| 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 | P | 49.9 | Very low | 49.4 | Very low | 150 Ų | 150 | 118.5 Ų | 118.5 | 97% | 0.974 | 61% | 0.61 | S | S | * | * | 0 | -50.2 | 0 | -7.6 | 26.9 | 0 | 0 | 0 | 114.2 | |||||
| 2 | I | 54 | Low | 49.3 | Very low | 161 Ų | 161 | 120.9 Ų | 120.9 | 83% | 0.826 | 62% | 0.62 | S | S | * | * | trans | -82.4 | -28.6 | -177.2 | -69.2 | 160.4 | 0 | 0 | 0 | 113.3 | ||||
| 3 | L | 47.4 | Very low | 49.4 | Very low | 116 Ų | 116 | 122.8 Ų | 122.8 | 61% | 0.607 | 62% | 0.621 | S | S | * | * | S | Bend | trans | -92.6 | 5.7 | 176.5 | -71.6 | 169.4 | 0 | 0 | 0 | 114.1 | M5 I58 | L3-M5 PolarHBondContact O-N 3.5Å; L3-I58 HydrophobicContact CD1-CG2 4.44Å |
| 4 | H | 44.6 | Very low | 50.4 | Low | 143 Ų | 143 | 114.8 Ų | 114.8 | 66% | 0.662 | 58% | 0.58 | S | S | * | * | trans | -76.8 | 93.2 | 176 | -90.4 | -91.9 | 0 | 0 | 0 | 110.2 | ||||
| 5 | M | 56.6 | Low | 51.5 | Low | 143 Ų | 143 | 113.7 Ų | 113.7 | 70% | 0.704 | 58% | 0.583 | S | S | * | * | trans | -93.5 | 6.2 | 172.4 | -71.4 | -90.7 | 153.2 | 0 | 0 | 112.7 | L3 | L3-M5 PolarHBondContact O-N 3.5Š| ||
| 6 | S | 44.6 | Very low | 52.8 | Low | 30 Ų | 30 | 110.6 Ų | 110.6 | 21% | 0.21 | 57% | 0.568 | C | S | . | * | trans | -94 | 128.1 | -178.8 | 175.3 | 0 | 0 | 0 | 0 | 111.7 | Q8 R14 | S6-Q8 VanDerWaalsContact C-N 3.25Å; S6-Q8 PolarHBondContact O-N 3.24Å; S6-Q8 PolarHBondContact OG-N 3.41Å; S6-Q8 PolarHBondContact OG-O 3.44Å; S6-R14 VanDerWaalsContact CB-NH1 3.31Å; S6-R14 PolarHBondContact OG-NH1 3.41Å | ||
| 7 | K | 52.2 | Low | 54 | Low | 156 Ų | 156 | 104.9 Ų | 104.9 | 68% | 0.678 | 54% | 0.54 | S | S | * | . | S | Bend | trans | -72.4 | -11.5 | 171.6 | -82.1 | -175.3 | 178.8 | 172.5 | 0 | 113.8 | W75 | K7-W75 HydrophobicContact CB-CE3 4.21Å; K7-W75 HydrophobicContact CB-CZ3 3.95Å; K7-W75 HydrophobicContact CD-CE3 4.15Å; K7-W75 HydrophobicContact CD-CZ3 4.34Å |
| 8 | Q | 43.3 | Very low | 55.1 | Low | 62 Ų | 62 | 103.5 Ų | 103.5 | 29% | 0.29 | 53% | 0.531 | S | S | . | . | trans | -107.6 | 129.7 | 174.6 | -78.3 | 177 | -61.5 | 0 | 0 | 110.8 | S6 S10 W75 | S6-Q8 VanDerWaalsContact C-N 3.25Å; S6-Q8 PolarHBondContact O-N 3.24Å; S6-Q8 PolarHBondContact OG-N 3.41Å; S6-Q8 PolarHBondContact OG-O 3.44Å; Q8-S10 VanDerWaalsContact C-N 3.33Å; Q8-W75 HydrophobicContact CG-CZ3 4.46Å | ||
| 9 | Q | 50.7 | Low | 56.5 | Low | 202 Ų | 202 | 101.5 Ų | 101.5 | 94% | 0.944 | 53% | 0.527 | S | S | * | . | S | Bend | trans | -79.3 | -16 | 179 | -167 | 167.5 | -11 | 0 | 0 | 112.8 | ||
| 10 | S | 46.3 | Very low | 57.8 | Low | 59 Ų | 59 | 97.1 Ų | 97.1 | 41% | 0.413 | 50% | 0.504 | S | S | . | . | trans | -106.8 | 125.7 | -178.3 | -179.3 | 0 | 0 | 0 | 0 | 111.7 | Q8 M12 | Q8-S10 VanDerWaalsContact C-N 3.33Å; S10-M12 PolarHBondContact O-N 3.3Å; S10-M12 VanDerWaalsContact OG-CB 3.22Å; S10-M12 WeakPolarHBondContact OG-CB 3.45Å; S10-M12 PolarHBondContact OG-N 3.2Å | ||
| 11 | M | 54.2 | Low | 59 | Low | 82 Ų | 82 | 98.3 Ų | 98.3 | 40% | 0.404 | 50% | 0.503 | S | S | . | . | G | 310 helix | trans | -70.8 | -1 | 171.8 | -122.7 | 162.1 | 177.6 | 0 | 0 | 112.8 | F13 Q18 Y21 | M11-F13 VanDerWaalsContact C-N 3.35Å; M11-F13 PolarHBondContact O-N 2.97Å; M11-Q18 WeakPolarHBondContact O-CG 3.38Å; M11-Q18 PolarHBondContact O-NE2 2.89Å; M11-Y21 HydrophobicContact CE-CD2 4.33Å; M11-Y21 HydrophobicContact CE-CG 4.35Å |
| 12 | M | 47.3 | Very low | 60.6 | Low | 147 Ų | 147 | 99.9 Ų | 99.9 | 72% | 0.724 | 49% | 0.49 | S | S | * | . | G | 310 helix | trans | -71.8 | -23 | -172.1 | -162.5 | 173.7 | -176.3 | 0 | 0 | 114 | S10 | S10-M12 PolarHBondContact O-N 3.3Å; S10-M12 VanDerWaalsContact OG-CB 3.22Å; S10-M12 WeakPolarHBondContact OG-CB 3.45Å; S10-M12 PolarHBondContact OG-N 3.2Å |
| 13 | F | 51.8 | Low | 62.2 | Low | 145 Ų | 145 | 96.3 Ų | 96.3 | 64% | 0.636 | 47% | 0.472 | S | S | * | . | G | 310 helix | trans | -106.2 | 17.2 | -177.1 | -66.9 | -75.3 | 0 | 0 | 0 | 114.2 | M11 | M11-F13 VanDerWaalsContact C-N 3.35Å; M11-F13 PolarHBondContact O-N 2.97Å |
| 14 | R | 63.4 | Low | 64.1 | Low | 11 Ų | 11 | 91.9 Ų | 91.9 | 4% | 0.042 | 45% | 0.448 | C | S | . | . | trans | -133.7 | 81 | -169.4 | -64.3 | -172.8 | 78.2 | 166.2 | 27.6 | 111.5 | S6 L16 S17 Q18 S66 E69 | S6-R14 VanDerWaalsContact CB-NH1 3.31Å; S6-R14 PolarHBondContact OG-NH1 3.41Å; R14-L16 PolarHBondContact O-N 3Å; R14-S17 PolarHBondContact NE-OG 3.43Å; R14-S17 PolarHBondContact O-N 3.46Å; R14-Q18 PolarHBondContact O-N 3.3Å; R14-S66 PolarHBondContact NH1-OG 2.94Å; R14-S66 PolarHBondContact NH2-O 3.23Å; R14-S66 PolarHBondContact NH2-OG 2.74Å; R14-E69 VanDerWaalsContact CA-OE1 3.23Å; R14-E69 WeakPolarHBondContact CA-OE1 3.45Å; R14-E69 VanDerWaalsContact CB-OE1 3.32Å; R14-E69 WeakPolarHBondContact CB-OE1 3.47Å; R14-E69 WeakPolarHBondContact CB-OE2 3.48Å; R14-E69 IonicContact CZ-OE2 3.16Å; R14-E69 IonicContact NE-OE2 2.65Å; R14-E69 PolarHBondContact NE-OE2 3.02Å; R14-E69 VanDerWaalsContact NH2-CB 3.25Å; R14-E69 IonicContact NH2-OE2 3.17Å; R14-E69 PolarHBondContact NH2-OE2 3.17Å | ||
| 15 | P | 66.6 | Low | 66.3 | Low | 98 Ų | 98 | 86.4 Ų | 86.4 | 64% | 0.636 | 43% | 0.428 | S | S | * | . | H | α-helix | trans | -62.6 | -29.9 | -173.7 | 24.3 | -32.9 | 0 | 0 | 0 | 113 | S19 | P15-S19 PolarHBondContact O-N 2.97Å; P15-S19 VanDerWaalsContact O-N 3.16Å |
| 16 | L | 71.5 | Confident | 67.9 | Low | 65 Ų | 65 | 81.9 Ų | 81.9 | 34% | 0.34 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -74.4 | -42.7 | 177.1 | -61.9 | 167.7 | 0 | 0 | 0 | 110.7 | R14 Q18 S19 L20 I65 E69 M72 | R14-L16 PolarHBondContact O-N 3Å; L16-Q18 VanDerWaalsContact C-N 3.31Å; L16-Q18 PolarHBondContact O-N 3.19Å; L16-S19 PolarHBondContact O-N 3.28Å; L16-S19 PolarHBondContact O-OG 3.36Å; L16-L20 PolarHBondContact O-N 3.36Å; L16-L20 VanDerWaalsContact O-N 3.15Å; L16-I65 HydrophobicContact CB-CD1 4.29Å; L16-I65 HydrophobicContact CB-CG2 3.67Å; L16-E69 WeakPolarHBondContact CA-OE1 3.38Å; L16-E69 HydrophobicContact CB-CG 4.13Å; L16-E69 VanDerWaalsContact CB-OE1 3.29Å; L16-E69 WeakPolarHBondContact CB-OE1 3.47Å; L16-E69 HydrophobicContact CD1-CG 3.92Å; L16-E69 HydrophobicContact CG-CG 4.44Å; L16-E69 PolarHBondContact N-OE1 3.31Å; L16-M72 HydrophobicContact CD1-SD 4.35Å |
| 17 | S | 73 | Confident | 70.1 | Confident | 13 Ų | 13 | 80.9 Ų | 80.9 | 9% | 0.091 | 41% | 0.406 | C | S | . | . | H | α-helix | trans | -62.3 | -36.3 | 174.2 | -69.2 | 0 | 0 | 0 | 0 | 112.7 | R14 L20 Y21 E69 | R14-S17 PolarHBondContact NE-OG 3.43Å; R14-S17 PolarHBondContact O-N 3.46Å; S17-L20 PolarHBondContact O-N 3.15Å; S17-Y21 PolarHBondContact O-N 3.34Å; S17-Y21 VanDerWaalsContact O-N 3.11Å; S17-E69 PolarHBondContact N-OE1 2.79Å; S17-E69 VanDerWaalsContact N-OE1 3.17Å; S17-E69 PolarHBondContact OG-OE2 2.92Å |
| 18 | Q | 75.3 | Confident | 71.9 | Confident | 80 Ų | 80 | 77 Ų | 77 | 37% | 0.374 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -64.3 | -42.4 | 173.7 | -74.8 | -178 | 5.9 | 0 | 0 | 112.4 | M11 R14 L16 L20 Y21 W22 | M11-Q18 WeakPolarHBondContact O-CG 3.38Å; M11-Q18 PolarHBondContact O-NE2 2.89Å; R14-Q18 PolarHBondContact O-N 3.3Å; L16-Q18 VanDerWaalsContact C-N 3.31Å; L16-Q18 PolarHBondContact O-N 3.19Å; Q18-L20 VanDerWaalsContact C-N 3.31Å; Q18-L20 PolarHBondContact O-N 2.83Å; Q18-Y21 WeakPolarHBondContact O-CB 3.3Å; Q18-Y21 PolarHBondContact O-N 3.34Å; Q18-W22 VanDerWaalsContact O-CD1 3.29Å; Q18-W22 PolarHBondContact O-N 2.95Å; Q18-W22 VanDerWaalsContact O-N 3.12Å |
| 19 | S | 81.8 | Confident | 74.3 | Confident | 66 Ų | 66 | 80 Ų | 80 | 46% | 0.462 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -61.6 | -39.4 | 177.6 | 73.4 | 0 | 0 | 0 | 0 | 112.4 | P15 L16 W22 L23 | P15-S19 PolarHBondContact O-N 2.97Å; P15-S19 VanDerWaalsContact O-N 3.16Å; L16-S19 PolarHBondContact O-N 3.28Å; L16-S19 PolarHBondContact O-OG 3.36Å; S19-W22 PolarHBondContact O-N 2.93Å; S19-L23 WeakPolarHBondContact O-CB 3.37Å; S19-L23 PolarHBondContact O-N 2.99Å |
| 20 | L | 82.6 | Confident | 76.1 | Confident | 13 Ų | 13 | 74 Ų | 74 | 7% | 0.068 | 38% | 0.383 | C | S | . | . | H | α-helix | trans | -65.5 | -37.2 | 175.1 | -77.1 | 173.3 | 0 | 0 | 0 | 113.1 | L16 S17 Q18 L23 L24 L61 I65 | L16-L20 PolarHBondContact O-N 3.36Å; L16-L20 VanDerWaalsContact O-N 3.15Å; S17-L20 PolarHBondContact O-N 3.15Å; Q18-L20 VanDerWaalsContact C-N 3.31Å; Q18-L20 PolarHBondContact O-N 2.83Å; L20-L23 PolarHBondContact O-N 3.21Å; L20-L24 WeakPolarHBondContact O-CB 3.38Å; L20-L24 PolarHBondContact O-N 3.29Å; L20-L61 HydrophobicContact CD1-CB 4.43Å; L20-L61 HydrophobicContact CD2-CB 3.93Å; L20-L61 HydrophobicContact CD2-CD2 3.63Å; L20-L61 HydrophobicContact CD2-CG 4.14Å; L20-I65 HydrophobicContact CD1-CB 3.5Å; L20-I65 VanDerWaalsContact CD1-CB 3.5Å; L20-I65 HydrophobicContact CD1-CD1 3.91Å; L20-I65 HydrophobicContact CD1-CG1 3.6Å; L20-I65 HydrophobicContact CD1-CG2 3.66Å; L20-I65 HydrophobicContact CG-CD1 4.45Å |
| 21 | Y | 82.3 | Confident | 78.1 | Confident | 122 Ų | 122 | 73.2 Ų | 73.2 | 48% | 0.478 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -62.4 | -44.9 | 175.5 | 176.4 | -96.7 | 0 | 0 | 0 | 111.3 | M11 S17 Q18 L23 L24 A25 | M11-Y21 HydrophobicContact CE-CD2 4.33Å; M11-Y21 HydrophobicContact CE-CG 4.35Å; S17-Y21 PolarHBondContact O-N 3.34Å; S17-Y21 VanDerWaalsContact O-N 3.11Å; Q18-Y21 WeakPolarHBondContact O-CB 3.3Å; Q18-Y21 PolarHBondContact O-N 3.34Å; Y21-L23 VanDerWaalsContact C-N 3.32Å; Y21-L23 PolarHBondContact O-N 3.43Å; Y21-L24 PolarHBondContact O-N 3.46Å; Y21-A25 WeakPolarHBondContact O-CB 3.31Å; Y21-A25 PolarHBondContact O-N 3.41Å |
| 22 | W | 84.1 | Confident | 79.8 | Confident | 184 Ų | 184 | 74.5 Ų | 74.5 | 70% | 0.697 | 39% | 0.387 | S | S | * | . | H | α-helix | trans | -65.4 | -36 | 175.3 | -78.8 | 107.8 | 0 | 0 | 0 | 112.6 | Q18 S19 A25 A26 | Q18-W22 VanDerWaalsContact O-CD1 3.29Å; Q18-W22 PolarHBondContact O-N 2.95Å; Q18-W22 VanDerWaalsContact O-N 3.12Å; S19-W22 PolarHBondContact O-N 2.93Å; W22-A25 PolarHBondContact O-N 3.07Å; W22-A26 WeakPolarHBondContact O-CB 3.38Å; W22-A26 PolarHBondContact O-N 2.7Å |
| 23 | L | 86.5 | Confident | 81.8 | Confident | 86 Ų | 86 | 74.7 Ų | 74.7 | 45% | 0.45 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -63 | -45.1 | 173.6 | -166.7 | 153.7 | 0 | 0 | 0 | 111.3 | S19 L20 Y21 A25 A26 D27 T57 | S19-L23 WeakPolarHBondContact O-CB 3.37Å; S19-L23 PolarHBondContact O-N 2.99Å; L20-L23 PolarHBondContact O-N 3.21Å; Y21-L23 VanDerWaalsContact C-N 3.32Å; Y21-L23 PolarHBondContact O-N 3.43Å; L23-A25 PolarHBondContact O-N 2.95Å; L23-A26 PolarHBondContact O-N 2.95Å; L23-D27 WeakPolarHBondContact O-CB 3.37Å; L23-D27 PolarHBondContact O-N 3.28Å; L23-T57 HydrophobicContact CD2-CG2 4.38Å |
| 24 | L | 88.5 | Confident | 83.7 | Confident | 22 Ų | 22 | 68.8 Ų | 68.8 | 12% | 0.115 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -62 | -42.1 | 174.7 | -171.3 | 84 | 0 | 0 | 0 | 111.8 | L20 Y21 A26 D27 L28 Y54 T57 I58 | L20-L24 WeakPolarHBondContact O-CB 3.38Å; L20-L24 PolarHBondContact O-N 3.29Å; Y21-L24 PolarHBondContact O-N 3.46Å; L24-A26 VanDerWaalsContact C-N 3.34Å; L24-A26 PolarHBondContact O-N 3.41Å; L24-D27 PolarHBondContact O-N 2.84Å; L24-L28 WeakPolarHBondContact O-CG 3.47Å; L24-L28 PolarHBondContact O-N 3.01Å; L24-Y54 HydrophobicContact CD1-CD2 3.94Å; L24-Y54 HydrophobicContact CD1-CE2 3.9Å; L24-T57 HydrophobicContact CB-CG2 4.43Å; L24-T57 HydrophobicContact CD1-CG2 3.97Å; L24-I58 HydrophobicContact CD1-CD1 3.98Å; L24-I58 HydrophobicContact CD1-CG1 3.62Å |
| 25 | A | 89.6 | Confident | 84.8 | Confident | 29 Ų | 29 | 71.6 Ų | 71.6 | 24% | 0.24 | 39% | 0.387 | C | S | . | . | H | α-helix | trans | -62.5 | -41.6 | 177 | 0 | 0 | 0 | 0 | 0 | 111.6 | Y21 W22 L23 L28 L29 | Y21-A25 WeakPolarHBondContact O-CB 3.31Å; Y21-A25 PolarHBondContact O-N 3.41Å; W22-A25 PolarHBondContact O-N 3.07Å; L23-A25 PolarHBondContact O-N 2.95Å; A25-L28 PolarHBondContact O-N 2.62Å; A25-L29 WeakPolarHBondContact O-CG 3.18Å; A25-L29 PolarHBondContact O-N 3.17Å; A25-L29 VanDerWaalsContact O-N 3.12Å |
| 26 | A | 91.6 | Very high | 85.8 | Confident | 47 Ų | 47 | 70 Ų | 70 | 39% | 0.388 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -64.4 | -42 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | W22 L23 L24 L28 L29 I30 | W22-A26 WeakPolarHBondContact O-CB 3.38Å; W22-A26 PolarHBondContact O-N 2.7Å; L23-A26 PolarHBondContact O-N 2.95Å; L24-A26 VanDerWaalsContact C-N 3.34Å; L24-A26 PolarHBondContact O-N 3.41Å; A26-L28 PolarHBondContact O-N 3.17Å; A26-L29 WeakPolarHBondContact O-CB 3.28Å; A26-L29 PolarHBondContact O-N 3.1Å; A26-I30 WeakPolarHBondContact O-CG1 3.49Å; A26-I30 PolarHBondContact O-N 3.01Å |
| 27 | D | 90.4 | Very high | 86.5 | Confident | 10 Ų | 10 | 70.1 Ų | 70.1 | 5% | 0.053 | 39% | 0.387 | C | S | . | . | H | α-helix | trans | -63.3 | -40.4 | 178 | -168.8 | 74.2 | 0 | 0 | 0 | 112.2 | L23 L24 L29 I30 L31 Y54 | L23-D27 WeakPolarHBondContact O-CB 3.37Å; L23-D27 PolarHBondContact O-N 3.28Å; L24-D27 PolarHBondContact O-N 2.84Å; D27-L29 PolarHBondContact O-N 3.43Å; D27-I30 PolarHBondContact O-N 2.96Å; D27-L31 WeakPolarHBondContact O-CG 3.43Å; D27-L31 PolarHBondContact O-N 3.04Å; D27-Y54 WeakPolarHBondContact OD2-CA 3.46Å; D27-Y54 VanDerWaalsContact OD2-CB 3.25Å; D27-Y54 WeakPolarHBondContact OD2-CB 3.43Å; D27-Y54 PolarHBondContact OD2-N 3.39Å |
| 28 | L | 90.3 | Very high | 87 | Confident | 73 Ų | 73 | 73.5 Ų | 73.5 | 38% | 0.382 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -63.2 | -38.6 | 172.6 | -77.2 | 173.3 | 0 | 0 | 0 | 113 | L24 A25 A26 I30 L31 T32 Y54 | L24-L28 WeakPolarHBondContact O-CG 3.47Å; L24-L28 PolarHBondContact O-N 3.01Å; A25-L28 PolarHBondContact O-N 2.62Å; A26-L28 PolarHBondContact O-N 3.17Å; L28-I30 VanDerWaalsContact C-N 3.35Å; L28-L31 PolarHBondContact O-N 3.49Å; L28-T32 WeakPolarHBondContact O-CB 3.47Å; L28-T32 PolarHBondContact O-N 2.65Å; L28-T32 PolarHBondContact O-OG1 3.39Å; L28-Y54 HydrophobicContact CD2-CD2 4.11Å; L28-Y54 HydrophobicContact CD2-CE2 3.55Å; L28-Y54 HydrophobicContact CG-CD2 4.44Å; L28-Y54 HydrophobicContact CG-CE2 4Å |
| 29 | L | 92.9 | Very high | 87.2 | Confident | 127 Ų | 127 | 76 Ų | 76 | 67% | 0.665 | 43% | 0.429 | S | S | * | . | H | α-helix | trans | -64.4 | -41.4 | 174.2 | -71.4 | 172.1 | 0 | 0 | 0 | 111.2 | A25 A26 D27 T32 W33 | A25-L29 WeakPolarHBondContact O-CG 3.18Å; A25-L29 PolarHBondContact O-N 3.17Å; A25-L29 VanDerWaalsContact O-N 3.12Å; A26-L29 WeakPolarHBondContact O-CB 3.28Å; A26-L29 PolarHBondContact O-N 3.1Å; D27-L29 PolarHBondContact O-N 3.43Å; L29-T32 PolarHBondContact O-N 3.38Å; L29-W33 WeakPolarHBondContact O-CB 3.14Å; L29-W33 PolarHBondContact O-N 2.89Å |
| 30 | I | 88.4 | Confident | 87.2 | Confident | 74 Ų | 74 | 75.3 Ų | 75.3 | 38% | 0.379 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -63.8 | -45.7 | 176.6 | -67.8 | 165.2 | 0 | 0 | 0 | 110.7 | A26 D27 L28 T32 W33 I34 A50 | A26-I30 WeakPolarHBondContact O-CG1 3.49Å; A26-I30 PolarHBondContact O-N 3.01Å; D27-I30 PolarHBondContact O-N 2.96Å; L28-I30 VanDerWaalsContact C-N 3.35Å; I30-T32 PolarHBondContact O-N 3.05Å; I30-W33 PolarHBondContact O-N 3.45Å; I30-I34 HydrophobicContact CG2-CD1 3.63Å; I30-I34 HydrophobicContact CG2-CG1 4.42Å; I30-I34 VanDerWaalsContact O-CG1 3.28Å; I30-I34 WeakPolarHBondContact O-CG1 3.29Å; I30-I34 PolarHBondContact O-N 3.25Å; I30-A50 HydrophobicContact CG2-CB 4.37Å |
| 31 | L | 88.3 | Confident | 87.2 | Confident | 43 Ų | 43 | 83.8 Ų | 83.8 | 23% | 0.225 | 46% | 0.457 | C | S | . | . | H | α-helix | trans | -61.7 | -42.1 | 176.7 | -79.2 | 164.9 | 0 | 0 | 0 | 112.3 | D27 L28 W33 I34 G35 A50 Y54 | D27-L31 WeakPolarHBondContact O-CG 3.43Å; D27-L31 PolarHBondContact O-N 3.04Å; L28-L31 PolarHBondContact O-N 3.49Å; L31-W33 VanDerWaalsContact C-N 3.33Å; L31-W33 PolarHBondContact O-N 3.15Å; L31-I34 PolarHBondContact O-N 3.44Å; L31-G35 PolarHBondContact O-N 3.42Å; L31-A50 HydrophobicContact CD2-CB 3.77Å; L31-A50 HydrophobicContact CG-CB 3.98Å; L31-Y54 HydrophobicContact CD1-CD2 4.27Å; L31-Y54 HydrophobicContact CD1-CG 4.27Å |
| 32 | T | 90.7 | Very high | 87.1 | Confident | 110 Ų | 110 | 80.8 Ų | 80.8 | 68% | 0.675 | 45% | 0.452 | S | S | * | . | H | α-helix | trans | -63.3 | -41.9 | 176.8 | -55.5 | 0 | 0 | 0 | 0 | 111 | L28 L29 I30 G35 | L28-T32 WeakPolarHBondContact O-CB 3.47Å; L28-T32 PolarHBondContact O-N 2.65Å; L28-T32 PolarHBondContact O-OG1 3.39Å; L29-T32 PolarHBondContact O-N 3.38Å; I30-T32 PolarHBondContact O-N 3.05Å; T32-G35 PolarHBondContact O-N 3.15Å |
| 33 | W | 89.3 | Confident | 87.2 | Confident | 150 Ų | 150 | 74.4 Ų | 74.4 | 57% | 0.568 | 43% | 0.429 | S | S | * | . | H | α-helix | trans | -65.2 | -43.7 | 177.5 | 178.6 | 62.3 | 0 | 0 | 0 | 112.2 | L29 I30 L31 G35 G36 F43 | L29-W33 WeakPolarHBondContact O-CB 3.14Å; L29-W33 PolarHBondContact O-N 2.89Å; I30-W33 PolarHBondContact O-N 3.45Å; L31-W33 VanDerWaalsContact C-N 3.33Å; L31-W33 PolarHBondContact O-N 3.15Å; W33-G35 VanDerWaalsContact C-N 3.33Å; W33-G35 PolarHBondContact O-N 3.01Å; W33-G36 PolarHBondContact O-N 2.85Å; W33-F43 HydrophobicContact CH2-CE1 4.38Å |
| 34 | I | 90.6 | Very high | 87.2 | Confident | 21 Ų | 21 | 73 Ų | 73 | 11% | 0.108 | 42% | 0.424 | C | S | . | . | H | α-helix | trans | -67.2 | -34.2 | 178.2 | -67.7 | 166.4 | 0 | 0 | 0 | 111.6 | I30 L31 G36 Q37 I46 | I30-I34 HydrophobicContact CG2-CD1 3.63Å; I30-I34 HydrophobicContact CG2-CG1 4.42Å; I30-I34 VanDerWaalsContact O-CG1 3.28Å; I30-I34 WeakPolarHBondContact O-CG1 3.29Å; I30-I34 PolarHBondContact O-N 3.25Å; L31-I34 PolarHBondContact O-N 3.44Å; I34-G36 PolarHBondContact O-N 3.46Å; I34-G36 VanDerWaalsContact O-N 3.17Å; I34-Q37 PolarHBondContact O-N 2.7Å; I34-I46 HydrophobicContact CD1-CB 3.92Å; I34-I46 HydrophobicContact CD1-CG2 3.39Å; I34-I46 HydrophobicContact CG1-CG2 4.44Å |
| 35 | G | 87.4 | Confident | 87.3 | Confident | 70 Ų | 70 | 75.8 Ų | 75.8 | 72% | 0.722 | 44% | 0.439 | S | S | * | . | H | α-helix | trans | -60.8 | -22.6 | 176.3 | 0 | 0 | 0 | 0 | 0 | 114.1 | L31 T32 W33 | L31-G35 PolarHBondContact O-N 3.42Å; T32-G35 PolarHBondContact O-N 3.15Å; W33-G35 VanDerWaalsContact C-N 3.33Å; W33-G35 PolarHBondContact O-N 3.01Å |
| 36 | G | 86.6 | Confident | 87.3 | Confident | 65 Ų | 65 | 77.8 Ų | 77.8 | 67% | 0.67 | 45% | 0.445 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -92.3 | -7.5 | 174.7 | 0 | 0 | 0 | 0 | 0 | 114.9 | W33 I34 | W33-G36 PolarHBondContact O-N 2.85Å; I34-G36 PolarHBondContact O-N 3.46Å; I34-G36 VanDerWaalsContact O-N 3.17Å |
| 37 | Q | 85.9 | Confident | 87.1 | Confident | 68 Ų | 68 | 76.2 Ų | 76.2 | 32% | 0.318 | 43% | 0.433 | S | S | . | . | S | Bend | trans | -86.9 | 150 | 178 | -64.6 | -57 | -47.5 | 0 | 0 | 111 | I34 F43 | I34-Q37 PolarHBondContact O-N 2.7Å; Q37-F43 HydrophobicContact CB-CB 4.45Å; Q37-F43 HydrophobicContact CB-CD1 4.31Å; Q37-F43 HydrophobicContact CB-CD2 4.29Å; Q37-F43 HydrophobicContact CB-CG 4.09Å; Q37-F43 HydrophobicContact CG-CD1 4.23Å; Q37-F43 HydrophobicContact CG-CE1 4.3Å |
| 38 | P | 84.1 | Confident | 87.1 | Confident | 84 Ų | 84 | 81.6 Ų | 81.6 | 55% | 0.545 | 46% | 0.458 | S | S | . | . | trans | -60.9 | 145 | 171.9 | 26.6 | -33.8 | 0 | 0 | 0 | 110.2 | S40 | P38-S40 PolarHBondContact O-N 2.95Š| ||
| 39 | V | 80.3 | Confident | 87.2 | Confident | 133 Ų | 133 | 82 Ų | 82 | 81% | 0.806 | 46% | 0.463 | S | S | * | . | S | Bend | trans | -75.6 | 71.1 | 177.6 | -169.1 | 0 | 0 | 0 | 0 | 109.5 | ||
| 40 | S | 80.9 | Confident | 87.1 | Confident | 51 Ų | 51 | 76.2 Ų | 76.2 | 36% | 0.357 | 43% | 0.434 | S | S | . | . | trans | -120.3 | 155.1 | 173.7 | 58.3 | 0 | 0 | 0 | 0 | 110.3 | P38 F43 | P38-S40 PolarHBondContact O-N 2.95Å; S40-F43 PolarHBondContact O-N 3.12Å | ||
| 41 | Y | 81.9 | Confident | 87.2 | Confident | 190 Ų | 190 | 75.1 Ų | 75.1 | 75% | 0.745 | 43% | 0.433 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.2 | 127.5 | 166.9 | -174.8 | -90.1 | 0 | 0 | 0 | 108.3 | I45 | Y41-I45 HydrophobicContact CD2-CD1 4.05Å; Y41-I45 HydrophobicContact CE2-CD1 3.53Å |
| 42 | P | 81.5 | Confident | 87.4 | Confident | 59 Ų | 59 | 77.6 Ų | 77.6 | 38% | 0.383 | 45% | 0.449 | S | S | . | . | T | Hydrogen-bonded Turn | cis | -102.3 | -1.1 | 16 | 38.1 | -35.4 | 0 | 0 | 0 | 116.1 | T44 I45 I46 | P42-T44 VanDerWaalsContact C-N 3.28Å; P42-T44 PolarHBondContact O-N 3.34Å; P42-I45 PolarHBondContact O-N 3.23Å; P42-I46 PolarHBondContact O-N 3.16Å |
| 43 | F | 86.4 | Confident | 87.4 | Confident | 50 Ų | 50 | 76.4 Ų | 76.4 | 22% | 0.219 | 44% | 0.438 | C | S | . | . | H | α-helix | trans | -63.8 | -29.7 | -171.2 | -59 | -66.7 | 0 | 0 | 0 | 113.7 | W33 Q37 S40 I45 I46 G47 | W33-F43 HydrophobicContact CH2-CE1 4.38Å; Q37-F43 HydrophobicContact CB-CB 4.45Å; Q37-F43 HydrophobicContact CB-CD1 4.31Å; Q37-F43 HydrophobicContact CB-CD2 4.29Å; Q37-F43 HydrophobicContact CB-CG 4.09Å; Q37-F43 HydrophobicContact CG-CD1 4.23Å; Q37-F43 HydrophobicContact CG-CE1 4.3Å; S40-F43 PolarHBondContact O-N 3.12Å; F43-I45 VanDerWaalsContact C-N 3.34Å; F43-I45 PolarHBondContact O-N 3.21Å; F43-I46 HydrophobicContact CD1-CD1 4.48Å; F43-I46 PolarHBondContact O-N 2.98Å; F43-G47 PolarHBondContact O-N 3.23Å |
| 44 | T | 86.1 | Confident | 87.4 | Confident | 56 Ų | 56 | 72.5 Ų | 72.5 | 34% | 0.344 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -59.1 | -42.4 | 175.1 | -49.7 | 0 | 0 | 0 | 0 | 112.5 | P42 Q48 | P42-T44 VanDerWaalsContact C-N 3.28Å; P42-T44 PolarHBondContact O-N 3.34Å; T44-Q48 WeakPolarHBondContact O-CG 3.32Å; T44-Q48 PolarHBondContact O-N 3.09Å; T44-Q48 VanDerWaalsContact O-N 3.09Å |
| 45 | I | 90.2 | Very high | 87.3 | Confident | 82 Ų | 82 | 77.5 Ų | 77.5 | 42% | 0.421 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -70.8 | -41.6 | -179.4 | -66.6 | 174.5 | 0 | 0 | 0 | 110 | Y41 P42 F43 G47 Q48 V49 | Y41-I45 HydrophobicContact CD2-CD1 4.05Å; Y41-I45 HydrophobicContact CE2-CD1 3.53Å; P42-I45 PolarHBondContact O-N 3.23Å; F43-I45 VanDerWaalsContact C-N 3.34Å; F43-I45 PolarHBondContact O-N 3.21Å; I45-G47 VanDerWaalsContact C-N 3.3Å; I45-G47 PolarHBondContact O-N 3.41Å; I45-Q48 PolarHBondContact O-N 3.49Å; I45-V49 HydrophobicContact CG2-CG2 4.33Å; I45-V49 WeakPolarHBondContact O-CG2 3.24Å; I45-V49 PolarHBondContact O-N 3.28Å |
| 46 | I | 88.7 | Confident | 87.5 | Confident | 71 Ų | 71 | 76.6 Ų | 76.6 | 36% | 0.364 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -62.4 | -42.1 | 178.7 | -52.7 | 173.7 | 0 | 0 | 0 | 109.9 | I34 P42 F43 Q48 V49 A50 | I34-I46 HydrophobicContact CD1-CB 3.92Å; I34-I46 HydrophobicContact CD1-CG2 3.39Å; I34-I46 HydrophobicContact CG1-CG2 4.44Å; P42-I46 PolarHBondContact O-N 3.16Å; F43-I46 HydrophobicContact CD1-CD1 4.48Å; F43-I46 PolarHBondContact O-N 2.98Å; I46-Q48 PolarHBondContact O-N 3.42Å; I46-V49 PolarHBondContact O-N 2.93Å; I46-A50 VanDerWaalsContact O-CB 3.25Å; I46-A50 WeakPolarHBondContact O-CB 3.46Å; I46-A50 PolarHBondContact O-N 3.03Å |
| 47 | G | 89.3 | Confident | 87.4 | Confident | 14 Ų | 14 | 73.8 Ų | 73.8 | 14% | 0.144 | 40% | 0.395 | C | S | . | . | H | α-helix | trans | -63.2 | -39.8 | 176 | 0 | 0 | 0 | 0 | 0 | 113.5 | F43 I45 S51 | F43-G47 PolarHBondContact O-N 3.23Å; I45-G47 VanDerWaalsContact C-N 3.3Å; I45-G47 PolarHBondContact O-N 3.41Å; G47-S51 WeakPolarHBondContact O-CB 3.46Å; G47-S51 PolarHBondContact O-N 3.44Å; G47-S51 PolarHBondContact O-OG 3.24Å |
| 48 | Q | 89.3 | Confident | 87.3 | Confident | 123 Ų | 123 | 72.3 Ų | 72.3 | 58% | 0.575 | 39% | 0.389 | S | S | * | . | H | α-helix | trans | -64.5 | -47.5 | 174.7 | -74.2 | 176.1 | 1.2 | 0 | 0 | 111.8 | T44 I45 I46 S51 V52 | T44-Q48 WeakPolarHBondContact O-CG 3.32Å; T44-Q48 PolarHBondContact O-N 3.09Å; T44-Q48 VanDerWaalsContact O-N 3.09Å; I45-Q48 PolarHBondContact O-N 3.49Å; I46-Q48 PolarHBondContact O-N 3.42Å; Q48-S51 PolarHBondContact O-N 3.46Å; Q48-V52 WeakPolarHBondContact O-CG2 3.38Å; Q48-V52 PolarHBondContact O-N 2.94Å |
| 49 | V | 92.3 | Very high | 87.3 | Confident | 82 Ų | 82 | 73.2 Ų | 73.2 | 50% | 0.497 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -62.9 | -44.4 | 178.3 | 173.4 | 0 | 0 | 0 | 0 | 110.8 | I45 I46 S51 V52 L53 | I45-V49 HydrophobicContact CG2-CG2 4.33Å; I45-V49 WeakPolarHBondContact O-CG2 3.24Å; I45-V49 PolarHBondContact O-N 3.28Å; I46-V49 PolarHBondContact O-N 2.93Å; V49-S51 PolarHBondContact O-N 3.3Å; V49-V52 PolarHBondContact O-N 2.86Å; V49-L53 HydrophobicContact CG1-CD1 3.98Å; V49-L53 HydrophobicContact CG1-CG 4.43Å; V49-L53 WeakPolarHBondContact O-CB 3.23Å; V49-L53 WeakPolarHBondContact O-CG 3.4Å; V49-L53 PolarHBondContact O-N 3.27Å |
| 50 | A | 90.1 | Very high | 87.5 | Confident | 5 Ų | 5 | 71.4 Ų | 71.4 | 4% | 0.041 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -61.6 | -41.4 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | I30 L31 I46 V52 L53 Y54 | I30-A50 HydrophobicContact CG2-CB 4.37Å; L31-A50 HydrophobicContact CD2-CB 3.77Å; L31-A50 HydrophobicContact CG-CB 3.98Å; I46-A50 VanDerWaalsContact O-CB 3.25Å; I46-A50 WeakPolarHBondContact O-CB 3.46Å; I46-A50 PolarHBondContact O-N 3.03Å; A50-V52 PolarHBondContact O-N 2.89Å; A50-L53 PolarHBondContact O-N 2.79Å; A50-Y54 WeakPolarHBondContact O-CB 3.49Å; A50-Y54 PolarHBondContact O-N 3.4Å |
| 51 | S | 90.4 | Very high | 87.6 | Confident | 51 Ų | 51 | 71.8 Ų | 71.8 | 36% | 0.357 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -63.3 | -42.4 | 176.3 | -59 | 0 | 0 | 0 | 0 | 112.1 | G47 Q48 V49 L53 Y54 F55 | G47-S51 WeakPolarHBondContact O-CB 3.46Å; G47-S51 PolarHBondContact O-N 3.44Å; G47-S51 PolarHBondContact O-OG 3.24Å; Q48-S51 PolarHBondContact O-N 3.46Å; V49-S51 PolarHBondContact O-N 3.3Å; S51-L53 VanDerWaalsContact C-N 3.34Å; S51-Y54 WeakPolarHBondContact O-CB 3.48Å; S51-Y54 PolarHBondContact O-N 2.71Å; S51-F55 VanDerWaalsContact O-CD2 3.26Å; S51-F55 WeakPolarHBondContact O-CD2 3.49Å; S51-F55 PolarHBondContact O-N 3.24Å; S51-F55 VanDerWaalsContact O-N 3.17Å |
| 52 | V | 93.8 | Very high | 87.6 | Confident | 94 Ų | 94 | 66.3 Ų | 66.3 | 57% | 0.57 | 35% | 0.354 | S | S | * | . | H | α-helix | trans | -64.1 | -42 | 175.7 | 172.6 | 0 | 0 | 0 | 0 | 110.8 | Q48 V49 A50 T56 | Q48-V52 WeakPolarHBondContact O-CG2 3.38Å; Q48-V52 PolarHBondContact O-N 2.94Å; V49-V52 PolarHBondContact O-N 2.86Å; A50-V52 PolarHBondContact O-N 2.89Å; V52-T56 VanDerWaalsContact O-CB 3.24Å; V52-T56 WeakPolarHBondContact O-CB 3.45Å; V52-T56 PolarHBondContact O-N 3.38Å; V52-T56 PolarHBondContact O-OG1 2.85Å |
| 53 | L | 89.9 | Confident | 87.4 | Confident | 85 Ų | 85 | 65.9 Ų | 65.9 | 45% | 0.445 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -62.1 | -43.3 | 175.9 | -77 | 171.5 | 0 | 0 | 0 | 111.9 | V49 A50 S51 T56 T57 | V49-L53 HydrophobicContact CG1-CD1 3.98Å; V49-L53 HydrophobicContact CG1-CG 4.43Å; V49-L53 WeakPolarHBondContact O-CB 3.23Å; V49-L53 WeakPolarHBondContact O-CG 3.4Å; V49-L53 PolarHBondContact O-N 3.27Å; A50-L53 PolarHBondContact O-N 2.79Å; S51-L53 VanDerWaalsContact C-N 3.34Å; L53-T56 PolarHBondContact O-N 2.83Å; L53-T57 VanDerWaalsContact O-CB 3.27Å; L53-T57 WeakPolarHBondContact O-CB 3.22Å; L53-T57 PolarHBondContact O-N 3.41Å; L53-T57 PolarHBondContact O-OG1 3.47Å |
| 54 | Y | 89.9 | Confident | 87.2 | Confident | 68 Ų | 68 | 66.5 Ų | 66.5 | 27% | 0.267 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -55.3 | -55.3 | 176.1 | -177.5 | -103.6 | 0 | 0 | 0 | 112 | L24 D27 L28 L31 A50 S51 T56 T57 I58 | L24-Y54 HydrophobicContact CD1-CD2 3.94Å; L24-Y54 HydrophobicContact CD1-CE2 3.9Å; D27-Y54 WeakPolarHBondContact OD2-CA 3.46Å; D27-Y54 VanDerWaalsContact OD2-CB 3.25Å; D27-Y54 WeakPolarHBondContact OD2-CB 3.43Å; D27-Y54 PolarHBondContact OD2-N 3.39Å; L28-Y54 HydrophobicContact CD2-CD2 4.11Å; L28-Y54 HydrophobicContact CD2-CE2 3.55Å; L28-Y54 HydrophobicContact CG-CD2 4.44Å; L28-Y54 HydrophobicContact CG-CE2 4Å; L31-Y54 HydrophobicContact CD1-CD2 4.27Å; L31-Y54 HydrophobicContact CD1-CG 4.27Å; A50-Y54 WeakPolarHBondContact O-CB 3.49Å; A50-Y54 PolarHBondContact O-N 3.4Å; S51-Y54 WeakPolarHBondContact O-CB 3.48Å; S51-Y54 PolarHBondContact O-N 2.71Å; Y54-T56 PolarHBondContact O-N 3.24Å; Y54-T57 PolarHBondContact O-N 3.17Å; Y54-I58 HydrophobicContact CD1-CD1 4.32Å; Y54-I58 HydrophobicContact CD2-CD1 4.38Å; Y54-I58 HydrophobicContact CE1-CD1 3.68Å; Y54-I58 HydrophobicContact CE2-CD1 3.73Å; Y54-I58 PolarHBondContact O-N 3.25Å; Y54-I58 VanDerWaalsContact O-N 3.15Å; Y54-I58 WeakPolarHBondContact OH-CD1 3.36Å |
| 55 | F | 89.2 | Confident | 87 | Confident | 126 Ų | 126 | 65.2 Ų | 65.2 | 55% | 0.553 | 35% | 0.35 | S | S | * | . | H | α-helix | trans | -65.8 | -40.7 | -179 | -80 | -71.8 | 0 | 0 | 0 | 112.3 | S51 T57 I58 L59 | S51-F55 VanDerWaalsContact O-CD2 3.26Å; S51-F55 WeakPolarHBondContact O-CD2 3.49Å; S51-F55 PolarHBondContact O-N 3.24Å; S51-F55 VanDerWaalsContact O-N 3.17Å; F55-T57 VanDerWaalsContact C-N 3.29Å; F55-T57 PolarHBondContact O-N 3.44Å; F55-I58 PolarHBondContact O-N 3.11Å; F55-L59 HydrophobicContact CD1-CD1 4.41Å; F55-L59 VanDerWaalsContact O-CB 3.29Å; F55-L59 WeakPolarHBondContact O-CB 3.29Å; F55-L59 WeakPolarHBondContact O-CG 3.37Å; F55-L59 PolarHBondContact O-N 2.89Å |
| 56 | T | 89.9 | Confident | 86.3 | Confident | 52 Ų | 52 | 61.8 Ų | 61.8 | 32% | 0.319 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -62.6 | -39.3 | 177 | -58.2 | 0 | 0 | 0 | 0 | 111.1 | V52 L53 Y54 I60 L61 | V52-T56 VanDerWaalsContact O-CB 3.24Å; V52-T56 WeakPolarHBondContact O-CB 3.45Å; V52-T56 PolarHBondContact O-N 3.38Å; V52-T56 PolarHBondContact O-OG1 2.85Å; L53-T56 PolarHBondContact O-N 2.83Å; Y54-T56 PolarHBondContact O-N 3.24Å; T56-I60 HydrophobicContact CG2-CB 4.47Å; T56-I60 HydrophobicContact CG2-CD1 4.34Å; T56-I60 WeakPolarHBondContact O-CA 3.46Å; T56-I60 WeakPolarHBondContact O-CB 3.41Å; T56-I60 PolarHBondContact O-N 3.24Å; T56-L61 HydrophobicContact CG2-CD1 4.34Å; T56-L61 PolarHBondContact O-N 3.48Å; T56-L61 VanDerWaalsContact O-N 3.1Å |
| 57 | T | 85.5 | Confident | 85.8 | Confident | 5 Ų | 5 | 63.3 Ų | 63.3 | 3% | 0.031 | 34% | 0.341 | C | S | . | . | I | π-helix | trans | -64.8 | -47 | -179.5 | -60.2 | 0 | 0 | 0 | 0 | 111.3 | L23 L24 L53 Y54 F55 L61 M62 | L23-T57 HydrophobicContact CD2-CG2 4.38Å; L24-T57 HydrophobicContact CB-CG2 4.43Å; L24-T57 HydrophobicContact CD1-CG2 3.97Å; L53-T57 VanDerWaalsContact O-CB 3.27Å; L53-T57 WeakPolarHBondContact O-CB 3.22Å; L53-T57 PolarHBondContact O-N 3.41Å; L53-T57 PolarHBondContact O-OG1 3.47Å; Y54-T57 PolarHBondContact O-N 3.17Å; F55-T57 VanDerWaalsContact C-N 3.29Å; F55-T57 PolarHBondContact O-N 3.44Å; T57-L61 WeakPolarHBondContact O-CB 3.45Å; T57-L61 PolarHBondContact O-N 3.31Å; T57-M62 PolarHBondContact O-N 3.18Å |
| 58 | I | 84.1 | Confident | 85.4 | Confident | 38 Ų | 38 | 66.5 Ų | 66.5 | 20% | 0.195 | 35% | 0.354 | C | S | . | . | I | π-helix | trans | -73.4 | -45.7 | -178.9 | -65.3 | 179.4 | 0 | 0 | 0 | 112.1 | L3 L24 Y54 F55 | L3-I58 HydrophobicContact CD1-CG2 4.44Å; L24-I58 HydrophobicContact CD1-CD1 3.98Å; L24-I58 HydrophobicContact CD1-CG1 3.62Å; Y54-I58 HydrophobicContact CD1-CD1 4.32Å; Y54-I58 HydrophobicContact CD2-CD1 4.38Å; Y54-I58 HydrophobicContact CE1-CD1 3.68Å; Y54-I58 HydrophobicContact CE2-CD1 3.73Å; Y54-I58 PolarHBondContact O-N 3.25Å; Y54-I58 VanDerWaalsContact O-N 3.15Å; Y54-I58 WeakPolarHBondContact OH-CD1 3.36Å; F55-I58 PolarHBondContact O-N 3.11Å |
| 59 | L | 83.8 | Confident | 84.8 | Confident | 102 Ų | 102 | 61.1 Ų | 61.1 | 53% | 0.534 | 33% | 0.329 | S | S | . | . | I | π-helix | trans | -82.6 | -33.2 | -172.2 | -67.8 | 174.5 | 0 | 0 | 0 | 113.3 | F55 P63 | F55-L59 HydrophobicContact CD1-CD1 4.41Å; F55-L59 VanDerWaalsContact O-CB 3.29Å; F55-L59 WeakPolarHBondContact O-CB 3.29Å; F55-L59 WeakPolarHBondContact O-CG 3.37Å; F55-L59 PolarHBondContact O-N 2.89Å; L59-P63 WeakPolarHBondContact O-CG 3.36Å |
| 60 | I | 84.8 | Confident | 83.9 | Confident | 96 Ų | 96 | 58.9 Ų | 58.9 | 49% | 0.492 | 31% | 0.314 | S | S | . | . | I | π-helix | trans | -113.6 | -52.1 | -171 | -57.1 | 177.2 | 0 | 0 | 0 | 111.4 | T56 P63 T64 | T56-I60 HydrophobicContact CG2-CB 4.47Å; T56-I60 HydrophobicContact CG2-CD1 4.34Å; T56-I60 WeakPolarHBondContact O-CA 3.46Å; T56-I60 WeakPolarHBondContact O-CB 3.41Å; T56-I60 PolarHBondContact O-N 3.24Å; I60-P63 VanDerWaalsContact O-CD 3.28Å; I60-P63 WeakPolarHBondContact O-CD 3.27Å; I60-P63 WeakPolarHBondContact O-CG 3.4Å; I60-T64 HydrophobicContact CG2-CG2 4.34Å; I60-T64 WeakPolarHBondContact O-CB 3.49Å; I60-T64 WeakPolarHBondContact O-CG2 3.37Å; I60-T64 PolarHBondContact O-N 3.42Å; I60-T64 PolarHBondContact O-OG1 3.49Å |
| 61 | L | 82.2 | Confident | 83.1 | Confident | 58 Ų | 58 | 65.8 Ų | 65.8 | 30% | 0.304 | 34% | 0.343 | S | S | . | . | I | π-helix | trans | -68.3 | -42.3 | -175.6 | -96.1 | 57.5 | 0 | 0 | 0 | 112.7 | L20 T56 T57 T64 I65 | L20-L61 HydrophobicContact CD1-CB 4.43Å; L20-L61 HydrophobicContact CD2-CB 3.93Å; L20-L61 HydrophobicContact CD2-CD2 3.63Å; L20-L61 HydrophobicContact CD2-CG 4.14Å; T56-L61 HydrophobicContact CG2-CD1 4.34Å; T56-L61 PolarHBondContact O-N 3.48Å; T56-L61 VanDerWaalsContact O-N 3.1Å; T57-L61 WeakPolarHBondContact O-CB 3.45Å; T57-L61 PolarHBondContact O-N 3.31Å; L61-T64 VanDerWaalsContact CA-OG1 3.31Å; L61-T64 WeakPolarHBondContact CA-OG1 3.22Å; L61-T64 PolarHBondContact O-N 2.88Å; L61-T64 PolarHBondContact O-OG1 3.49Å; L61-I65 WeakPolarHBondContact O-CB 3.26Å; L61-I65 WeakPolarHBondContact O-CG1 3.44Å; L61-I65 PolarHBondContact O-N 2.96Å |
| 62 | M | 82.3 | Confident | 82.3 | Confident | 76 Ų | 76 | 69.8 Ų | 69.8 | 37% | 0.374 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -55.8 | -53.4 | 177.1 | -91 | -171 | 174.6 | 0 | 0 | 113.6 | T57 S66 | T57-M62 PolarHBondContact O-N 3.18Å; M62-S66 WeakPolarHBondContact O-CB 3.25Å; M62-S66 PolarHBondContact O-N 2.88Å |
| 63 | P | 78.2 | Confident | 81.3 | Confident | 50 Ų | 50 | 69.9 Ų | 69.9 | 33% | 0.325 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -69.2 | -36.2 | 179.7 | 23.8 | -32.1 | 0 | 0 | 0 | 113 | L59 I60 S66 L67 | L59-P63 WeakPolarHBondContact O-CG 3.36Å; I60-P63 VanDerWaalsContact O-CD 3.28Å; I60-P63 WeakPolarHBondContact O-CD 3.27Å; I60-P63 WeakPolarHBondContact O-CG 3.4Å; P63-S66 PolarHBondContact O-N 2.95Å; P63-L67 PolarHBondContact O-N 3.34Å |
| 64 | T | 82.3 | Confident | 79.9 | Confident | 62 Ų | 62 | 74.8 Ų | 74.8 | 38% | 0.38 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -67.5 | -47.3 | -179.1 | 51.5 | 0 | 0 | 0 | 0 | 112.1 | I60 L61 S66 L67 I68 | I60-T64 HydrophobicContact CG2-CG2 4.34Å; I60-T64 WeakPolarHBondContact O-CB 3.49Å; I60-T64 WeakPolarHBondContact O-CG2 3.37Å; I60-T64 PolarHBondContact O-N 3.42Å; I60-T64 PolarHBondContact O-OG1 3.49Å; L61-T64 VanDerWaalsContact CA-OG1 3.31Å; L61-T64 WeakPolarHBondContact CA-OG1 3.22Å; L61-T64 PolarHBondContact O-N 2.88Å; L61-T64 PolarHBondContact O-OG1 3.49Å; T64-S66 PolarHBondContact O-N 3.48Å; T64-L67 WeakPolarHBondContact O-CB 3.47Å; T64-L67 PolarHBondContact O-N 3.3Å; T64-L67 VanDerWaalsContact O-N 3.15Å; T64-I68 VanDerWaalsContact O-CG1 3.3Å; T64-I68 WeakPolarHBondContact O-CG1 3.25Å; T64-I68 PolarHBondContact O-N 2.93Å |
| 65 | I | 81.8 | Confident | 78.4 | Confident | 30 Ų | 30 | 78.9 Ų | 78.9 | 15% | 0.154 | 39% | 0.387 | C | S | . | . | H | α-helix | trans | -67.2 | -33.7 | 175.5 | -67.7 | -121.2 | 0 | 0 | 0 | 110.4 | L16 L20 L61 L67 I68 E69 | L16-I65 HydrophobicContact CB-CD1 4.29Å; L16-I65 HydrophobicContact CB-CG2 3.67Å; L20-I65 HydrophobicContact CD1-CB 3.5Å; L20-I65 VanDerWaalsContact CD1-CB 3.5Å; L20-I65 HydrophobicContact CD1-CD1 3.91Å; L20-I65 HydrophobicContact CD1-CG1 3.6Å; L20-I65 HydrophobicContact CD1-CG2 3.66Å; L20-I65 HydrophobicContact CG-CD1 4.45Å; L61-I65 WeakPolarHBondContact O-CB 3.26Å; L61-I65 WeakPolarHBondContact O-CG1 3.44Å; L61-I65 PolarHBondContact O-N 2.96Å; I65-L67 VanDerWaalsContact C-N 3.27Å; I65-L67 PolarHBondContact O-N 2.93Å; I65-I68 PolarHBondContact O-N 3.12Å; I65-E69 WeakPolarHBondContact O-CB 3.46Å; I65-E69 PolarHBondContact O-N 2.91Å |
| 66 | S | 75.6 | Confident | 76.3 | Confident | 10 Ų | 10 | 82 Ų | 82 | 7% | 0.07 | 42% | 0.417 | C | S | . | . | H | α-helix | trans | -60.7 | -39.8 | 173.5 | -171.6 | 0 | 0 | 0 | 0 | 112.2 | R14 M62 P63 T64 N70 | R14-S66 PolarHBondContact NH1-OG 2.94Å; R14-S66 PolarHBondContact NH2-O 3.23Å; R14-S66 PolarHBondContact NH2-OG 2.74Å; M62-S66 WeakPolarHBondContact O-CB 3.25Å; M62-S66 PolarHBondContact O-N 2.88Å; P63-S66 PolarHBondContact O-N 2.95Å; T64-S66 PolarHBondContact O-N 3.48Å; S66-N70 WeakPolarHBondContact O-CB 3.33Å; S66-N70 PolarHBondContact O-N 3.47Å; S66-N70 PolarHBondContact O-ND2 2.98Å; S66-N70 PolarHBondContact O-OD1 3.2Å |
| 67 | L | 77.9 | Confident | 75.7 | Confident | 103 Ų | 103 | 83.6 Ų | 83.6 | 54% | 0.539 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -70 | -41.9 | 176.2 | -170.2 | 79.4 | 0 | 0 | 0 | 112.4 | P63 T64 I65 N70 K71 | P63-L67 PolarHBondContact O-N 3.34Å; T64-L67 WeakPolarHBondContact O-CB 3.47Å; T64-L67 PolarHBondContact O-N 3.3Å; T64-L67 VanDerWaalsContact O-N 3.15Å; I65-L67 VanDerWaalsContact C-N 3.27Å; I65-L67 PolarHBondContact O-N 2.93Å; L67-N70 PolarHBondContact O-N 3.5Å; L67-K71 WeakPolarHBondContact O-CG 3.28Å; L67-K71 PolarHBondContact O-N 3.3Å |
| 68 | I | 81 | Confident | 75.1 | Confident | 81 Ų | 81 | 87.7 Ų | 87.7 | 42% | 0.415 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -62.3 | -48.7 | -179.7 | -69.6 | 163.8 | 0 | 0 | 0 | 110.4 | T64 I65 N70 K71 M72 | T64-I68 VanDerWaalsContact O-CG1 3.3Å; T64-I68 WeakPolarHBondContact O-CG1 3.25Å; T64-I68 PolarHBondContact O-N 2.93Å; I65-I68 PolarHBondContact O-N 3.12Å; I68-N70 VanDerWaalsContact C-N 3.34Å; I68-N70 PolarHBondContact O-N 3.49Å; I68-K71 PolarHBondContact O-N 3.36Å; I68-M72 HydrophobicContact CG2-CG 4.46Å; I68-M72 HydrophobicContact CG2-SD 4.13Å; I68-M72 WeakPolarHBondContact O-CG 3.41Å; I68-M72 PolarHBondContact O-N 3.49Å |
| 69 | E | 75.3 | Confident | 74.6 | Confident | 9 Ų | 9 | 90.4 Ų | 90.4 | 4% | 0.042 | 46% | 0.457 | C | S | . | . | H | α-helix | trans | -65.3 | -36.9 | 178.4 | -82.7 | 178.3 | 144.9 | 0 | 0 | 111.9 | R14 L16 S17 I65 K71 M72 L73 | R14-E69 VanDerWaalsContact CA-OE1 3.23Å; R14-E69 WeakPolarHBondContact CA-OE1 3.45Å; R14-E69 VanDerWaalsContact CB-OE1 3.32Å; R14-E69 WeakPolarHBondContact CB-OE1 3.47Å; R14-E69 WeakPolarHBondContact CB-OE2 3.48Å; R14-E69 IonicContact CZ-OE2 3.16Å; R14-E69 IonicContact NE-OE2 2.65Å; R14-E69 PolarHBondContact NE-OE2 3.02Å; R14-E69 VanDerWaalsContact NH2-CB 3.25Å; R14-E69 IonicContact NH2-OE2 3.17Å; R14-E69 PolarHBondContact NH2-OE2 3.17Å; L16-E69 WeakPolarHBondContact CA-OE1 3.38Å; L16-E69 HydrophobicContact CB-CG 4.13Å; L16-E69 VanDerWaalsContact CB-OE1 3.29Å; L16-E69 WeakPolarHBondContact CB-OE1 3.47Å; L16-E69 HydrophobicContact CD1-CG 3.92Å; L16-E69 HydrophobicContact CG-CG 4.44Å; L16-E69 PolarHBondContact N-OE1 3.31Å; S17-E69 PolarHBondContact N-OE1 2.79Å; S17-E69 VanDerWaalsContact N-OE1 3.17Å; S17-E69 PolarHBondContact OG-OE2 2.92Å; I65-E69 WeakPolarHBondContact O-CB 3.46Å; I65-E69 PolarHBondContact O-N 2.91Å; E69-K71 VanDerWaalsContact C-N 3.34Å; E69-K71 PolarHBondContact O-N 3.27Å; E69-M72 PolarHBondContact O-N 2.96Å; E69-L73 WeakPolarHBondContact O-CB 3.5Å; E69-L73 WeakPolarHBondContact O-CG 3.41Å; E69-L73 PolarHBondContact O-N 3.47Å |
| 70 | N | 73.3 | Confident | 74.1 | Confident | 35 Ų | 35 | 89.8 Ų | 89.8 | 19% | 0.187 | 45% | 0.452 | C | S | . | . | H | α-helix | trans | -60.6 | -43.3 | 172.9 | -72.2 | -10.2 | 0 | 0 | 0 | 111.5 | S66 L67 I68 L73 K74 W75 | S66-N70 WeakPolarHBondContact O-CB 3.33Å; S66-N70 PolarHBondContact O-N 3.47Å; S66-N70 PolarHBondContact O-ND2 2.98Å; S66-N70 PolarHBondContact O-OD1 3.2Å; L67-N70 PolarHBondContact O-N 3.5Å; I68-N70 VanDerWaalsContact C-N 3.34Å; I68-N70 PolarHBondContact O-N 3.49Å; N70-L73 PolarHBondContact O-N 3.41Å; N70-K74 PolarHBondContact O-N 2.75Å; N70-W75 PolarHBondContact O-N 3.39Å |
| 71 | K | 74.9 | Confident | 73.4 | Confident | 150 Ų | 150 | 89.4 Ų | 89.4 | 65% | 0.652 | 45% | 0.45 | S | S | * | . | H | α-helix | trans | -65.1 | -41.1 | 175.9 | -75.3 | 176.8 | 178.3 | -74.5 | 0 | 112.1 | L67 I68 E69 L73 K74 | L67-K71 WeakPolarHBondContact O-CG 3.28Å; L67-K71 PolarHBondContact O-N 3.3Å; I68-K71 PolarHBondContact O-N 3.36Å; E69-K71 VanDerWaalsContact C-N 3.34Å; E69-K71 PolarHBondContact O-N 3.27Å; K71-L73 VanDerWaalsContact C-N 3.33Å; K71-L73 PolarHBondContact O-N 3.48Å; K71-K74 PolarHBondContact O-N 3.27Å |
| 72 | M | 71.9 | Confident | 72.9 | Confident | 136 Ų | 136 | 91.5 Ų | 91.5 | 67% | 0.67 | 46% | 0.459 | S | S | * | . | H | α-helix | trans | -64.1 | -38.2 | 177.6 | -73.9 | -179.2 | 67.9 | 0 | 0 | 112.3 | L16 I68 E69 K74 | L16-M72 HydrophobicContact CD1-SD 4.35Å; I68-M72 HydrophobicContact CG2-CG 4.46Å; I68-M72 HydrophobicContact CG2-SD 4.13Å; I68-M72 WeakPolarHBondContact O-CG 3.41Å; I68-M72 PolarHBondContact O-N 3.49Å; E69-M72 PolarHBondContact O-N 2.96Å; M72-K74 PolarHBondContact O-N 2.95Å |
| 73 | L | 72.6 | Confident | 72.2 | Confident | 96 Ų | 96 | 92.6 Ų | 92.6 | 50% | 0.503 | 47% | 0.466 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -79.9 | 5.3 | 178.9 | -68.5 | 169.8 | 0 | 0 | 0 | 113.5 | E69 N70 K71 W75 | E69-L73 WeakPolarHBondContact O-CB 3.5Å; E69-L73 WeakPolarHBondContact O-CG 3.41Å; E69-L73 PolarHBondContact O-N 3.47Å; N70-L73 PolarHBondContact O-N 3.41Å; K71-L73 VanDerWaalsContact C-N 3.33Å; K71-L73 PolarHBondContact O-N 3.48Å; L73-W75 PolarHBondContact O-N 3.44Å; L73-W75 VanDerWaalsContact O-N 3.07Å |
| 74 | K | 60.8 | Low | 71.7 | Confident | 187 Ų | 187 | 95.8 Ų | 95.8 | 81% | 0.813 | 48% | 0.476 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 50.1 | 30.4 | 179.9 | -67.6 | -175.2 | 178.9 | 179.5 | 0 | 114.1 | N70 K71 M72 T76 | N70-K74 PolarHBondContact O-N 2.75Å; K71-K74 PolarHBondContact O-N 3.27Å; M72-K74 PolarHBondContact O-N 2.95Å; K74-T76 PolarHBondContact O-N 2.93Å |
| 75 | W | 58.4 | Low | 70.9 | Confident | 154 Ų | 154 | 98.7 Ų | 98.7 | 58% | 0.583 | 48% | 0.484 | S | S | * | . | trans | -86 | 105.5 | 163.5 | -90.3 | 13.5 | 0 | 0 | 0 | 107.6 | K7 Q8 N70 L73 | K7-W75 HydrophobicContact CB-CE3 4.21Å; K7-W75 HydrophobicContact CB-CZ3 3.95Å; K7-W75 HydrophobicContact CD-CE3 4.15Å; K7-W75 HydrophobicContact CD-CZ3 4.34Å; Q8-W75 HydrophobicContact CG-CZ3 4.46Å; N70-W75 PolarHBondContact O-N 3.39Å; L73-W75 PolarHBondContact O-N 3.44Å; L73-W75 VanDerWaalsContact O-N 3.07Å | ||
| 76 | T | 46.7 | Very low | 69.9 | Low | 193 Ų | 193 | 104.9 Ų | 104.9 | 100% | 1.184 | 51% | 0.514 | S | S | * | . | trans | -49.1 | 0 | 165.4 | 37.3 | 0 | 0 | 0 | 0 | 112.2 | K74 | K74-T76 PolarHBondContact O-N 2.93Š|
Retrieved 76 of 76 residues in 74.3 ms
(Link to these results)