N 3.14Å; T522-E525 VanDerWaalsContact OG1-CB 3.25Å; T522-E525 WeakPolarHBondContact OG1-CB 3.35Å; T522-E525 PolarHBondContact OG1-N 3.44Å; T522-R526 WeakPolarHBondContact O-CG 3.14Å; T522-R526 PolarHBondContact O-N 2.72Å | ||
| 523 | Q | 85.7 | Confident | 78.4 | Confident | 115 Ų | 115 | 62.8 Ų | 62.8 | 54% | 0.537 | 37% | 0.371 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -56.6 | -33.3 | 178.7 | -70.2 | -73.5 | 4.9 | 0 | 0 | 113.3 | G527 L528 G529 | Q523-G527 PolarHBondContact O-N 2.89Å; Q523-L528 PolarHBondContact O-N 2.92Å; Q523-G529 PolarHBondContact O-N 3.22Å |
| 524 | L | 84.3 | Confident | 75.3 | Confident | 105 Ų | 105 | 64.5 Ų | 64.5 | 55% | 0.55 | 39% | 0.391 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -70.2 | -47.7 | 176.4 | -70.4 | 175 | 0 | 0 | 0 | 111.6 | T522 R526 G527 Q530 | T522-L524 PolarHBondContact O-N 3.28Å; T522-L524 VanDerWaalsContact O-N 3.16Å; L524-R526 PolarHBondContact O-N 3.01Å; L524-G527 PolarHBondContact O-N 3.41Å; L524-Q530 HydrophobicContact CD2-CG 3.91Å |
| 525 | E | 86.9 | Confident | 72 | Confident | 34 Ų | 34 | 66 Ų | 66 | 16% | 0.159 | 40% | 0.403 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -57.1 | -37.3 | 176.1 | -178.8 | -174.1 | -173.6 | 0 | 0 | 111.5 | D455 S458 N461 G521 T522 G527 | D455-E525 HydrophobicContact CB-CG 4.39Å; D455-E525 PolarHBondContact N-O 3.41Å; D455-E525 VanDerWaalsContact N-O 3.15Å; S458-E525 VanDerWaalsContact CB-OE1 3.28Å; S458-E525 WeakPolarHBondContact CB-OE1 3.44Å; S458-E525 PolarHBondContact OG-OE1 3.11Å; N461-E525 PolarHBondContact ND2-O 3.3Å; G521-E525 VanDerWaalsContact CA-OE2 3.31Å; G521-E525 WeakPolarHBondContact CA-OE2 3.44Å; T522-E525 PolarHBondContact N-OE2 3.19Å; T522-E525 VanDerWaalsContact N-OE2 3.11Å; T522-E525 WeakPolarHBondContact O-CB 3.44Å; T522-E525 PolarHBondContact O-N 3.48Å; T522-E525 VanDerWaalsContact O-N 3.14Å; T522-E525 VanDerWaalsContact OG1-CB 3.25Å; T522-E525 WeakPolarHBondContact OG1-CB 3.35Å; T522-E525 PolarHBondContact OG1-N 3.44Å; E525-G527 VanDerWaalsContact C-N 3.28Å; E525-G527 PolarHBondContact O-N 3.48Å |
| 526 | R | 86.1 | Confident | 68.9 | Low | 38 Ų | 38 | 70 Ų | 70 | 14% | 0.143 | 42% | 0.42 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -72.9 | -16.6 | 177.3 | -62 | -177.4 | -179.3 | -158.4 | -8.5 | 114.2 | P202 R460 E516 I519 G521 T522 L524 L528 | P202-R526 WeakPolarHBondContact CD-O 3.3Å; R460-R526 VanDerWaalsContact NH2-NE 3.17Å; E516-R526 PolarHBondContact O-NH2 2.89Å; E516-R526 WeakPolarHBondContact OE1-CB 3.44Å; E516-R526 WeakPolarHBondContact OE1-CD 3.44Å; E516-R526 WeakPolarHBondContact OE1-CG 3.4Å; E516-R526 IonicContact OE1-NE 3.71Å; I519-R526 PolarHBondContact O-NH2 2.66Å; I519-R526 VanDerWaalsContact O-NH2 3.14Å; G521-R526 PolarHBondContact O-NE 3.42Å; T522-R526 WeakPolarHBondContact O-CG 3.14Å; T522-R526 PolarHBondContact O-N 2.72Å; L524-R526 PolarHBondContact O-N 3.01Å; R526-L528 HydrophobicContact CB-CB 4.35Å; R526-L528 HydrophobicContact CB-CD1 3.88Å; R526-L528 HydrophobicContact CB-CG 3.9Å |
| 527 | G | 83.2 | Confident | 65.7 | Low | 11 Ų | 11 | 72.8 Ų | 72.8 | 11% | 0.113 | 44% | 0.437 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 73.7 | 25.4 | -171.5 | 0 | 0 | 0 | 0 | 0 | 114.3 | L453 Q523 L524 E525 | L453-G527 WeakPolarHBondContact O-CA 3.39Å; Q523-G527 PolarHBondContact O-N 2.89Å; L524-G527 PolarHBondContact O-N 3.41Å; E525-G527 VanDerWaalsContact C-N 3.28Å; E525-G527 PolarHBondContact O-N 3.48Å |
| 528 | L | 79.3 | Confident | 62.7 | Low | 70 Ų | 70 | 73 Ų | 73 | 37% | 0.366 | 45% | 0.447 | S | S | . | . | trans | -101 | -12.3 | -178.7 | -69.9 | 175.7 | 0 | 0 | 0 | 113.1 | Q523 R526 | Q523-L528 PolarHBondContact O-N 2.92Å; R526-L528 HydrophobicContact CB-CB 4.35Å; R526-L528 HydrophobicContact CB-CD1 3.88Å; R526-L528 HydrophobicContact CB-CG 3.9Å | ||
| 529 | G | 56.6 | Low | 59.6 | Low | 50 Ų | 50 | 74.6 Ų | 74.6 | 52% | 0.515 | 45% | 0.448 | S | S | . | . | S | Bend | trans | -102.7 | -7.9 | -179.5 | 0 | 0 | 0 | 0 | 0 | 115.9 | Q523 | Q523-G529 PolarHBondContact O-N 3.22Š|
| 530 | Q | 46.3 | Very low | 56.6 | Low | 108 Ų | 108 | 77.8 Ų | 77.8 | 51% | 0.505 | 46% | 0.461 | S | S | . | . | trans | -106.1 | 111.1 | -178.2 | -73.1 | -176.7 | -3.5 | 0 | 0 | 110.3 | L524 | L524-Q530 HydrophobicContact CD2-CG 3.91Š| ||
| 531 | G | 44.9 | Very low | 53.6 | Low | 67 Ų | 67 | 76.9 Ų | 76.9 | 69% | 0.691 | 46% | 0.464 | S | S | * | . | S | Bend | trans | -53.8 | 143.8 | 141.4 | 0 | 0 | 0 | 0 | 0 | 107.9 | ||
| 532 | L | 35.1 | Very low | 50.8 | Low | 77 Ų | 77 | 85.9 Ų | 85.9 | 40% | 0.403 | 49% | 0.489 | S | S | . | . | S | Bend | trans | -21 | 137.9 | -174.3 | -119.8 | 72.3 | 0 | 0 | 0 | 115.7 | F536 T537 | L532-F536 HydrophobicContact CB-CB 4.22Å; L532-F536 HydrophobicContact CD2-CB 3.82Å; L532-F536 HydrophobicContact CD2-CD1 4.21Å; L532-F536 HydrophobicContact CD2-CD2 3.94Å; L532-F536 HydrophobicContact CD2-CG 3.73Å; L532-T537 WeakPolarHBondContact O-CG2 3.11Å |
| 533 | P | 31.5 | Very low | 48 | Very low | 21 Ų | 21 | 86.7 Ų | 86.7 | 14% | 0.136 | 49% | 0.488 | C | S | . | . | trans | -56.4 | 156.7 | -174.6 | 16.6 | -27.6 | 0 | 0 | 0 | 114.6 | Y452 V535 F536 | Y452-P533 HydrophobicContact CD1-CG 4.09Å; Y452-P533 HydrophobicContact CE1-CB 4.29Å; Y452-P533 HydrophobicContact CE1-CG 3.31Å; P533-V535 PolarHBondContact O-N 2.94Å; P533-F536 PolarHBondContact O-N 2.96Å | ||
| 534 | S | 28.6 | Very low | 45.4 | Very low | 97 Ų | 97 | 85.4 Ų | 85.4 | 68% | 0.678 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -57 | -4.9 | -162.3 | 54.9 | 0 | 0 | 0 | 0 | 118.7 | F536 T537 | S534-F536 VanDerWaalsContact C-N 3.35Å; S534-T537 VanDerWaalsContact CA-OG1 3.27Å; S534-T537 WeakPolarHBondContact CA-OG1 3.13Å; S534-T537 PolarHBondContact O-OG1 3.49Å |
| 535 | V | 26.5 | Very low | 43.1 | Very low | 121 Ų | 121 | 87.8 Ų | 87.8 | 73% | 0.733 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -80 | -23.2 | 170 | -177.8 | 0 | 0 | 0 | 0 | 111.1 | P533 | P533-V535 PolarHBondContact O-N 2.94Å |
| 536 | F | 30.9 | Very low | 40.5 | Very low | 114 Ų | 114 | 93.4 Ų | 93.4 | 50% | 0.5 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -98.1 | -20.8 | 175.4 | -71.8 | -82.9 | 0 | 0 | 0 | 113.4 | L532 P533 S534 A538 Q539 E540 | L532-F536 HydrophobicContact CB-CB 4.22Å; L532-F536 HydrophobicContact CD2-CB 3.82Å; L532-F536 HydrophobicContact CD2-CD1 4.21Å; L532-F536 HydrophobicContact CD2-CD2 3.94Å; L532-F536 HydrophobicContact CD2-CG 3.73Å; P533-F536 PolarHBondContact O-N 2.96Å; S534-F536 VanDerWaalsContact C-N 3.35Å; F536-A538 VanDerWaalsContact C-N 3.27Å; F536-A538 PolarHBondContact O-N 3.23Å; F536-Q539 WeakPolarHBondContact O-CA 3.43Å; F536-Q539 VanDerWaalsContact O-CB 3.3Å; F536-Q539 WeakPolarHBondContact O-CB 3.18Å; F536-Q539 PolarHBondContact O-N 3.12Å; F536-E540 PolarHBondContact O-N 3.13Å |
| 537 | T | 26.9 | Very low | 38 | Very low | 60 Ų | 60 | 93.2 Ų | 93.2 | 37% | 0.368 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -69.6 | -21.2 | 176.3 | 58.9 | 0 | 0 | 0 | 0 | 113.5 | L532 S534 Q539 E540 A541 | L532-T537 WeakPolarHBondContact O-CG2 3.11Å; S534-T537 VanDerWaalsContact CA-OG1 3.27Å; S534-T537 WeakPolarHBondContact CA-OG1 3.13Å; S534-T537 PolarHBondContact O-OG1 3.49Å; T537-Q539 PolarHBondContact O-N 3.15Å; T537-E540 PolarHBondContact O-N 3.48Å; T537-A541 WeakPolarHBondContact O-CB 3.45Å; T537-A541 PolarHBondContact O-N 2.94Å |
| 538 | A | 28.8 | Very low | 35.8 | Very low | 68 Ų | 68 | 103 Ų | 103 | 56% | 0.562 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -66.9 | -25.3 | 169 | 0 | 0 | 0 | 0 | 0 | 112.5 | F536 | F536-A538 VanDerWaalsContact C-N 3.27Å; F536-A538 PolarHBondContact O-N 3.23Å |
| 539 | Q | 28.4 | Very low | 34 | Very low | 136 Ų | 136 | 105.7 Ų | 105.7 | 64% | 0.636 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -86 | -37.9 | 172.6 | -162 | 87.9 | -6.7 | 0 | 0 | 110.8 | F536 T537 R542 M543 | F536-Q539 WeakPolarHBondContact O-CA 3.43Å; F536-Q539 VanDerWaalsContact O-CB 3.3Å; F536-Q539 WeakPolarHBondContact O-CB 3.18Å; F536-Q539 PolarHBondContact O-N 3.12Å; T537-Q539 PolarHBondContact O-N 3.15Å; Q539-R542 CarbonylContact O-C 3.47Å; Q539-R542 PolarHBondContact O-N 3.46Å; Q539-M543 VanDerWaalsContact O-CG 3.28Å; Q539-M543 WeakPolarHBondContact O-CG 3.44Å; Q539-M543 PolarHBondContact O-N 2.81Å; Q539-M543 VanDerWaalsContact O-N 3.07Å |
| 540 | E | 29.8 | Very low | 33.5 | Very low | 110 Ų | 110 | 110 Ų | 110 | 51% | 0.514 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -77.3 | -35.1 | -176.2 | -147.8 | 132.2 | -158.6 | 0 | 0 | 113.1 | F536 T537 R542 M543 | F536-E540 PolarHBondContact O-N 3.13Å; T537-E540 PolarHBondContact O-N 3.48Å; E540-R542 PolarHBondContact O-N 3.24Å; E540-M543 WeakPolarHBondContact O-CB 3.42Å; E540-M543 PolarHBondContact O-N 3.35Å |
| 541 | A | 30.1 | Very low | 33.3 | Very low | 96 Ų | 96 | 106 Ų | 106 | 79% | 0.793 | 56% | 0.56 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.7 | -13 | 168.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | T537 | T537-A541 WeakPolarHBondContact O-CB 3.45Å; T537-A541 PolarHBondContact O-N 2.94Å |
| 542 | R | 28.1 | Very low | 33.6 | Very low | 217 Ų | 217 | 105.2 Ų | 105.2 | 82% | 0.819 | 55% | 0.547 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -99.6 | -2.3 | 170.5 | -82.6 | -172.1 | -172.8 | -179.5 | 4.5 | 113.5 | Q539 E540 P544 | Q539-R542 CarbonylContact O-C 3.47Å; Q539-R542 PolarHBondContact O-N 3.46Å; E540-R542 PolarHBondContact O-N 3.24Å; R542-P544 VanDerWaalsContact O-CD 3.31Å; R542-P544 WeakPolarHBondContact O-CD 3.33Å |
| 543 | M | 28.9 | Very low | 34.9 | Very low | 106 Ų | 106 | 106.9 Ų | 106.9 | 52% | 0.522 | 55% | 0.552 | S | S | . | * | S | Bend | trans | -77.8 | 120.2 | 177.6 | -81.7 | -97.3 | -103.1 | 0 | 0 | 109.1 | Q539 E540 P547 | Q539-M543 VanDerWaalsContact O-CG 3.28Å; Q539-M543 WeakPolarHBondContact O-CG 3.44Å; Q539-M543 PolarHBondContact O-N 2.81Å; Q539-M543 VanDerWaalsContact O-N 3.07Å; E540-M543 WeakPolarHBondContact O-CB 3.42Å; E540-M543 PolarHBondContact O-N 3.35Å; M543-P547 HydrophobicContact CB-CG 4.06Å; M543-P547 HydrophobicContact CE-CB 3.83Å; M543-P547 HydrophobicContact CE-CG 4.26Å; M543-P547 HydrophobicContact CG-CG 4.43Å; M543-P547 HydrophobicContact SD-CB 3.67Å; M543-P547 HydrophobicContact SD-CG 3.5Å; M543-P547 VanDerWaalsContact SD-CG 3.5Å |
| 544 | P | 32.2 | Very low | 37 | Very low | 87 Ų | 87 | 107.4 Ų | 107.4 | 57% | 0.565 | 56% | 0.555 | S | S | * | * | trans | -59.9 | 163 | 174.8 | 17 | -24 | 0 | 0 | 0 | 111.3 | R542 K546 P547 | R542-P544 VanDerWaalsContact O-CD 3.31Å; R542-P544 WeakPolarHBondContact O-CD 3.33Å; P544-K546 PolarHBondContact O-N 2.9Å; P544-K546 VanDerWaalsContact O-N 3.08Å; P544-P547 HydrophobicContact CG-CG 4.09Å; P544-P547 WeakPolarHBondContact O-CD 3.48Å; P544-P547 WeakPolarHBondContact O-CG 3.42Å | ||
| 545 | Q | 36.7 | Very low | 39.4 | Very low | 155 Ų | 155 | 103.1 Ų | 103.1 | 72% | 0.724 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -55.8 | -28.1 | 176.2 | -75.2 | 175 | -25.5 | 0 | 0 | 113.2 | R548 E549 | Q545-R548 WeakPolarHBondContact O-CB 3.45Å; Q545-R548 PolarHBondContact O-N 3.46Å; Q545-R548 VanDerWaalsContact O-N 3.13Å; Q545-E549 PolarHBondContact O-N 3.44Å; Q545-E549 VanDerWaalsContact O-N 3.16Å |
| 546 | K | 30.9 | Very low | 41.8 | Very low | 152 Ų | 152 | 102.9 Ų | 102.9 | 66% | 0.661 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -54.5 | -48.2 | 179.3 | -103.5 | 176.1 | 175.9 | 170.7 | 0 | 115.7 | P544 R548 E549 K550 | P544-K546 PolarHBondContact O-N 2.9Å; P544-K546 VanDerWaalsContact O-N 3.08Å; K546-R548 VanDerWaalsContact C-N 3.34Å; K546-E549 PolarHBondContact O-N 2.91Å; K546-K550 WeakPolarHBondContact O-CG 3.47Å; K546-K550 PolarHBondContact O-N 3.37Å |
| 547 | P | 33.9 | Very low | 44 | Very low | 34 Ų | 34 | 97.8 Ų | 97.8 | 22% | 0.221 | 49% | 0.488 | C | S | . | . | H | α-helix | trans | -64.8 | -30.4 | 174.4 | 13 | -28.1 | 0 | 0 | 0 | 114.3 | M543 P544 K550 A551 | M543-P547 HydrophobicContact CB-CG 4.06Å; M543-P547 HydrophobicContact CE-CB 3.83Å; M543-P547 HydrophobicContact CE-CG 4.26Å; M543-P547 HydrophobicContact CG-CG 4.43Å; M543-P547 HydrophobicContact SD-CB 3.67Å; M543-P547 HydrophobicContact SD-CG 3.5Å; M543-P547 VanDerWaalsContact SD-CG 3.5Å; P544-P547 HydrophobicContact CG-CG 4.09Å; P544-P547 WeakPolarHBondContact O-CD 3.48Å; P544-P547 WeakPolarHBondContact O-CG 3.42Å; P547-K550 PolarHBondContact O-N 3.2Å; P547-A551 WeakPolarHBondContact O-CB 3.48Å; P547-A551 PolarHBondContact O-N 3.02Å |
| 548 | R | 36.6 | Very low | 46.2 | Very low | 217 Ų | 217 | 95.8 Ų | 95.8 | 82% | 0.819 | 48% | 0.476 | S | S | * | . | H | α-helix | trans | -67.9 | -40.7 | 175.5 | -161.7 | 174.9 | -178.7 | -178.7 | -1.7 | 111.5 | Q545 K546 A551 A552 | Q545-R548 WeakPolarHBondContact O-CB 3.45Å; Q545-R548 PolarHBondContact O-N 3.46Å; Q545-R548 VanDerWaalsContact O-N 3.13Å; K546-R548 VanDerWaalsContact C-N 3.34Å; R548-A551 PolarHBondContact O-N 3.08Å; R548-A552 PolarHBondContact O-N 3.37Å; R548-A552 VanDerWaalsContact O-N 3.16Å |
| 549 | E | 43 | Very low | 47.7 | Very low | 126 Ų | 126 | 100.2 Ų | 100.2 | 59% | 0.589 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -64.7 | -41 | 171.3 | -68.2 | 179.7 | 146.8 | 0 | 0 | 112.7 | Q545 K546 A551 A552 Q553 | Q545-E549 PolarHBondContact O-N 3.44Å; Q545-E549 VanDerWaalsContact O-N 3.16Å; K546-E549 PolarHBondContact O-N 2.91Å; E549-A551 VanDerWaalsContact C-N 3.3Å; E549-A551 PolarHBondContact O-N 2.88Å; E549-A552 PolarHBondContact O-N 3.44Å; E549-Q553 PolarHBondContact O-N 3Å |
| 550 | K | 44.4 | Very low | 49.3 | Very low | 140 Ų | 140 | 98.1 Ų | 98.1 | 61% | 0.609 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -62.9 | -35.4 | 174.5 | -78.7 | -179.4 | 176.8 | -177.2 | 0 | 112.5 | K546 P547 Q553 | K546-K550 WeakPolarHBondContact O-CG 3.47Å; K546-K550 PolarHBondContact O-N 3.37Å; P547-K550 PolarHBondContact O-N 3.2Å; K550-Q553 WeakPolarHBondContact O-CB 3.49Å; K550-Q553 PolarHBondContact O-N 3.43Å |
| 551 | A | 42.6 | Very low | 51 | Low | 26 Ų | 26 | 94.3 Ų | 94.3 | 22% | 0.215 | 46% | 0.464 | C | S | . | . | H | α-helix | trans | -70.5 | -39.1 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | P353 P547 R548 E549 Q553 V554 | P353-A551 HydrophobicContact CG-CB 3.79Å; P547-A551 WeakPolarHBondContact O-CB 3.48Å; P547-A551 PolarHBondContact O-N 3.02Å; R548-A551 PolarHBondContact O-N 3.08Å; E549-A551 VanDerWaalsContact C-N 3.3Å; E549-A551 PolarHBondContact O-N 2.88Å; A551-Q553 PolarHBondContact O-N 2.91Å; A551-V554 PolarHBondContact O-N 2.74Å |
| 552 | A | 51.1 | Low | 52.5 | Low | 50 Ų | 50 | 92.5 Ų | 92.5 | 41% | 0.413 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -65.6 | -27.2 | 169.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | R548 E549 V554 | R548-A552 PolarHBondContact O-N 3.37Å; R548-A552 VanDerWaalsContact O-N 3.16Å; E549-A552 PolarHBondContact O-N 3.44Å; A552-V554 VanDerWaalsContact C-N 3.29Å; A552-V554 PolarHBondContact O-N 3.1Å |
| 553 | Q | 62.4 | Low | 54 | Low | 112 Ų | 112 | 88.3 Ų | 88.3 | 52% | 0.523 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -66.9 | -26 | 179 | -150.3 | 168.9 | 20.9 | 0 | 0 | 113.4 | E549 K550 A551 Y555 R556 | E549-Q553 PolarHBondContact O-N 3Å; K550-Q553 WeakPolarHBondContact O-CB 3.49Å; K550-Q553 PolarHBondContact O-N 3.43Å; A551-Q553 PolarHBondContact O-N 2.91Å; Q553-Y555 VanDerWaalsContact C-N 3.3Å; Q553-Y555 PolarHBondContact O-N 3.48Å; Q553-R556 PolarHBondContact O-N 2.73Å |
| 554 | V | 75.5 | Confident | 55.6 | Low | 32 Ų | 32 | 88 Ų | 88 | 19% | 0.194 | 43% | 0.433 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -62.6 | -36.1 | -178.4 | 179.3 | 0 | 0 | 0 | 0 | 112.2 | R107 L352 A551 A552 | R107-V554 VanDerWaalsContact CB-O 3.31Å; R107-V554 WeakPolarHBondContact CB-O 3.1Å; L352-V554 HydrophobicContact CD1-CG1 4.16Å; L352-V554 HydrophobicContact CD2-CG2 4.17Å; A551-V554 PolarHBondContact O-N 2.74Å; A552-V554 VanDerWaalsContact C-N 3.29Å; A552-V554 PolarHBondContact O-N 3.1Å |
| 555 | Y | 80.4 | Confident | 56.9 | Low | 6 Ų | 6 | 84.8 Ų | 84.8 | 2% | 0.024 | 41% | 0.412 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -94 | -7.7 | -176.7 | -60.7 | -77 | 0 | 0 | 0 | 114.1 | S106 L108 P353 P355 P356 A359 R362 Q553 | S106-Y555 WeakPolarHBondContact O-CD1 3.37Å; L108-Y555 HydrophobicContact CD1-CE1 4.21Å; L108-Y555 HydrophobicContact CD2-CE1 3.8Å; L108-Y555 HydrophobicContact CG-CE1 3.82Å; P353-Y555 HydrophobicContact CG-CE2 4.15Å; P353-Y555 PolarHBondContact O-OH 3.04Å; P355-Y555 HydrophobicContact CB-CE1 3.96Å; P356-Y555 HydrophobicContact CG-CD2 4.3Å; P356-Y555 HydrophobicContact CG-CG 4.09Å; A359-Y555 HydrophobicContact CB-CD1 3.73Å; A359-Y555 HydrophobicContact CB-CE1 4.45Å; A359-Y555 HydrophobicContact CB-CG 4.32Å; R362-Y555 PolarHBondContact NH2-O 3.33Å; Q553-Y555 VanDerWaalsContact C-N 3.3Å; Q553-Y555 PolarHBondContact O-N 3.48Å |
| 556 | R | 75.9 | Confident | 58.1 | Low | 116 Ų | 116 | 82.7 Ų | 82.7 | 44% | 0.438 | 41% | 0.412 | S | S | . | . | P | Polyproline II helix | trans | -66.7 | 143.5 | 179.9 | -79.6 | -172 | 177.9 | 151.4 | 0.6 | 111.5 | R107 Q553 | R107-R556 PolarHBondContact NE-O 3.14Å; R107-R556 PolarHBondContact NH2-O 3.21Å; Q553-R556 PolarHBondContact O-N 2.73Å |
| 557 | L | 76.9 | Confident | 59.4 | Low | 7 Ų | 7 | 80.3 Ų | 80.3 | 4% | 0.037 | 41% | 0.414 | C | S | . | . | P | Polyproline II helix | trans | -65.7 | 161.8 | 175.6 | -80.7 | 155.6 | 0 | 0 | 0 | 112.2 | M104 I561 Q562 | M104-L557 HydrophobicContact CG-CD2 4.49Å; L557-I561 HydrophobicContact CD1-CG2 4.27Å; L557-I561 HydrophobicContact CD2-CG2 4.1Å; L557-Q562 HydrophobicContact CB-CG 3.9Å; L557-Q562 PolarHBondContact O-NE2 3.44Å |
| 558 | P | 72.9 | Confident | 60.9 | Low | 19 Ų | 19 | 81.2 Ų | 81.2 | 12% | 0.123 | 42% | 0.416 | C | S | . | . | P | Polyproline II helix | trans | -57 | 141 | 166.3 | -20.4 | 31.2 | 0 | 0 | 0 | 111.5 | P560 I561 Q562 | P558-P560 VanDerWaalsContact C-CD 3.4Å; P558-P560 HydrophobicContact CB-CG 4.38Å; P558-I561 HydrophobicContact CB-CD1 4.45Å; P558-I561 HydrophobicContact CG-CD1 4.14Å; P558-I561 PolarHBondContact O-N 3.48Å; P558-Q562 PolarHBondContact O-N 3.11Å |
| 559 | F | 61.3 | Low | 62.2 | Low | 161 Ų | 161 | 74.7 Ų | 74.7 | 71% | 0.706 | 40% | 0.402 | S | S | * | . | H | α-helix | trans | -43.1 | -46.1 | 179.7 | -78.8 | -78.1 | 0 | 0 | 0 | 115.9 | I561 Q562 | F559-I561 PolarHBondContact O-N 3.45Å; F559-Q562 PolarHBondContact O-N 3.43Å |
| 560 | P | 61.7 | Low | 63 | Low | 92 Ų | 92 | 76.8 Ų | 76.8 | 60% | 0.597 | 41% | 0.411 | S | S | * | . | H | α-helix | trans | -64.8 | -25.6 | -179.2 | 23.3 | -33.8 | 0 | 0 | 0 | 113.7 | P558 | P558-P560 VanDerWaalsContact C-CD 3.4Å; P558-P560 HydrophobicContact CB-CG 4.38Å |
| 561 | I | 65.4 | Low | 63.7 | Low | 30 Ų | 30 | 74.7 Ų | 74.7 | 15% | 0.154 | 41% | 0.412 | C | S | . | . | H | α-helix | trans | -89.2 | -28.3 | -178.3 | -58.5 | 169.8 | 0 | 0 | 0 | 111 | W103 M104 L557 P558 F559 N563 L564 C565 | W103-I561 HydrophobicContact CH2-CD1 3.92Å; W103-I561 HydrophobicContact CZ2-CD1 4Å; W103-I561 HydrophobicContact CZ3-CD1 4.48Å; M104-I561 HydrophobicContact CE-CD1 4.06Å; M104-I561 HydrophobicContact CE-CG2 4.47Å; M104-I561 HydrophobicContact CG-CD1 3.72Å; M104-I561 HydrophobicContact SD-CD1 3.69Å; L557-I561 HydrophobicContact CD1-CG2 4.27Å; L557-I561 HydrophobicContact CD2-CG2 4.1Å; P558-I561 HydrophobicContact CB-CD1 4.45Å; P558-I561 HydrophobicContact CG-CD1 4.14Å; P558-I561 PolarHBondContact O-N 3.48Å; F559-I561 PolarHBondContact O-N 3.45Å; I561-N563 PolarHBondContact O-N 2.91Å; I561-L564 WeakPolarHBondContact O-CB 3.29Å; I561-L564 PolarHBondContact O-N 3.09Å; I561-L564 VanDerWaalsContact O-N 3.07Å; I561-C565 PolarHBondContact O-N 3.39Å |
| 562 | Q | 61.5 | Low | 64.6 | Low | 58 Ų | 58 | 76.1 Ų | 76.1 | 27% | 0.271 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -58.7 | -38.4 | 174.2 | -68.3 | -177.5 | 19.5 | 0 | 0 | 111.7 | L557 P558 F559 L564 C565 | L557-Q562 HydrophobicContact CB-CG 3.9Å; L557-Q562 PolarHBondContact O-NE2 3.44Å; P558-Q562 PolarHBondContact O-N 3.11Å; F559-Q562 PolarHBondContact O-N 3.43Å; Q562-L564 PolarHBondContact O-N 2.59Å; Q562-C565 WeakPolarHBondContact O-CB 3.02Å; Q562-C565 PolarHBondContact O-N 3.18Å |
| 563 | N | 60.2 | Low | 65.3 | Low | 128 Ų | 128 | 80.1 Ų | 80.1 | 68% | 0.684 | 42% | 0.42 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -67.6 | -17.3 | 178.8 | -68 | -7 | 0 | 0 | 0 | 113.5 | I561 P566 | I561-N563 PolarHBondContact O-N 2.91Å; N563-P566 WeakPolarHBondContact O-CD 3.47Å |
| 564 | L | 61.3 | Low | 65.3 | Low | 101 Ų | 101 | 77.2 Ų | 77.2 | 53% | 0.529 | 41% | 0.412 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -90.8 | -19.4 | 177.7 | -73.6 | 156.4 | 0 | 0 | 0 | 112.6 | I561 Q562 P566 C567 I568 | I561-L564 WeakPolarHBondContact O-CB 3.29Å; I561-L564 PolarHBondContact O-N 3.09Å; I561-L564 VanDerWaalsContact O-N 3.07Å; Q562-L564 PolarHBondContact O-N 2.59Å; L564-P566 VanDerWaalsContact C-N 3.35Å; L564-C567 WeakPolarHBondContact O-CA 3.4Å; L564-C567 WeakPolarHBondContact O-CB 3.36Å; L564-C567 PolarHBondContact O-N 3.37Å; L564-I568 WeakPolarHBondContact O-CG1 3.46Å; L564-I568 PolarHBondContact O-N 3.1Å |
| 565 | C | 60.8 | Low | 64.9 | Low | 18 Ų | 18 | 76.9 Ų | 76.9 | 12% | 0.122 | 41% | 0.409 | C | S | . | . | G | 310 helix | trans | -53.7 | -37.6 | 179.3 | -82.8 | 0 | 0 | 0 | 0 | 115.3 | I561 Q562 C567 I568 C576 | I561-C565 PolarHBondContact O-N 3.39Å; Q562-C565 WeakPolarHBondContact O-CB 3.02Å; Q562-C565 PolarHBondContact O-N 3.18Å; C565-C567 PolarHBondContact O-N 2.88Å; C565-I568 PolarHBondContact O-N 3.25Å; C565-C576 VanDerWaalsContact CA-SG 3.55Å; C565-C576 HydrophobicContact CB-CB 3.72Å; C565-C576 WeakPolarHBondContact CB-SG 3.35Å; C565-C576 WeakPolarHBondContact SG-CB 3.39Å; C565-C576 CovalentContact SG-SG 2.05Å; C565-C576 PolarHBondContact SG-SG 3.44Å |
| 566 | P | 60.7 | Low | 64.3 | Low | 111 Ų | 111 | 77.1 Ų | 77.1 | 72% | 0.721 | 41% | 0.411 | S | S | * | . | G | 310 helix | trans | -67.6 | -22.7 | 175.4 | -15.9 | 29.5 | 0 | 0 | 0 | 113.3 | N563 L564 | N563-P566 WeakPolarHBondContact O-CD 3.47Å; L564-P566 VanDerWaalsContact C-N 3.35Å |
| 567 | C | 58.5 | Low | 63.5 | Low | 103 Ų | 103 | 74.2 Ų | 74.2 | 70% | 0.696 | 41% | 0.407 | S | S | * | . | G | 310 helix | trans | -92.5 | -2.4 | -177.3 | -56.6 | 0 | 0 | 0 | 0 | 113.1 | L564 C565 | L564-C567 WeakPolarHBondContact O-CA 3.4Å; L564-C567 WeakPolarHBondContact O-CB 3.36Å; L564-C567 PolarHBondContact O-N 3.37Å; C565-C567 PolarHBondContact O-N 2.88Å |
| 568 | I | 65.3 | Low | 62.5 | Low | 53 Ų | 53 | 79.8 Ų | 79.8 | 27% | 0.272 | 44% | 0.437 | S | S | . | . | S | Bend | trans | -78.8 | 132.2 | -179.5 | -69.3 | 177 | 0 | 0 | 0 | 109.5 | L564 C565 L572 | L564-I568 WeakPolarHBondContact O-CG1 3.46Å; L564-I568 PolarHBondContact O-N 3.1Å; C565-I568 PolarHBondContact O-N 3.25Å; I568-L572 HydrophobicContact CG2-CB 3.25Å; I568-L572 HydrophobicContact CG2-CD1 4.34Å; I568-L572 HydrophobicContact CG2-CG 4.42Å |
| 569 | P | 64.1 | Low | 61.1 | Low | 80 Ų | 80 | 83.4 Ų | 83.4 | 52% | 0.519 | 46% | 0.46 | S | S | . | . | trans | -60.5 | 146.3 | 179.9 | 23.6 | -32.9 | 0 | 0 | 0 | 111.5 | P571 L572 | P569-P571 VanDerWaalsContact C-N 3.33Å; P569-P571 HydrophobicContact CB-CG 4.47Å; P569-P571 WeakPolarHBondContact O-CD 3.26Å; P569-L572 HydrophobicContact CG-CD1 4.11Å; P569-L572 PolarHBondContact O-N 3.1Å | ||
| 570 | Q | 59.8 | Low | 59.8 | Low | 169 Ų | 169 | 84.3 Ų | 84.3 | 79% | 0.79 | 47% | 0.466 | S | S | * | . | G | 310 helix | trans | -40 | -43.5 | -176.2 | -72.6 | -175.3 | -14.4 | 0 | 0 | 116.5 | L572 R573 | Q570-L572 PolarHBondContact O-N 3Å; Q570-R573 WeakPolarHBondContact O-CB 3.31Å; Q570-R573 PolarHBondContact O-N 3.39Å |
| 571 | P | 58.4 | Low | 58.1 | Low | 97 Ų | 97 | 87.2 Ų | 87.2 | 63% | 0.63 | 48% | 0.477 | S | S | * | . | G | 310 helix | trans | -63.8 | -21.3 | 179.5 | 23.4 | -35.7 | 0 | 0 | 0 | 114.7 | P569 | P569-P571 VanDerWaalsContact C-N 3.33Å; P569-P571 HydrophobicContact CB-CG 4.47Å; P569-P571 WeakPolarHBondContact O-CD 3.26Å |
| 572 | L | 61.7 | Low | 56.3 | Low | 55 Ų | 55 | 92.6 Ų | 92.6 | 29% | 0.288 | 51% | 0.513 | S | S | . | . | G | 310 helix | trans | -101.1 | 0.3 | -177.5 | -67.8 | 178.2 | 0 | 0 | 0 | 113 | L189 I568 P569 Q570 C574 L575 | L189-L572 HydrophobicContact CB-CD2 3.91Å; L189-L572 HydrophobicContact CD1-CD2 4.37Å; L189-L572 HydrophobicContact CD2-CD2 3.76Å; L189-L572 HydrophobicContact CG-CD2 4.19Å; I568-L572 HydrophobicContact CG2-CB 3.25Å; I568-L572 HydrophobicContact CG2-CD1 4.34Å; I568-L572 HydrophobicContact CG2-CG 4.42Å; P569-L572 HydrophobicContact CG-CD1 4.11Å; P569-L572 PolarHBondContact O-N 3.1Å; Q570-L572 PolarHBondContact O-N 3Å; L572-C574 PolarHBondContact O-N 3.49Å; L572-L575 HydrophobicContact CB-CD1 4.45Å; L572-L575 HydrophobicContact CD2-CD1 4.17Å; L572-L575 WeakPolarHBondContact O-CB 3.45Å; L572-L575 WeakPolarHBondContact O-CG 3.34Å; L572-L575 PolarHBondContact O-N 3.05Å; L572-L575 VanDerWaalsContact O-N 3.14Å |
| 573 | R | 66.4 | Low | 54.7 | Low | 135 Ų | 135 | 92.3 Ų | 92.3 | 51% | 0.509 | 53% | 0.527 | S | S | . | . | G | 310 helix | trans | -63.8 | -22.4 | -177.6 | -156.1 | 174.8 | -174.7 | 178.2 | 0.8 | 112.9 | Q570 L575 C576 | Q570-R573 WeakPolarHBondContact O-CB 3.31Å; Q570-R573 PolarHBondContact O-N 3.39Å; R573-L575 PolarHBondContact O-N 3.29Å; R573-L575 VanDerWaalsContact O-N 3.08Å; R573-C576 PolarHBondContact O-N 3.12Å; R573-C576 VanDerWaalsContact O-N 3.15Å |
| 574 | C | 63.3 | Low | 53.2 | Low | 51 Ų | 51 | 94.3 Ų | 94.3 | 35% | 0.345 | 54% | 0.537 | S | S | . | . | G | 310 helix | trans | -61.4 | -12.5 | 174.2 | -64 | 0 | 0 | 0 | 0 | 114.4 | H358 L572 | H358-C574 VanDerWaalsContact CA-O 3.28Å; H358-C574 WeakPolarHBondContact CA-O 3.46Å; H358-C574 VanDerWaalsContact CB-O 3.3Å; H358-C574 WeakPolarHBondContact CB-O 3.04Å; L572-C574 PolarHBondContact O-N 3.49Å |
| 575 | L | 67.1 | Low | 51.8 | Low | 25 Ų | 25 | 98 Ų | 98 | 13% | 0.131 | 55% | 0.552 | C | S | . | * | G | 310 helix | trans | -89.3 | -15.9 | 178.6 | -58.3 | 171.7 | 0 | 0 | 0 | 113.4 | L189 R362 L572 R573 | L189-L575 HydrophobicContact CD2-CD1 3.66Å; R362-L575 HydrophobicContact CB-CD2 4.03Å; R362-L575 HydrophobicContact CG-CD2 4.45Å; R362-L575 PolarHBondContact NH1-O 2.72Å; L572-L575 HydrophobicContact CB-CD1 4.45Å; L572-L575 HydrophobicContact CD2-CD1 4.17Å; L572-L575 WeakPolarHBondContact O-CB 3.45Å; L572-L575 WeakPolarHBondContact O-CG 3.34Å; L572-L575 PolarHBondContact O-N 3.05Å; L572-L575 VanDerWaalsContact O-N 3.14Å; R573-L575 PolarHBondContact O-N 3.29Å; R573-L575 VanDerWaalsContact O-N 3.08Å |
| 576 | C | 66.3 | Low | 50.2 | Low | 11 Ų | 11 | 106.3 Ų | 106.3 | 7% | 0.074 | 59% | 0.589 | C | S | . | * | S | Bend | trans | -102.8 | 148.8 | -179 | -72.1 | 0 | 0 | 0 | 0 | 110.9 | C565 R573 L578 | C565-C576 VanDerWaalsContact CA-SG 3.55Å; C565-C576 HydrophobicContact CB-CB 3.72Å; C565-C576 WeakPolarHBondContact CB-SG 3.35Å; C565-C576 WeakPolarHBondContact SG-CB 3.39Å; C565-C576 CovalentContact SG-SG 2.05Å; C565-C576 PolarHBondContact SG-SG 3.44Å; R573-C576 PolarHBondContact O-N 3.12Å; R573-C576 VanDerWaalsContact O-N 3.15Å; C576-L578 PolarHBondContact O-N 3.39Å |
| 577 | P | 60.8 | Low | 48.6 | Very low | 54 Ų | 54 | 105.3 Ų | 105.3 | 35% | 0.351 | 60% | 0.599 | S | S | . | * | P | Polyproline II helix | trans | -59.8 | 129.3 | 164.9 | 26.4 | -31 | 0 | 0 | 0 | 108.4 | ||
| 578 | L | 54.8 | Low | 46.9 | Very low | 125 Ų | 125 | 103.5 Ų | 103.5 | 65% | 0.654 | 60% | 0.597 | S | S | * | * | P | Polyproline II helix | trans | -69.5 | 142.5 | 172.5 | -160.1 | 67.7 | 0 | 0 | 0 | 108.1 | C576 E580 | C576-L578 PolarHBondContact O-N 3.39Å; L578-E580 PolarHBondContact O-N 2.83Å |
| 579 | P | 42.8 | Very low | 45 | Very low | 94 Ų | 94 | 107 Ų | 107 | 61% | 0.61 | 63% | 0.626 | S | S | * | * | P | Polyproline II helix | trans | -56.7 | 128.1 | 169 | -17.8 | 29.8 | 0 | 0 | 0 | 108.4 | D581 | P579-D581 PolarHBondContact O-N 3.37Š|
| 580 | E | 34.8 | Very low | 43.1 | Very low | 181 Ų | 181 | 108.8 Ų | 108.8 | 85% | 0.846 | 64% | 0.641 | S | S | * | * | P | Polyproline II helix | trans | -64.1 | 127 | 163.7 | -70.4 | -178.8 | 155.6 | 0 | 0 | 106.7 | L578 P582 | L578-E580 PolarHBondContact O-N 2.83Å; E580-P582 WeakPolarHBondContact O-CD 3.47Å |
| 581 | D | 25.8 | Very low | 41.5 | Very low | 152 Ų | 152 | 109.4 Ų | 109.4 | 81% | 0.813 | 64% | 0.644 | S | S | * | * | P | Polyproline II helix | trans | -60.1 | 123.5 | 172.9 | -79.9 | -40.9 | 0 | 0 | 0 | 108.1 | P579 G583 | P579-D581 PolarHBondContact O-N 3.37Å; D581-G583 PolarHBondContact O-N 2.88Å |
| 582 | P | 27 | Very low | 40.2 | Very low | 143 Ų | 143 | 110.7 Ų | 110.7 | 93% | 0.929 | 65% | 0.652 | S | S | * | * | S | Bend | trans | -80.7 | 53.6 | -179.3 | 33.8 | -34.8 | 0 | 0 | 0 | 110.9 | E580 | E580-P582 WeakPolarHBondContact O-CD 3.47Š|
| 583 | G | 28.5 | Very low | 38.5 | Very low | 53 Ų | 53 | 117.7 Ų | 117.7 | 55% | 0.546 | 68% | 0.683 | S | S | . | * | trans | -146.8 | 62 | -171.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | D581 | D581-G583 PolarHBondContact O-N 2.88Š| ||
| 584 | D | 28.9 | Very low | 36.7 | Very low | 169 Ų | 169 | 120.3 Ų | 120.3 | 90% | 0.904 | 70% | 0.701 | S | S | * | * | S | Bend | trans | -156.7 | 32.8 | 154.8 | -86.2 | -32 | 0 | 0 | 0 | 110.2 | ||
| 585 | E | 31.8 | Very low | 35 | Very low | 179 Ų | 179 | 125.9 Ų | 125.9 | 84% | 0.836 | 72% | 0.724 | S | S | * | * | trans | -116.4 | 73.3 | 162.1 | -75.9 | -148.4 | 162 | 0 | 0 | 109.3 | ||||
| 586 | E | 27.8 | Very low | 33.1 | Very low | 193 Ų | 193 | 129.3 Ų | 129.3 | 90% | 0.902 | 76% | 0.757 | S | S | * | * | trans | -143.4 | 94.2 | 148.5 | -103.2 | -176.1 | -173 | 0 | 0 | 108.3 | G588 | E586-G588 VanDerWaalsContact C-N 3.32Å; E586-G588 PolarHBondContact O-N 3.48Å | ||
| 587 | G | 25.9 | Very low | 31.3 | Very low | 90 Ų | 90 | 135.2 Ų | 135.2 | 93% | 0.928 | 79% | 0.787 | S | S | * | * | trans | -68.9 | 93.3 | 159 | 0 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 588 | G | 23.1 | Very low | 29.6 | Very low | 65 Ų | 65 | 141.1 Ų | 141.1 | 67% | 0.67 | 82% | 0.815 | S | S | * | * | trans | -99.1 | 118 | 162.4 | 0 | 0 | 0 | 0 | 0 | 109.2 | E586 S590 | E586-G588 VanDerWaalsContact C-N 3.32Å; E586-G588 PolarHBondContact O-N 3.48Å; G588-S590 PolarHBondContact O-N 3.03Å | ||
| 589 | S | 26.8 | Very low | 28.4 | Very low | 125 Ų | 125 | 143 Ų | 143 | 87% | 0.874 | 83% | 0.825 | S | S | * | * | trans | -48.5 | 129.4 | 175 | 51.8 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 590 | S | 23.5 | Very low | 27.8 | Very low | 118 Ų | 118 | 144.7 Ų | 144.7 | 83% | 0.825 | 84% | 0.836 | S | S | * | * | trans | -135 | 106.5 | 153.2 | 50.4 | 0 | 0 | 0 | 0 | 110 | G588 | G588-S590 PolarHBondContact O-N 3.03Š| ||
| 591 | E | 25.4 | Very low | 27.3 | Very low | 183 Ų | 183 | 140 Ų | 140 | 86% | 0.855 | 84% | 0.835 | S | S | * | * | trans | -73.6 | 163.8 | 154.7 | -90.1 | -163.7 | 162 | 0 | 0 | 109.6 | ||||
| 592 | P | 32.7 | Very low | 27.3 | Very low | 124 Ų | 124 | 138.6 Ų | 138.6 | 81% | 0.805 | 84% | 0.838 | S | S | * | * | trans | -85.1 | 133.8 | -148.6 | 33.7 | -31.4 | 0 | 0 | 0 | 111.8 | ||||
| 593 | E | 26 | Very low | 27.3 | Very low | 201 Ų | 201 | 135.2 Ų | 135.2 | 94% | 0.939 | 83% | 0.829 | S | S | * | * | trans | -111 | 134.5 | 167.8 | -113.1 | -173.5 | 164.1 | 0 | 0 | 111.9 | ||||
| 594 | E | 28.3 | Very low | 27.3 | Very low | 190 Ų | 190 | 142 Ų | 142 | 89% | 0.888 | 85% | 0.847 | S | S | * | * | trans | -81.5 | 145.7 | -166.2 | -161.4 | 174.6 | -179.7 | 0 | 0 | 111.4 | ||||
| 595 | M | 27.2 | Very low | 27.3 | Very low | 168 Ų | 168 | 139.4 Ų | 139.4 | 83% | 0.828 | 84% | 0.839 | S | S | * | * | trans | -37.7 | 129.7 | 169.9 | -173.8 | 167.9 | 172.4 | 0 | 0 | 115.4 | ||||
| 596 | A | 28.1 | Very low | 26.9 | Very low | 98 Ų | 98 | 136.6 Ų | 136.6 | 81% | 0.81 | 84% | 0.838 | S | S | * | * | trans | -154 | 129.7 | 153.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 597 | D | 26.8 | Very low | 27.1 | Very low | 135 Ų | 135 | 133.6 Ų | 133.6 | 72% | 0.722 | 83% | 0.834 | S | S | * | * | trans | -65.3 | 152.8 | -174.9 | -62.7 | -60.6 | 0 | 0 | 0 | 115.9 | ||||
| 598 | L | 26.4 | Very low | 27 | Very low | 177 Ų | 177 | 138.4 Ų | 138.4 | 93% | 0.927 | 83% | 0.833 | S | S | * | * | trans | -147.1 | 105.6 | 145.5 | -77.2 | -178.7 | 0 | 0 | 0 | 111.4 | ||||
| 599 | L | 28.2 | Very low | 27.1 | Very low | 166 Ų | 166 | 140 Ų | 140 | 87% | 0.869 | 83% | 0.834 | S | S | * | * | trans | -106 | 144.4 | 151 | -78.9 | 170.2 | 0 | 0 | 0 | 108.1 | ||||
| 600 | P | 31.2 | Very low | 27.1 | Very low | 129 Ų | 129 | 139 Ų | 139 | 84% | 0.838 | 83% | 0.827 | S | S | * | * | trans | -84.9 | 142 | 177.6 | 34.5 | -31 | 0 | 0 | 0 | 111.2 | ||||
| 601 | G | 24.2 | Very low | 27.3 | Very low | 81 Ų | 81 | 143.3 Ų | 143.3 | 84% | 0.835 | 83% | 0.825 | S | S | * | * | trans | -87.3 | 177.8 | -164.4 | 0 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 602 | S | 25.3 | Very low | 27.5 | Very low | 123 Ų | 123 | 142.1 Ų | 142.1 | 86% | 0.86 | 82% | 0.82 | S | S | * | * | trans | -152.2 | 109.5 | 158.5 | 61.5 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 603 | G | 26.6 | Very low | 27.2 | Very low | 72 Ų | 72 | 139.5 Ų | 139.5 | 74% | 0.742 | 82% | 0.815 | S | S | * | * | trans | 65.5 | 102.6 | 131.6 | 0 | 0 | 0 | 0 | 0 | 121.8 | ||||
| 604 | E | 28.3 | Very low | 27.3 | Very low | 197 Ų | 197 | 139.7 Ų | 139.7 | 92% | 0.921 | 81% | 0.813 | S | S | * | * | trans | 84.6 | 150.5 | 132 | -75.5 | -169.4 | 132.7 | 0 | 0 | 122.4 | ||||
| 605 | P | 30.2 | Very low | 27.5 | Very low | 114 Ų | 114 | 140.9 Ų | 140.9 | 74% | 0.74 | 81% | 0.81 | S | S | * | * | trans | -119.5 | 166.1 | -135.9 | 39.3 | -25.2 | 0 | 0 | 0 | 117 | ||||
| 606 | C | 22.3 | Very low | 27.6 | Very low | 120 Ų | 120 | 137.6 Ų | 137.6 | 81% | 0.811 | 80% | 0.803 | S | S | * | * | trans | -4.1 | 156.3 | 162 | -65.3 | 0 | 0 | 0 | 0 | 121.3 | ||||
| 607 | P | 31.8 | Very low | 27.7 | Very low | 129 Ų | 129 | 141.5 Ų | 141.5 | 84% | 0.838 | 81% | 0.805 | S | S | * | * | -139.3 | 164.4 | 88.4 | 30.9 | -12 | 0 | 0 | 0 | 116.5 | |||||
| 608 | E | 24.8 | Very low | 28 | Very low | 191 Ų | 191 | 148.5 Ų | 148.5 | 89% | 0.893 | 83% | 0.829 | S | S | * | * | trans | -53.5 | 154.9 | 176.2 | -59.9 | 170.9 | 127.9 | 0 | 0 | 115.5 | ||||
| 609 | S | 25.8 | Very low | 28.1 | Very low | 100 Ų | 100 | 147.1 Ų | 147.1 | 70% | 0.699 | 82% | 0.824 | S | S | * | * | trans | 175.4 | 114.3 | 132.7 | 160.8 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 610 | S | 25.9 | Very low | 28.1 | Very low | 104 Ų | 104 | 146.1 Ų | 146.1 | 73% | 0.727 | 82% | 0.822 | S | S | * | * | 23.5 | 141 | 129.5 | 24.5 | 0 | 0 | 0 | 0 | 122.4 | |||||
| 611 | R | 28.1 | Very low | 28 | Very low | 207 Ų | 207 | 147.1 Ų | 147.1 | 78% | 0.781 | 82% | 0.821 | S | S | * | * | trans | 102.3 | 127.9 | 133.1 | -112.6 | -174.1 | 171 | 146.3 | 3.2 | 119.9 | ||||
| 612 | E | 29.4 | Very low | 28.2 | Very low | 159 Ų | 159 | 150.9 Ų | 150.9 | 74% | 0.743 | 82% | 0.82 | S | S | * | * | trans | 65.7 | 129.5 | 139.6 | -82.1 | 159.4 | -158.6 | 0 | 0 | 119.9 | ||||
| 613 | G | 26.7 | Very low | 28.4 | Very low | 69 Ų | 69 | 152.7 Ų | 152.7 | 71% | 0.711 | 82% | 0.817 | S | S | * | * | trans | -82.8 | 173.2 | 178.4 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 614 | F | 28.6 | Very low | 28.5 | Very low | 204 Ų | 204 | 158.1 Ų | 158.1 | 90% | 0.895 | 82% | 0.822 | S | S | * | * | trans | -164.1 | 152.1 | 140.7 | -130.6 | -95.9 | 0 | 0 | 0 | 111 | ||||
| 615 | R | 31.2 | Very low | 28.5 | Very low | 215 Ų | 215 | 155.3 Ų | 155.3 | 81% | 0.811 | 82% | 0.815 | S | S | * | * | trans | -47.3 | 156 | 171.1 | -91.3 | 168.5 | 167.4 | 176.3 | -2.6 | 116.6 | ||||
| 616 | S | 29.2 | Very low | 28.4 | Very low | 99 Ų | 99 | 158.5 Ų | 158.5 | 69% | 0.692 | 82% | 0.821 | S | S | * | * | trans | 85.7 | 129.2 | 133.4 | -86 | 0 | 0 | 0 | 0 | 122 | ||||
| 617 | Q | 31 | Very low | 28.9 | Very low | 180 Ų | 180 | 161.7 Ų | 161.7 | 84% | 0.841 | 82% | 0.822 | S | S | * | * | trans | 69.7 | 105.5 | 141 | -72.9 | 178 | -14.4 | 0 | 0 | 118.2 | ||||
| 618 | K | 34 | Very low | 28.6 | Very low | 283 Ų | 283 | 164.6 Ų | 164.6 | 100% | 1.23 | 82% | 0.82 | S | S | * | * | -160.2 | 0 | 88.6 | -114.4 | 175.4 | -179.4 | 176.4 | 0 | 111.6 |
Retrieved 618 of 618 residues in 147.6 ms
(Link to these results)