| 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 | 37.7 | Very low | 49.7 | Very low | 241 Ų | 241 | 152.1 Ų | 152.1 | 100% | 1.187 | 86% | 0.863 | S | S | * | * | 0 | 131 | 0 | -69.5 | -73.6 | 176.7 | 0 | 0 | 108.3 | |||||
| 2 | P | 55.5 | Low | 50.4 | Low | 123 Ų | 123 | 145.1 Ų | 145.1 | 80% | 0.799 | 85% | 0.849 | S | S | * | * | trans | -93.1 | 153.6 | -160 | 36.7 | -33.1 | 0 | 0 | 0 | 113 | ||||
| 3 | A | 43.3 | Very low | 51.3 | Low | 103 Ų | 103 | 148.9 Ų | 148.9 | 85% | 0.851 | 85% | 0.849 | S | S | * | * | trans | -173.6 | 107.7 | 139.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | G5 | A3-G5 PolarHBondContact O-N 3.2Š| ||
| 4 | K | 51.5 | Low | 52.2 | Low | 196 Ų | 196 | 146 Ų | 146 | 85% | 0.852 | 84% | 0.843 | S | S | * | * | trans | -68.5 | 100.2 | 169.4 | -173.6 | 159.5 | -174.1 | 163.1 | 0 | 109.3 | K6 | K4-K6 PolarHBondContact O-N 3.23Š| ||
| 5 | G | 47.2 | Very low | 52.9 | Low | 84 Ų | 84 | 148.8 Ų | 148.8 | 87% | 0.866 | 84% | 0.844 | S | S | * | * | trans | -74.7 | 102.2 | 172.9 | 0 | 0 | 0 | 0 | 0 | 111.4 | A3 | A3-G5 PolarHBondContact O-N 3.2Š| ||
| 6 | K | 54.7 | Low | 53.7 | Low | 183 Ų | 183 | 143.2 Ų | 143.2 | 80% | 0.796 | 83% | 0.83 | S | S | * | * | trans | -118.5 | 109 | 176.9 | -159 | -176.1 | -170.1 | -174 | 0 | 108.4 | K4 | K4-K6 PolarHBondContact O-N 3.23Š| ||
| 7 | K | 49 | Very low | 54.6 | Low | 218 Ų | 218 | 146.7 Ų | 146.7 | 95% | 0.948 | 83% | 0.833 | S | S | * | * | trans | 149.2 | 131.6 | 158.5 | -93.5 | 172 | 176.7 | 177.4 | 0 | 108.5 | ||||
| 8 | G | 48.5 | Very low | 55.6 | Low | 68 Ų | 68 | 149.6 Ų | 149.6 | 70% | 0.701 | 84% | 0.835 | S | S | * | * | cis | -158.1 | 146.1 | 0.9 | 0 | 0 | 0 | 0 | 0 | 108.8 | G10 | G8-G10 VanDerWaalsContact C-N 3.27Å; G8-G10 PolarHBondContact O-N 2.82Å | ||
| 9 | K | 50.8 | Low | 56.5 | Low | 205 Ų | 205 | 151.3 Ų | 151.3 | 89% | 0.891 | 84% | 0.835 | S | S | * | * | trans | -56.6 | 101.9 | 156.3 | -92.5 | 170.7 | 169.1 | 173.1 | 0 | 105.7 | Q11 | K9-Q11 PolarHBondContact O-N 2.89Š| ||
| 10 | G | 50.3 | Low | 57.3 | Low | 75 Ų | 75 | 153.9 Ų | 153.9 | 77% | 0.773 | 84% | 0.838 | S | S | * | * | trans | -59.9 | 93.4 | 157.8 | 0 | 0 | 0 | 0 | 0 | 105.5 | G8 G12 | G8-G10 VanDerWaalsContact C-N 3.27Å; G8-G10 PolarHBondContact O-N 2.82Å; G10-G12 PolarHBondContact O-N 2.82Å | ||
| 11 | Q | 58.6 | Low | 58.2 | Low | 177 Ų | 177 | 155.5 Ų | 155.5 | 83% | 0.827 | 84% | 0.837 | S | S | * | * | trans | -59.6 | 96.5 | 162.3 | -78.5 | 174.5 | -32.2 | 0 | 0 | 104.2 | K9 K13 | K9-Q11 PolarHBondContact O-N 2.89Å; Q11-K13 PolarHBondContact O-N 2.97Å | ||
| 12 | G | 58.4 | Low | 60.2 | Low | 68 Ų | 68 | 149.1 Ų | 149.1 | 70% | 0.701 | 81% | 0.813 | S | S | * | * | trans | -47.8 | 117.5 | 163.7 | 0 | 0 | 0 | 0 | 0 | 105 | G10 S14 | G10-G12 PolarHBondContact O-N 2.82Å; G12-S14 PolarHBondContact O-N 2.94Å | ||
| 13 | K | 61.7 | Low | 61.2 | Low | 195 Ų | 195 | 152.7 Ų | 152.7 | 85% | 0.848 | 82% | 0.819 | S | S | * | * | trans | -46.8 | 110.9 | 179.3 | -80.7 | 173.4 | 174.2 | 174.2 | 0 | 105.5 | Q11 H15 | Q11-K13 PolarHBondContact O-N 2.97Å; K13-H15 PolarHBondContact O-N 2.82Å | ||
| 14 | S | 63.1 | Low | 62.6 | Low | 108 Ų | 108 | 152.6 Ų | 152.6 | 76% | 0.755 | 81% | 0.808 | S | S | * | * | trans | -56.2 | 116.7 | 168.2 | 49.2 | 0 | 0 | 0 | 0 | 103.9 | G12 G16 | G12-S14 PolarHBondContact O-N 2.94Å; S14-G16 PolarHBondContact O-N 3.18Å | ||
| 15 | H | 63.4 | Low | 64.2 | Low | 188 Ų | 188 | 147.7 Ų | 147.7 | 87% | 0.87 | 79% | 0.791 | S | S | * | * | trans | -57.2 | 99.9 | 166.9 | -78.7 | -76.8 | 0 | 0 | 0 | 104.3 | K13 K17 | K13-H15 PolarHBondContact O-N 2.82Å; H15-K17 PolarHBondContact O-N 2.73Å | ||
| 16 | G | 65.3 | Low | 65.8 | Low | 59 Ų | 59 | 150 Ų | 150 | 61% | 0.608 | 78% | 0.782 | S | S | * | * | trans | -48 | 130 | 179.6 | 0 | 0 | 0 | 0 | 0 | 106.6 | S14 K18 | S14-G16 PolarHBondContact O-N 3.18Å; G16-K18 PolarHBondContact O-N 2.89Å | ||
| 17 | K | 69.3 | Low | 67.1 | Low | 203 Ų | 203 | 145.8 Ų | 145.8 | 88% | 0.883 | 77% | 0.768 | S | S | * | * | trans | -41.1 | 111.5 | -179.7 | -83.4 | 179.2 | 176.3 | 177.9 | 0 | 107.3 | H15 Q19 | H15-K17 PolarHBondContact O-N 2.73Å; K17-Q19 PolarHBondContact O-N 2.84Å | ||
| 18 | K | 72.3 | Confident | 69 | Low | 199 Ų | 199 | 136.7 Ų | 136.7 | 87% | 0.865 | 73% | 0.732 | S | S | * | * | trans | -50.5 | 114.9 | 171.9 | -105.4 | 178.1 | 179.6 | 172.5 | 0 | 104.5 | G16 K20 | G16-K18 PolarHBondContact O-N 2.89Å; K18-K20 PolarHBondContact O-N 2.85Å | ||
| 19 | Q | 72.9 | Confident | 71 | Confident | 181 Ų | 181 | 138.6 Ų | 138.6 | 85% | 0.846 | 73% | 0.732 | S | S | * | * | trans | -51.3 | 123.8 | 172.4 | -72 | 176.3 | -51.8 | 0 | 0 | 105.5 | K17 K21 | K17-Q19 PolarHBondContact O-N 2.84Å; Q19-K21 VanDerWaalsContact C-N 3.34Å; Q19-K21 PolarHBondContact O-N 3.05Å | ||
| 20 | K | 73.3 | Confident | 72.8 | Confident | 204 Ų | 204 | 131.9 Ų | 131.9 | 89% | 0.887 | 71% | 0.714 | S | S | * | * | trans | -57.6 | 108.9 | 173.2 | -76.5 | -175.2 | 177.1 | -175.8 | 0 | 104.7 | K18 | K18-K20 PolarHBondContact O-N 2.85Š| ||
| 21 | K | 76.1 | Confident | 74.7 | Confident | 188 Ų | 188 | 129.6 Ų | 129.6 | 82% | 0.817 | 69% | 0.688 | S | S | * | * | trans | -55.7 | 135.9 | 171.1 | -67.7 | -177.3 | 179.5 | -175.1 | 0 | 105.5 | Q19 E23 | Q19-K21 VanDerWaalsContact C-N 3.34Å; Q19-K21 PolarHBondContact O-N 3.05Å; K21-E23 PolarHBondContact O-N 3.26Å | ||
| 22 | P | 78.8 | Confident | 76.1 | Confident | 107 Ų | 107 | 124.4 Ų | 124.4 | 70% | 0.695 | 67% | 0.665 | S | S | * | * | trans | -51.7 | 135 | 170.6 | 21.8 | -30.2 | 0 | 0 | 0 | 107.4 | V24 | P22-V24 VanDerWaalsContact C-N 3.3Å; P22-V24 HydrophobicContact CG-CG2 4.31Å; P22-V24 WeakPolarHBondContact O-CG2 3.41Å; P22-V24 PolarHBondContact O-N 3.11Å | ||
| 23 | E | 76.3 | Confident | 77.6 | Confident | 197 Ų | 197 | 125.6 Ų | 125.6 | 92% | 0.921 | 65% | 0.654 | S | S | * | * | trans | -66.4 | 99 | 172 | -173.1 | 161.5 | -172.9 | 0 | 0 | 106.3 | K21 D25 | K21-E23 PolarHBondContact O-N 3.26Å; E23-D25 PolarHBondContact O-N 3.45Å | ||
| 24 | V | 73.7 | Confident | 78.9 | Confident | 102 Ų | 102 | 120.6 Ų | 120.6 | 62% | 0.618 | 64% | 0.637 | S | S | * | * | trans | -85.1 | 114 | -178.2 | -177.4 | 0 | 0 | 0 | 0 | 106.8 | P22 I26 | P22-V24 VanDerWaalsContact C-N 3.3Å; P22-V24 HydrophobicContact CG-CG2 4.31Å; P22-V24 WeakPolarHBondContact O-CG2 3.41Å; P22-V24 PolarHBondContact O-N 3.11Å; V24-I26 PolarHBondContact O-N 3.23Å; V24-I26 VanDerWaalsContact O-N 3.11Å | ||
| 25 | D | 84.6 | Confident | 80 | Confident | 92 Ų | 92 | 118.1 Ų | 118.1 | 49% | 0.492 | 62% | 0.615 | S | S | . | * | trans | -64.2 | 112.7 | 171.3 | 177.9 | 18.5 | 0 | 0 | 0 | 109.2 | E23 L27 S28 | E23-D25 PolarHBondContact O-N 3.45Å; D25-L27 PolarHBondContact O-N 2.8Å; D25-L27 VanDerWaalsContact O-N 3.14Å; D25-L27 WeakPolarHBondContact OD1-CA 3.44Å; D25-L27 WeakPolarHBondContact OD1-CB 3.45Å; D25-L27 PolarHBondContact OD1-N 3.14Å; D25-S28 VanDerWaalsContact O-CB 3.28Å; D25-S28 WeakPolarHBondContact O-CB 3.35Å; D25-S28 PolarHBondContact O-N 2.9Å; D25-S28 PolarHBondContact O-OG 3.32Å; D25-S28 PolarHBondContact OD2-N 3.02Å | ||
| 26 | I | 81.3 | Confident | 81.1 | Confident | 133 Ų | 133 | 116.4 Ų | 116.4 | 68% | 0.682 | 60% | 0.602 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -60 | -22.4 | 176 | -58.7 | 170.6 | 0 | 0 | 0 | 110 | V24 A31 | V24-I26 PolarHBondContact O-N 3.23Å; V24-I26 VanDerWaalsContact O-N 3.11Å; I26-A31 WeakPolarHBondContact O-CB 3.37Å |
| 27 | L | 82.4 | Confident | 82.4 | Confident | 94 Ų | 94 | 121.8 Ų | 121.8 | 49% | 0.492 | 61% | 0.605 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -91.6 | -2.3 | 177.8 | -45.6 | -171.5 | 0 | 0 | 0 | 115.1 | D25 R49 | D25-L27 PolarHBondContact O-N 2.8Å; D25-L27 VanDerWaalsContact O-N 3.14Å; D25-L27 WeakPolarHBondContact OD1-CA 3.44Å; D25-L27 WeakPolarHBondContact OD1-CB 3.45Å; D25-L27 PolarHBondContact OD1-N 3.14Å; L27-R49 HydrophobicContact CD2-CG 4.18Å; L27-R49 VanDerWaalsContact CD2-CZ 3.47Å; L27-R49 PolarHBondContact O-NH2 3.08Å |
| 28 | S | 88.6 | Confident | 83.4 | Confident | 27 Ų | 27 | 118.2 Ų | 118.2 | 19% | 0.189 | 59% | 0.594 | C | S | . | * | S | Bend | trans | -59.4 | 151 | 179.8 | 68.4 | 0 | 0 | 0 | 0 | 111.9 | D25 A30 A31 M32 | D25-S28 VanDerWaalsContact O-CB 3.28Å; D25-S28 WeakPolarHBondContact O-CB 3.35Å; D25-S28 PolarHBondContact O-N 2.9Å; D25-S28 PolarHBondContact O-OG 3.32Å; D25-S28 PolarHBondContact OD2-N 3.02Å; S28-A30 PolarHBondContact O-N 2.92Å; S28-A30 VanDerWaalsContact O-N 3.17Å; S28-A31 PolarHBondContact O-N 2.99Å; S28-A31 PolarHBondContact OG-N 3.41Å; S28-M32 PolarHBondContact O-N 3.38Å |
| 29 | P | 88.9 | Confident | 84.1 | Confident | 109 Ų | 109 | 109.9 Ų | 109.9 | 71% | 0.708 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -53.8 | -37.5 | 177.4 | -27.3 | 34.7 | 0 | 0 | 0 | 113.2 | M32 L33 | P29-M32 PolarHBondContact O-N 2.83Å; P29-L33 VanDerWaalsContact O-CB 3.25Å; P29-L33 WeakPolarHBondContact O-CB 3.37Å; P29-L33 PolarHBondContact O-N 3.49Å |
| 30 | A | 90.1 | Very high | 84.8 | Confident | 63 Ų | 63 | 111 Ų | 111 | 52% | 0.521 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -64.6 | -42.4 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | S28 L33 N34 | S28-A30 PolarHBondContact O-N 2.92Å; S28-A30 VanDerWaalsContact O-N 3.17Å; A30-L33 PolarHBondContact O-N 2.8Å; A30-N34 WeakPolarHBondContact O-CB 3.43Å; A30-N34 VanDerWaalsContact O-CG 3.23Å; A30-N34 PolarHBondContact O-N 3.01Å; A30-N34 PolarHBondContact O-ND2 3.41Å |
| 31 | A | 89 | Confident | 85.4 | Confident | 27 Ų | 27 | 104.7 Ų | 104.7 | 22% | 0.223 | 54% | 0.543 | C | S | . | . | H | α-helix | trans | -66.2 | -41.3 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | I26 S28 L33 N34 L35 | I26-A31 WeakPolarHBondContact O-CB 3.37Å; S28-A31 PolarHBondContact O-N 2.99Å; S28-A31 PolarHBondContact OG-N 3.41Å; A31-L33 VanDerWaalsContact C-N 3.34Å; A31-L33 PolarHBondContact O-N 3.03Å; A31-N34 PolarHBondContact O-N 3.17Å; A31-L35 WeakPolarHBondContact O-CB 3.49Å; A31-L35 PolarHBondContact O-N 3.39Å |
| 32 | M | 88.8 | Confident | 85.8 | Confident | 68 Ų | 68 | 97 Ų | 97 | 34% | 0.335 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -62.9 | -40.2 | 175.4 | -70.9 | -169.4 | 56.7 | 0 | 0 | 112.8 | S28 P29 L35 Y36 L46 R49 | S28-M32 PolarHBondContact O-N 3.38Å; P29-M32 PolarHBondContact O-N 2.83Å; M32-L35 WeakPolarHBondContact O-CB 3.29Å; M32-L35 PolarHBondContact O-N 3.22Å; M32-Y36 PolarHBondContact O-N 3.43Å; M32-L46 HydrophobicContact CE-CD2 4.21Å; M32-R49 PolarHBondContact SD-NH1 2.93Å; M32-R49 PolarHBondContact SD-NH2 3.02Å; M32-R49 VanDerWaalsContact SD-NH2 3.38Å |
| 33 | L | 90 | Very high | 86 | Confident | 93 Ų | 93 | 93.2 Ų | 93.2 | 49% | 0.487 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -68.2 | -43.9 | 179 | -174.8 | 139.4 | 0 | 0 | 0 | 110.9 | P29 A30 A31 L35 Y36 Y37 | P29-L33 VanDerWaalsContact O-CB 3.25Å; P29-L33 WeakPolarHBondContact O-CB 3.37Å; P29-L33 PolarHBondContact O-N 3.49Å; A30-L33 PolarHBondContact O-N 2.8Å; A31-L33 VanDerWaalsContact C-N 3.34Å; A31-L33 PolarHBondContact O-N 3.03Å; L33-L35 VanDerWaalsContact C-N 3.29Å; L33-L35 PolarHBondContact O-N 3.14Å; L33-Y36 WeakPolarHBondContact O-CB 3.43Å; L33-Y36 PolarHBondContact O-N 2.98Å; L33-Y36 VanDerWaalsContact O-N 3.14Å; L33-Y37 HydrophobicContact CD1-CE2 4.27Å; L33-Y37 HydrophobicContact CD2-CD2 3.68Å; L33-Y37 HydrophobicContact CD2-CE2 3.5Å; L33-Y37 VanDerWaalsContact CD2-CE2 3.5Å; L33-Y37 HydrophobicContact CG-CD2 3.96Å; L33-Y37 HydrophobicContact CG-CE2 3.59Å; L33-Y37 WeakPolarHBondContact O-CD2 3.28Å; L33-Y37 PolarHBondContact O-N 3.15Å; L33-Y37 VanDerWaalsContact O-N 3.11Å |
| 34 | N | 88.9 | Confident | 86.3 | Confident | 91 Ų | 91 | 87.9 Ų | 87.9 | 49% | 0.487 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -60.5 | -40.5 | 172.7 | -70 | -22.7 | 0 | 0 | 0 | 111.9 | A30 A31 Y36 Y37 I38 | A30-N34 WeakPolarHBondContact O-CB 3.43Å; A30-N34 VanDerWaalsContact O-CG 3.23Å; A30-N34 PolarHBondContact O-N 3.01Å; A30-N34 PolarHBondContact O-ND2 3.41Å; A31-N34 PolarHBondContact O-N 3.17Å; N34-Y36 VanDerWaalsContact C-N 3.33Å; N34-Y36 PolarHBondContact O-N 3Å; N34-Y37 PolarHBondContact O-N 3.38Å; N34-I38 HydrophobicContact CB-CD1 4.34Å; N34-I38 WeakPolarHBondContact O-CB 3.49Å; N34-I38 WeakPolarHBondContact O-CD1 3.46Å; N34-I38 VanDerWaalsContact O-CG1 3.24Å; N34-I38 WeakPolarHBondContact O-CG1 3.38Å; N34-I38 PolarHBondContact O-N 3.22Å |
| 35 | L | 86.8 | Confident | 86.7 | Confident | 55 Ų | 55 | 85.2 Ų | 85.2 | 29% | 0.288 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -59.6 | -44.3 | 174.1 | -178.3 | 69.3 | 0 | 0 | 0 | 111.2 | A31 M32 L33 Y37 I38 A39 C45 L46 | A31-L35 WeakPolarHBondContact O-CB 3.49Å; A31-L35 PolarHBondContact O-N 3.39Å; M32-L35 WeakPolarHBondContact O-CB 3.29Å; M32-L35 PolarHBondContact O-N 3.22Å; L33-L35 VanDerWaalsContact C-N 3.29Å; L33-L35 PolarHBondContact O-N 3.14Å; L35-Y37 VanDerWaalsContact C-N 3.28Å; L35-Y37 PolarHBondContact O-N 3Å; L35-I38 PolarHBondContact O-N 3.34Å; L35-A39 HydrophobicContact CD1-CB 4.19Å; L35-A39 WeakPolarHBondContact O-CB 3.38Å; L35-A39 PolarHBondContact O-N 2.87Å; L35-C45 HydrophobicContact CD1-CB 4Å; L35-C45 HydrophobicContact CD2-CB 4.07Å; L35-C45 HydrophobicContact CG-CB 4.27Å; L35-L46 HydrophobicContact CD2-CD2 4.48Å |
| 36 | Y | 86.6 | Confident | 86.6 | Confident | 152 Ų | 152 | 82.8 Ų | 82.8 | 60% | 0.596 | 44% | 0.44 | S | S | * | . | H | α-helix | trans | -59.2 | -39 | 178.1 | -171.7 | -84.7 | 0 | 0 | 0 | 112.4 | M32 L33 N34 V42 | M32-Y36 PolarHBondContact O-N 3.43Å; L33-Y36 WeakPolarHBondContact O-CB 3.43Å; L33-Y36 PolarHBondContact O-N 2.98Å; L33-Y36 VanDerWaalsContact O-N 3.14Å; N34-Y36 VanDerWaalsContact C-N 3.33Å; N34-Y36 PolarHBondContact O-N 3Å; Y36-V42 HydrophobicContact CD2-CB 4.47Å; Y36-V42 HydrophobicContact CD2-CG1 3.67Å; Y36-V42 HydrophobicContact CD2-CG2 4.25Å; Y36-V42 HydrophobicContact CE2-CG1 4.27Å; Y36-V42 HydrophobicContact CG-CG1 4.36Å; Y36-V42 HydrophobicContact CG-CG2 4.4Å; Y36-V42 VanDerWaalsContact O-CG2 3.28Å; Y36-V42 WeakPolarHBondContact O-CG2 3.49Å |
| 37 | Y | 90.9 | Very high | 86.7 | Confident | 173 Ų | 173 | 79.4 Ų | 79.4 | 68% | 0.678 | 42% | 0.421 | S | S | * | . | H | α-helix | trans | -84.4 | -26.8 | -177.4 | -72.1 | -63.5 | 0 | 0 | 0 | 114.5 | L33 N34 L35 | L33-Y37 HydrophobicContact CD1-CE2 4.27Å; L33-Y37 HydrophobicContact CD2-CD2 3.68Å; L33-Y37 HydrophobicContact CD2-CE2 3.5Å; L33-Y37 VanDerWaalsContact CD2-CE2 3.5Å; L33-Y37 HydrophobicContact CG-CD2 3.96Å; L33-Y37 HydrophobicContact CG-CE2 3.59Å; L33-Y37 WeakPolarHBondContact O-CD2 3.28Å; L33-Y37 PolarHBondContact O-N 3.15Å; L33-Y37 VanDerWaalsContact O-N 3.11Å; N34-Y37 PolarHBondContact O-N 3.38Å; L35-Y37 VanDerWaalsContact C-N 3.28Å; L35-Y37 PolarHBondContact O-N 3Å |
| 38 | I | 90.2 | Very high | 86.6 | Confident | 128 Ų | 128 | 82.5 Ų | 82.5 | 66% | 0.656 | 44% | 0.437 | S | S | * | . | H | α-helix | trans | -95.9 | -32 | -175.9 | -62.1 | 166.9 | 0 | 0 | 0 | 111.6 | N34 L35 | N34-I38 HydrophobicContact CB-CD1 4.34Å; N34-I38 WeakPolarHBondContact O-CB 3.49Å; N34-I38 WeakPolarHBondContact O-CD1 3.46Å; N34-I38 VanDerWaalsContact O-CG1 3.24Å; N34-I38 WeakPolarHBondContact O-CG1 3.38Å; N34-I38 PolarHBondContact O-N 3.22Å; L35-I38 PolarHBondContact O-N 3.34Å |
| 39 | A | 87.1 | Confident | 86.2 | Confident | 24 Ų | 24 | 83.9 Ų | 83.9 | 20% | 0.198 | 44% | 0.438 | C | S | . | . | trans | -75.4 | 132.3 | -174.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | L35 N41 V42 | L35-A39 HydrophobicContact CD1-CB 4.19Å; L35-A39 WeakPolarHBondContact O-CB 3.38Å; L35-A39 PolarHBondContact O-N 2.87Å; A39-N41 VanDerWaalsContact C-N 3.29Å; A39-V42 HydrophobicContact CB-CG2 4.15Å | ||
| 40 | H | 88.7 | Confident | 85.8 | Confident | 203 Ų | 203 | 81.3 Ų | 81.3 | 94% | 0.94 | 43% | 0.431 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -74.6 | -23 | 174 | -68.9 | 64.8 | 0 | 0 | 0 | 112.1 | ||
| 41 | N | 85.4 | Confident | 85.3 | Confident | 72 Ų | 72 | 83.2 Ų | 83.2 | 39% | 0.385 | 43% | 0.428 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -134.1 | 83.1 | 170.2 | -171.1 | -7.2 | 0 | 0 | 0 | 110.1 | A39 A43 D44 C45 | A39-N41 VanDerWaalsContact C-N 3.29Å; N41-A43 PolarHBondContact O-N 3.1Å; N41-A43 WeakPolarHBondContact OD1-CB 3.41Å; N41-A43 PolarHBondContact OD1-N 3.03Å; N41-D44 HydrophobicContact CB-CB 4.37Å; N41-D44 PolarHBondContact ND2-OD2 3.26Å; N41-D44 PolarHBondContact O-N 2.9Å; N41-D44 PolarHBondContact OD1-N 2.91Å; N41-C45 PolarHBondContact O-N 3.15Å; N41-C45 PolarHBondContact O-SG 3.39Å |
| 42 | V | 83.9 | Confident | 84.7 | Confident | 27 Ų | 27 | 88.6 Ų | 88.6 | 16% | 0.164 | 45% | 0.448 | C | S | . | . | H | α-helix | trans | -57.4 | -35.6 | 178.7 | -178.6 | 0 | 0 | 0 | 0 | 111.5 | Y36 A39 C45 L46 | Y36-V42 HydrophobicContact CD2-CB 4.47Å; Y36-V42 HydrophobicContact CD2-CG1 3.67Å; Y36-V42 HydrophobicContact CD2-CG2 4.25Å; Y36-V42 HydrophobicContact CE2-CG1 4.27Å; Y36-V42 HydrophobicContact CG-CG1 4.36Å; Y36-V42 HydrophobicContact CG-CG2 4.4Å; Y36-V42 VanDerWaalsContact O-CG2 3.28Å; Y36-V42 WeakPolarHBondContact O-CG2 3.49Å; A39-V42 HydrophobicContact CB-CG2 4.15Å; V42-C45 PolarHBondContact O-N 2.91Å; V42-L46 HydrophobicContact CG1-CD1 3.9Å; V42-L46 HydrophobicContact CG1-CG 4.26Å; V42-L46 VanDerWaalsContact O-CG 3.27Å; V42-L46 WeakPolarHBondContact O-CG 3.24Å; V42-L46 PolarHBondContact O-N 2.99Å |
| 43 | A | 83.6 | Confident | 84.1 | Confident | 28 Ų | 28 | 88.7 Ų | 88.7 | 23% | 0.231 | 45% | 0.445 | C | S | . | . | H | α-helix | trans | -58.7 | -63.1 | -179.7 | 0 | 0 | 0 | 0 | 0 | 109 | N41 C45 L46 H47 W53 | N41-A43 PolarHBondContact O-N 3.1Å; N41-A43 WeakPolarHBondContact OD1-CB 3.41Å; N41-A43 PolarHBondContact OD1-N 3.03Å; A43-C45 PolarHBondContact O-N 3.43Å; A43-C45 VanDerWaalsContact O-N 3.15Å; A43-L46 WeakPolarHBondContact O-CA 3.1Å; A43-L46 WeakPolarHBondContact O-CB 3.48Å; A43-L46 PolarHBondContact O-N 3.15Å; A43-H47 PolarHBondContact O-N 3.45Å; A43-H47 VanDerWaalsContact O-N 3.1Å; A43-W53 VanDerWaalsContact C-CH2 3.41Å; A43-W53 HydrophobicContact CB-CD2 3.64Å; A43-W53 HydrophobicContact CB-CE3 3.59Å; A43-W53 HydrophobicContact CB-CG 4.46Å; A43-W53 HydrophobicContact CB-CH2 3.52Å; A43-W53 HydrophobicContact CB-CZ2 3.54Å; A43-W53 HydrophobicContact CB-CZ3 3.57Å; A43-W53 WeakPolarHBondContact O-CZ3 3.33Å |
| 44 | D | 82.1 | Confident | 83.3 | Confident | 84 Ų | 84 | 90.5 Ų | 90.5 | 45% | 0.449 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -53.1 | -42.1 | -178.6 | -78.7 | -9.8 | 0 | 0 | 0 | 112.1 | N41 L46 H47 L48 W53 | N41-D44 HydrophobicContact CB-CB 4.37Å; N41-D44 PolarHBondContact ND2-OD2 3.26Å; N41-D44 PolarHBondContact O-N 2.9Å; N41-D44 PolarHBondContact OD1-N 2.91Å; D44-L46 VanDerWaalsContact C-N 3.31Å; D44-L46 PolarHBondContact O-N 3.49Å; D44-H47 PolarHBondContact O-N 3.44Å; D44-H47 VanDerWaalsContact O-N 3.15Å; D44-L48 WeakPolarHBondContact O-CG 2.78Å; D44-L48 PolarHBondContact O-N 3.21Å; D44-W53 VanDerWaalsContact N-CZ3 3.31Å; D44-W53 VanDerWaalsContact OD1-CH2 3.29Å; D44-W53 WeakPolarHBondContact OD1-CH2 3.25Å |
| 45 | C | 82.6 | Confident | 82.5 | Confident | 46 Ų | 46 | 89.8 Ų | 89.8 | 31% | 0.311 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -60.2 | -38.2 | 177.1 | -69.2 | 0 | 0 | 0 | 0 | 113.2 | L35 N41 V42 A43 R49 | L35-C45 HydrophobicContact CD1-CB 4Å; L35-C45 HydrophobicContact CD2-CB 4.07Å; L35-C45 HydrophobicContact CG-CB 4.27Å; N41-C45 PolarHBondContact O-N 3.15Å; N41-C45 PolarHBondContact O-SG 3.39Å; V42-C45 PolarHBondContact O-N 2.91Å; A43-C45 PolarHBondContact O-N 3.43Å; A43-C45 VanDerWaalsContact O-N 3.15Å; C45-R49 WeakPolarHBondContact O-CB 3.29Å; C45-R49 PolarHBondContact O-N 3.41Å |
| 46 | L | 83.4 | Confident | 81.8 | Confident | 42 Ų | 42 | 88.1 Ų | 88.1 | 22% | 0.22 | 47% | 0.471 | C | S | . | . | H | α-helix | trans | -69.5 | -36.1 | 175.6 | -71.5 | 172.5 | 0 | 0 | 0 | 111.8 | M32 L35 V42 A43 D44 R49 G50 F51 | M32-L46 HydrophobicContact CE-CD2 4.21Å; L35-L46 HydrophobicContact CD2-CD2 4.48Å; V42-L46 HydrophobicContact CG1-CD1 3.9Å; V42-L46 HydrophobicContact CG1-CG 4.26Å; V42-L46 VanDerWaalsContact O-CG 3.27Å; V42-L46 WeakPolarHBondContact O-CG 3.24Å; V42-L46 PolarHBondContact O-N 2.99Å; A43-L46 WeakPolarHBondContact O-CA 3.1Å; A43-L46 WeakPolarHBondContact O-CB 3.48Å; A43-L46 PolarHBondContact O-N 3.15Å; D44-L46 VanDerWaalsContact C-N 3.31Å; D44-L46 PolarHBondContact O-N 3.49Å; L46-R49 CarbonylContact O-C 3.32Å; L46-R49 WeakPolarHBondContact O-CA 3.27Å; L46-R49 WeakPolarHBondContact O-CB 3.39Å; L46-R49 PolarHBondContact O-N 3.43Å; L46-R49 VanDerWaalsContact O-N 3.14Å; L46-G50 PolarHBondContact O-N 3.45Å; L46-F51 CarbonylContact C-O 3.45Å; L46-F51 HydrophobicContact CB-CB 4.11Å; L46-F51 WeakPolarHBondContact O-CA 3.24Å; L46-F51 WeakPolarHBondContact O-CB 3.35Å; L46-F51 PolarHBondContact O-N 2.96Å |
| 47 | H | 83.4 | Confident | 81 | Confident | 62 Ų | 62 | 85.9 Ų | 85.9 | 29% | 0.287 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -73.8 | -36.9 | -179.4 | -166.3 | 118.7 | 0 | 0 | 0 | 113 | A43 D44 R49 G50 F51 H52 W53 | A43-H47 PolarHBondContact O-N 3.45Å; A43-H47 VanDerWaalsContact O-N 3.1Å; D44-H47 PolarHBondContact O-N 3.44Å; D44-H47 VanDerWaalsContact O-N 3.15Å; H47-R49 PolarHBondContact O-N 3.26Å; H47-G50 PolarHBondContact O-N 3.28Å; H47-F51 VanDerWaalsContact CA-O 3.29Å; H47-F51 WeakPolarHBondContact CA-O 3.09Å; H47-F51 PolarHBondContact N-O 3.37Å; H47-H52 AromaticContact CD2-ND1 3.91Å; H47-H52 AromaticContact CE1-CE1 3.59Å; H47-H52 AromaticContact CE1-ND1 3Å; H47-H52 PolarHBondContact CE1-ND1 3.29Å; H47-H52 AromaticContact CG-ND1 3.79Å; H47-H52 AromaticContact ND1-ND1 3.22Å; H47-H52 PolarHBondContact ND1-ND1 3.11Å; H47-H52 AromaticContact NE2-CE1 3.53Å; H47-H52 AromaticContact NE2-ND1 3.41Å; H47-H52 PolarHBondContact NE2-ND1 2.71Å; H47-W53 HydrophobicContact CB-CE3 3.92Å; H47-W53 HydrophobicContact CB-CH2 4.29Å; H47-W53 HydrophobicContact CB-CZ3 3.35Å; H47-W53 AromaticContact ND1-CZ3 3.95Å |
| 48 | L | 80.6 | Confident | 79.9 | Confident | 158 Ų | 158 | 87.6 Ų | 87.6 | 83% | 0.827 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -60.8 | -23.8 | 168.9 | -68.7 | 173.3 | 0 | 0 | 0 | 112.5 | D44 | D44-L48 WeakPolarHBondContact O-CG 2.78Å; D44-L48 PolarHBondContact O-N 3.21Å |
| 49 | R | 78.8 | Confident | 78.6 | Confident | 57 Ų | 57 | 84.1 Ų | 84.1 | 22% | 0.215 | 48% | 0.482 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -91.4 | 1.2 | 176.5 | -170.5 | 170.5 | 165.5 | -108.7 | -11 | 113.3 | L27 M32 C45 L46 H47 F51 | L27-R49 HydrophobicContact CD2-CG 4.18Å; L27-R49 VanDerWaalsContact CD2-CZ 3.47Å; L27-R49 PolarHBondContact O-NH2 3.08Å; M32-R49 PolarHBondContact SD-NH1 2.93Å; M32-R49 PolarHBondContact SD-NH2 3.02Å; M32-R49 VanDerWaalsContact SD-NH2 3.38Å; C45-R49 WeakPolarHBondContact O-CB 3.29Å; C45-R49 PolarHBondContact O-N 3.41Å; L46-R49 CarbonylContact O-C 3.32Å; L46-R49 WeakPolarHBondContact O-CA 3.27Å; L46-R49 WeakPolarHBondContact O-CB 3.39Å; L46-R49 PolarHBondContact O-N 3.43Å; L46-R49 VanDerWaalsContact O-N 3.14Å; H47-R49 PolarHBondContact O-N 3.26Å; R49-F51 HydrophobicContact CB-CD2 4.34Å; R49-F51 HydrophobicContact CG-CD2 4.11Å; R49-F51 HydrophobicContact CG-CE2 4.15Å |
| 50 | G | 81.8 | Confident | 77.4 | Confident | 54 Ų | 54 | 92.7 Ų | 92.7 | 56% | 0.557 | 52% | 0.515 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 91.6 | 4.6 | 177.8 | 0 | 0 | 0 | 0 | 0 | 115.2 | L46 H47 | L46-G50 PolarHBondContact O-N 3.45Å; H47-G50 PolarHBondContact O-N 3.28Å |
| 51 | F | 78.2 | Confident | 75.8 | Confident | 103 Ų | 103 | 93.2 Ų | 93.2 | 45% | 0.452 | 51% | 0.514 | S | S | . | . | trans | -95.1 | 105.9 | 174.6 | -66.7 | -86.7 | 0 | 0 | 0 | 110.2 | L46 H47 R49 | L46-F51 CarbonylContact C-O 3.45Å; L46-F51 HydrophobicContact CB-CB 4.11Å; L46-F51 WeakPolarHBondContact O-CA 3.24Å; L46-F51 WeakPolarHBondContact O-CB 3.35Å; L46-F51 PolarHBondContact O-N 2.96Å; H47-F51 VanDerWaalsContact CA-O 3.29Å; H47-F51 WeakPolarHBondContact CA-O 3.09Å; H47-F51 PolarHBondContact N-O 3.37Å; R49-F51 HydrophobicContact CB-CD2 4.34Å; R49-F51 HydrophobicContact CG-CD2 4.11Å; R49-F51 HydrophobicContact CG-CE2 4.15Å | ||
| 52 | H | 77.6 | Confident | 74.5 | Confident | 141 Ų | 141 | 93 Ų | 93 | 65% | 0.653 | 53% | 0.529 | S | S | * | . | P | Polyproline II helix | trans | -79.7 | 128.7 | 174.6 | -61.1 | -55.5 | 0 | 0 | 0 | 110.4 | H47 | H47-H52 AromaticContact CD2-ND1 3.91Å; H47-H52 AromaticContact CE1-CE1 3.59Å; H47-H52 AromaticContact CE1-ND1 3Å; H47-H52 PolarHBondContact CE1-ND1 3.29Å; H47-H52 AromaticContact CG-ND1 3.79Å; H47-H52 AromaticContact ND1-ND1 3.22Å; H47-H52 PolarHBondContact ND1-ND1 3.11Å; H47-H52 AromaticContact NE2-CE1 3.53Å; H47-H52 AromaticContact NE2-ND1 3.41Å; H47-H52 PolarHBondContact NE2-ND1 2.71Å |
| 53 | W | 75.9 | Confident | 72.6 | Confident | 69 Ų | 69 | 103.4 Ų | 103.4 | 26% | 0.261 | 57% | 0.566 | S | S | . | * | P | Polyproline II helix | trans | -92.5 | 147.2 | 172.2 | 71.2 | 83.3 | 0 | 0 | 0 | 110.9 | A43 D44 H47 G55 A56 | A43-W53 VanDerWaalsContact C-CH2 3.41Å; A43-W53 HydrophobicContact CB-CD2 3.64Å; A43-W53 HydrophobicContact CB-CE3 3.59Å; A43-W53 HydrophobicContact CB-CG 4.46Å; A43-W53 HydrophobicContact CB-CH2 3.52Å; A43-W53 HydrophobicContact CB-CZ2 3.54Å; A43-W53 HydrophobicContact CB-CZ3 3.57Å; A43-W53 WeakPolarHBondContact O-CZ3 3.33Å; D44-W53 VanDerWaalsContact N-CZ3 3.31Å; D44-W53 VanDerWaalsContact OD1-CH2 3.29Å; D44-W53 WeakPolarHBondContact OD1-CH2 3.25Å; H47-W53 HydrophobicContact CB-CE3 3.92Å; H47-W53 HydrophobicContact CB-CH2 4.29Å; H47-W53 HydrophobicContact CB-CZ3 3.35Å; H47-W53 AromaticContact ND1-CZ3 3.95Å; W53-G55 PolarHBondContact O-N 3.14Å; W53-A56 HydrophobicContact CD2-CB 3.83Å; W53-A56 HydrophobicContact CE3-CB 4.39Å; W53-A56 HydrophobicContact CG-CB 4.11Å; W53-A56 HydrophobicContact CZ2-CB 4.03Å; W53-A56 VanDerWaalsContact O-CB 3.24Å; W53-A56 WeakPolarHBondContact O-CB 3.28Å; W53-A56 PolarHBondContact O-N 2.94Å |
| 54 | P | 71.9 | Confident | 70.8 | Confident | 131 Ų | 131 | 107.6 Ų | 107.6 | 85% | 0.851 | 59% | 0.593 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.2 | 125.1 | 179.1 | 24.2 | -32.3 | 0 | 0 | 0 | 110.3 | ||
| 55 | G | 73.1 | Confident | 68.7 | Low | 77 Ų | 77 | 116.9 Ų | 116.9 | 79% | 0.794 | 63% | 0.629 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 91.2 | 1.4 | -174.1 | 0 | 0 | 0 | 0 | 0 | 114.7 | W53 | W53-G55 PolarHBondContact O-N 3.14Š|
| 56 | A | 71.3 | Confident | 68 | Low | 19 Ų | 19 | 120.4 Ų | 120.4 | 16% | 0.157 | 65% | 0.645 | C | S | . | * | trans | -55.3 | 132.6 | 169.8 | 0 | 0 | 0 | 0 | 0 | 109.8 | W53 K58 | W53-A56 HydrophobicContact CD2-CB 3.83Å; W53-A56 HydrophobicContact CE3-CB 4.39Å; W53-A56 HydrophobicContact CG-CB 4.11Å; W53-A56 HydrophobicContact CZ2-CB 4.03Å; W53-A56 VanDerWaalsContact O-CB 3.24Å; W53-A56 WeakPolarHBondContact O-CB 3.28Å; W53-A56 PolarHBondContact O-N 2.94Å; A56-K58 PolarHBondContact O-N 3.48Å; A56-K58 VanDerWaalsContact O-N 3.08Å | ||
| 57 | P | 71 | Confident | 67.2 | Low | 105 Ų | 105 | 124.5 Ų | 124.5 | 68% | 0.682 | 67% | 0.668 | S | S | * | * | trans | -57 | 122.1 | 174 | 21.3 | -28.8 | 0 | 0 | 0 | 107.6 | G59 | P57-G59 VanDerWaalsContact C-N 3.35Å; P57-G59 PolarHBondContact O-N 3.4Å | ||
| 58 | K | 67.3 | Low | 66.3 | Low | 209 Ų | 209 | 128 Ų | 128 | 91% | 0.909 | 69% | 0.689 | S | S | * | * | trans | -59.1 | 102.5 | 176 | -77.9 | -173.2 | 177.6 | 175.2 | 0 | 107 | A56 K60 | A56-K58 PolarHBondContact O-N 3.48Å; A56-K58 VanDerWaalsContact O-N 3.08Å; K58-K60 PolarHBondContact O-N 3.35Å | ||
| 59 | G | 63.7 | Low | 65.5 | Low | 56 Ų | 56 | 126.2 Ų | 126.2 | 58% | 0.577 | 68% | 0.681 | S | S | * | * | trans | -51.3 | 142.9 | 174.9 | 0 | 0 | 0 | 0 | 0 | 109.3 | P57 K61 | P57-G59 VanDerWaalsContact C-N 3.35Å; P57-G59 PolarHBondContact O-N 3.4Å; G59-K61 PolarHBondContact O-N 3.29Å | ||
| 60 | K | 61.1 | Low | 64.7 | Low | 204 Ų | 204 | 130.6 Ų | 130.6 | 89% | 0.887 | 71% | 0.71 | S | S | * | * | trans | -58.2 | 103.2 | 173.9 | -80.4 | -176.4 | 178.8 | 179.5 | 0 | 108.3 | K58 G62 | K58-K60 PolarHBondContact O-N 3.35Å; K60-G62 PolarHBondContact O-N 3.25Å | ||
| 61 | K | 55.1 | Low | 63.5 | Low | 214 Ų | 214 | 135.7 Ų | 135.7 | 93% | 0.93 | 72% | 0.72 | S | S | * | * | S | Bend | trans | -65.6 | 104.9 | 174.5 | -166.6 | 173.4 | -175.3 | 177.6 | 0 | 107.5 | G59 | G59-K61 PolarHBondContact O-N 3.29Š|
| 62 | G | 58 | Low | 62.5 | Low | 68 Ų | 68 | 138 Ų | 138 | 70% | 0.701 | 74% | 0.739 | S | S | * | * | trans | 91.7 | 101 | 173 | 0 | 0 | 0 | 0 | 0 | 114.6 | K60 | K60-G62 PolarHBondContact O-N 3.25Š| ||
| 63 | R | 44.9 | Very low | 61.3 | Low | 245 Ų | 245 | 137.8 Ų | 137.8 | 93% | 0.925 | 75% | 0.746 | S | S | * | * | trans | -132.8 | 89.2 | 136 | -155.3 | 163 | -172 | 168.2 | 1.5 | 107.1 | ||||
| 64 | S | 44.6 | Very low | 60.1 | Low | 116 Ų | 116 | 143.5 Ų | 143.5 | 81% | 0.811 | 79% | 0.786 | S | S | * | * | trans | -59.2 | 135.5 | 158.4 | 62.8 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 65 | K | 39.4 | Very low | 59 | Low | 278 Ų | 278 | 144.6 Ų | 144.6 | 100% | 1.209 | 78% | 0.78 | S | S | * | * | trans | -134 | 0 | 147.8 | -163.9 | 170.4 | -174 | 175 | 0 | 107.2 |
Retrieved 65 of 65 residues in 295.8 ms
(Link to these results)