| 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 | 50.8 | Low | 49.2 | Very low | 148 Ų | 148 | 124.5 Ų | 124.5 | 96% | 0.961 | 64% | 0.638 | S | S | * | * | 0 | -48.8 | 0 | -9 | 27.9 | 0 | 0 | 0 | 114.1 | |||||
| 2 | I | 54.4 | Low | 49 | Very low | 161 Ų | 161 | 126 Ų | 126 | 83% | 0.826 | 64% | 0.644 | S | S | * | * | trans | -84.3 | -26.2 | -178.1 | -67.6 | 161.9 | 0 | 0 | 0 | 113.1 | ||||
| 3 | L | 46.2 | Very low | 49.2 | Very low | 127 Ų | 127 | 127.2 Ų | 127.2 | 67% | 0.665 | 64% | 0.642 | S | S | * | * | S | Bend | trans | -92.6 | 4.1 | 176.6 | -72.9 | 168.8 | 0 | 0 | 0 | 114.3 | M5 I58 | L3-M5 PolarHBondContact O-N 3.31Å; L3-I58 HydrophobicContact CD1-CG2 4.49Å |
| 4 | H | 43.7 | Very low | 50.2 | Low | 149 Ų | 149 | 118.9 Ų | 118.9 | 69% | 0.69 | 60% | 0.599 | S | S | * | * | trans | -78.7 | 92.4 | 176.1 | -82.5 | -76.4 | 0 | 0 | 0 | 110.4 | ||||
| 5 | M | 57 | Low | 51.3 | Low | 147 Ų | 147 | 117.3 Ų | 117.3 | 72% | 0.724 | 60% | 0.601 | S | S | * | * | trans | -92 | 4.4 | 171.6 | -68.2 | -77.3 | 174.4 | 0 | 0 | 112.9 | L3 | L3-M5 PolarHBondContact O-N 3.31Š| ||
| 6 | S | 43.7 | Very low | 52.5 | Low | 34 Ų | 34 | 114.6 Ų | 114.6 | 24% | 0.238 | 59% | 0.587 | C | S | . | * | trans | -93.6 | 127.7 | -178 | 174.6 | 0 | 0 | 0 | 0 | 111.9 | Q8 R14 | S6-Q8 PolarHBondContact O-N 3.27Å; S6-Q8 PolarHBondContact OG-N 3.11Å; S6-Q8 PolarHBondContact OG-O 2.93Å; S6-R14 PolarHBondContact OG-NH1 2.99Å | ||
| 7 | K | 53.1 | Low | 53.7 | Low | 191 Ų | 191 | 108.7 Ų | 108.7 | 83% | 0.83 | 56% | 0.559 | S | S | * | * | S | Bend | trans | -72 | -9.8 | 171.6 | -86.6 | -168.7 | 178.1 | -179.7 | 0 | 114.3 | ||
| 8 | Q | 42.5 | Very low | 54.9 | Low | 58 Ų | 58 | 107.2 Ų | 107.2 | 27% | 0.271 | 55% | 0.549 | S | S | . | . | trans | -107.8 | 128.4 | 173.9 | -81.3 | 177.3 | -49.1 | 0 | 0 | 110.7 | S6 S10 W75 | S6-Q8 PolarHBondContact O-N 3.27Å; S6-Q8 PolarHBondContact OG-N 3.11Å; S6-Q8 PolarHBondContact OG-O 2.93Å; Q8-S10 VanDerWaalsContact C-N 3.32Å; Q8-W75 HydrophobicContact CG-CH2 4.2Å; Q8-W75 HydrophobicContact CG-CZ3 3.95Å | ||
| 9 | Q | 51 | Low | 56.3 | Low | 208 Ų | 208 | 105.1 Ų | 105.1 | 97% | 0.972 | 55% | 0.545 | S | S | * | . | S | Bend | trans | -78.6 | -14.8 | 179.1 | -166.1 | 170.4 | -10.6 | 0 | 0 | 112.8 | ||
| 10 | S | 45.7 | Very low | 57.6 | Low | 61 Ų | 61 | 100.7 Ų | 100.7 | 43% | 0.427 | 52% | 0.522 | S | S | . | . | trans | -111.3 | 127.3 | -177.7 | -177.9 | 0 | 0 | 0 | 0 | 111.8 | Q8 M12 | Q8-S10 VanDerWaalsContact C-N 3.32Å; S10-M12 PolarHBondContact O-N 3.28Å; S10-M12 VanDerWaalsContact OG-CB 3.25Å; S10-M12 WeakPolarHBondContact OG-CB 3.44Å; S10-M12 PolarHBondContact OG-N 2.94Å | ||
| 11 | M | 53.6 | Low | 58.8 | Low | 85 Ų | 85 | 101.7 Ų | 101.7 | 42% | 0.419 | 52% | 0.52 | S | S | . | . | G | 310 helix | trans | -71.7 | 1.5 | 172.7 | -123.8 | 170.3 | -162.4 | 0 | 0 | 112.9 | F13 Q18 Y21 | M11-F13 VanDerWaalsContact C-N 3.35Å; M11-F13 PolarHBondContact O-N 3.26Å; M11-Q18 WeakPolarHBondContact O-CG 3.37Å; M11-Q18 PolarHBondContact O-NE2 2.88Å; M11-Y21 HydrophobicContact CE-CD2 4.47Å; M11-Y21 HydrophobicContact SD-CD2 4.48Å; M11-Y21 HydrophobicContact SD-CG 4.38Å |
| 12 | M | 46.8 | Very low | 60.4 | Low | 143 Ų | 143 | 103.4 Ų | 103.4 | 70% | 0.704 | 51% | 0.507 | S | S | * | . | G | 310 helix | trans | -73.2 | -21 | -170.2 | -160.6 | 173.1 | -174.7 | 0 | 0 | 114.2 | S10 | S10-M12 PolarHBondContact O-N 3.28Å; S10-M12 VanDerWaalsContact OG-CB 3.25Å; S10-M12 WeakPolarHBondContact OG-CB 3.44Å; S10-M12 PolarHBondContact OG-N 2.94Å |
| 13 | F | 51 | Low | 61.9 | Low | 142 Ų | 142 | 99.8 Ų | 99.8 | 62% | 0.623 | 49% | 0.489 | S | S | * | . | G | 310 helix | trans | -109.1 | 19 | -177.7 | -66.4 | -74.6 | 0 | 0 | 0 | 114.2 | M11 | M11-F13 VanDerWaalsContact C-N 3.35Å; M11-F13 PolarHBondContact O-N 3.26Å |
| 14 | R | 62.9 | Low | 63.9 | Low | 10 Ų | 10 | 94.7 Ų | 94.7 | 4% | 0.038 | 46% | 0.463 | C | S | . | . | trans | -133.9 | 80.3 | -169.3 | -65.5 | -176.7 | 69.4 | 139.9 | 30.9 | 111.5 | S6 L16 S17 Q18 S66 E69 | S6-R14 PolarHBondContact OG-NH1 2.99Å; R14-L16 PolarHBondContact O-N 2.73Å; R14-S17 PolarHBondContact NE-OG 2.97Å; R14-S17 PolarHBondContact O-N 3.33Å; R14-Q18 PolarHBondContact O-N 3.01Å; R14-S66 PolarHBondContact NH2-O 2.94Å; R14-E69 WeakPolarHBondContact CA-OE1 3.25Å; R14-E69 VanDerWaalsContact CB-OE1 3.29Å; R14-E69 WeakPolarHBondContact CB-OE1 3.46Å; R14-E69 WeakPolarHBondContact CB-OE2 3.29Å; R14-E69 IonicContact CZ-OE2 3.17Å; R14-E69 IonicContact NE-OE2 2.68Å; R14-E69 PolarHBondContact NE-OE2 3.46Å; R14-E69 IonicContact NH2-OE2 2.81Å; R14-E69 PolarHBondContact NH2-OE2 3.4Å | ||
| 15 | P | 66.5 | Low | 66.1 | Low | 96 Ų | 96 | 89 Ų | 89 | 62% | 0.623 | 44% | 0.441 | S | S | * | . | H | α-helix | trans | -61.8 | -30.4 | -173.7 | 24.2 | -32.9 | 0 | 0 | 0 | 112.9 | S19 | P15-S19 PolarHBondContact O-N 3.2Å; P15-S19 VanDerWaalsContact O-N 3.14Å |
| 16 | L | 71 | Confident | 67.8 | Low | 73 Ų | 73 | 84.2 Ų | 84.2 | 38% | 0.382 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -73.7 | -42.2 | 177 | -62.7 | 167.8 | 0 | 0 | 0 | 110.7 | R14 Q18 S19 L20 V65 E69 M72 | R14-L16 PolarHBondContact O-N 2.73Å; L16-Q18 VanDerWaalsContact C-N 3.32Å; L16-Q18 PolarHBondContact O-N 3.41Å; L16-S19 PolarHBondContact O-N 2.99Å; L16-S19 PolarHBondContact O-OG 3.25Å; L16-L20 PolarHBondContact O-N 3.34Å; L16-L20 VanDerWaalsContact O-N 3.09Å; L16-V65 HydrophobicContact CB-CG1 3.54Å; L16-E69 WeakPolarHBondContact CA-OE1 3.39Å; L16-E69 HydrophobicContact CB-CG 4.12Å; L16-E69 VanDerWaalsContact CB-OE1 3.31Å; L16-E69 WeakPolarHBondContact CB-OE1 3.29Å; L16-E69 HydrophobicContact CD1-CG 3.88Å; L16-E69 HydrophobicContact CG-CG 4.41Å; L16-E69 PolarHBondContact N-OE1 3.04Å; L16-M72 HydrophobicContact CD1-SD 4.4Å |
| 17 | S | 72.7 | Confident | 70 | Confident | 15 Ų | 15 | 83 Ų | 83 | 11% | 0.105 | 42% | 0.416 | C | S | . | . | H | α-helix | trans | -64 | -34.6 | 175 | -67.4 | 0 | 0 | 0 | 0 | 113 | R14 Y21 E69 | R14-S17 PolarHBondContact NE-OG 2.97Å; R14-S17 PolarHBondContact O-N 3.33Å; S17-Y21 PolarHBondContact O-N 3.44Å; S17-Y21 VanDerWaalsContact O-N 3.07Å; S17-E69 PolarHBondContact N-OE1 3.26Å; S17-E69 PolarHBondContact OG-OE2 2.95Å |
| 18 | Q | 75.1 | Confident | 71.8 | Confident | 81 Ų | 81 | 77.5 Ų | 77.5 | 38% | 0.379 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -65.2 | -42.5 | 172.9 | -73.9 | -178.9 | 5.7 | 0 | 0 | 112.1 | M11 R14 L16 L20 Y21 W22 | M11-Q18 WeakPolarHBondContact O-CG 3.37Å; M11-Q18 PolarHBondContact O-NE2 2.88Å; R14-Q18 PolarHBondContact O-N 3.01Å; L16-Q18 VanDerWaalsContact C-N 3.32Å; L16-Q18 PolarHBondContact O-N 3.41Å; Q18-L20 VanDerWaalsContact C-N 3.33Å; Q18-L20 PolarHBondContact O-N 3.2Å; Q18-Y21 WeakPolarHBondContact O-CB 3.18Å; Q18-Y21 PolarHBondContact O-N 3.21Å; Q18-W22 VanDerWaalsContact O-CD1 3.3Å; Q18-W22 PolarHBondContact O-N 3.35Å; Q18-W22 VanDerWaalsContact O-N 3.08Å |
| 19 | S | 81.8 | Confident | 74.2 | Confident | 68 Ų | 68 | 80.8 Ų | 80.8 | 48% | 0.476 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -62.3 | -40.4 | 177.3 | 73.7 | 0 | 0 | 0 | 0 | 112.3 | P15 L16 Y21 W22 L23 | P15-S19 PolarHBondContact O-N 3.2Å; P15-S19 VanDerWaalsContact O-N 3.14Å; L16-S19 PolarHBondContact O-N 2.99Å; L16-S19 PolarHBondContact O-OG 3.25Å; S19-Y21 VanDerWaalsContact C-N 3.34Å; S19-Y21 PolarHBondContact O-N 2.89Å; S19-W22 PolarHBondContact O-N 3.3Å; S19-L23 WeakPolarHBondContact O-CB 3.29Å; S19-L23 PolarHBondContact O-N 3.29Å |
| 20 | L | 82.4 | Confident | 76 | Confident | 16 Ų | 16 | 74.3 Ų | 74.3 | 8% | 0.084 | 39% | 0.385 | C | S | . | . | H | α-helix | trans | -65.4 | -36 | 174.8 | -82.1 | 178.4 | 0 | 0 | 0 | 112.8 | L16 Q18 L23 L24 T57 L61 V65 | L16-L20 PolarHBondContact O-N 3.34Å; L16-L20 VanDerWaalsContact O-N 3.09Å; Q18-L20 VanDerWaalsContact C-N 3.33Å; Q18-L20 PolarHBondContact O-N 3.2Å; L20-L23 PolarHBondContact O-N 2.96Å; L20-L24 PolarHBondContact O-N 2.96Å; L20-T57 HydrophobicContact CD2-CG2 4.36Å; L20-L61 HydrophobicContact CD1-CB 4.15Å; L20-L61 HydrophobicContact CD2-CB 3.89Å; L20-L61 HydrophobicContact CD2-CD2 4.2Å; L20-L61 HydrophobicContact CD2-CG 4.43Å; L20-V65 HydrophobicContact CD1-CB 3.52Å; L20-V65 HydrophobicContact CD1-CG1 3.91Å; L20-V65 HydrophobicContact CD1-CG2 3.37Å; L20-V65 HydrophobicContact CG-CG2 4.32Å |
| 21 | Y | 82.3 | Confident | 78 | Confident | 123 Ų | 123 | 73.6 Ų | 73.6 | 48% | 0.482 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -63.1 | -45.1 | 174.8 | 176.7 | -98.1 | 0 | 0 | 0 | 111.5 | M11 S17 Q18 S19 L23 L24 A25 | M11-Y21 HydrophobicContact CE-CD2 4.47Å; M11-Y21 HydrophobicContact SD-CD2 4.48Å; M11-Y21 HydrophobicContact SD-CG 4.38Å; S17-Y21 PolarHBondContact O-N 3.44Å; S17-Y21 VanDerWaalsContact O-N 3.07Å; Q18-Y21 WeakPolarHBondContact O-CB 3.18Å; Q18-Y21 PolarHBondContact O-N 3.21Å; S19-Y21 VanDerWaalsContact C-N 3.34Å; S19-Y21 PolarHBondContact O-N 2.89Å; Y21-L23 VanDerWaalsContact C-N 3.33Å; Y21-L23 PolarHBondContact O-N 3.47Å; Y21-L24 PolarHBondContact O-N 3.13Å; Y21-A25 PolarHBondContact O-N 2.66Å |
| 22 | W | 84.4 | Confident | 79.8 | Confident | 183 Ų | 183 | 74.7 Ų | 74.7 | 69% | 0.693 | 39% | 0.388 | S | S | * | . | H | α-helix | trans | -65.3 | -36 | 175.3 | -80 | 107.2 | 0 | 0 | 0 | 112.7 | Q18 S19 A25 A26 | Q18-W22 VanDerWaalsContact O-CD1 3.3Å; Q18-W22 PolarHBondContact O-N 3.35Å; Q18-W22 VanDerWaalsContact O-N 3.08Å; S19-W22 PolarHBondContact O-N 3.3Å; W22-A25 PolarHBondContact O-N 2.97Å; W22-A26 WeakPolarHBondContact O-CB 3.43Å; W22-A26 PolarHBondContact O-N 2.81Å |
| 23 | L | 86.8 | Confident | 81.8 | Confident | 86 Ų | 86 | 75.1 Ų | 75.1 | 45% | 0.45 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -62.4 | -44.6 | 173.2 | -169.3 | 150.2 | 0 | 0 | 0 | 111.3 | S19 L20 Y21 A25 A26 D27 T57 | S19-L23 WeakPolarHBondContact O-CB 3.29Å; S19-L23 PolarHBondContact O-N 3.29Å; L20-L23 PolarHBondContact O-N 2.96Å; Y21-L23 VanDerWaalsContact C-N 3.33Å; Y21-L23 PolarHBondContact O-N 3.47Å; L23-A25 PolarHBondContact O-N 3.26Å; L23-A26 PolarHBondContact O-N 2.68Å; L23-D27 WeakPolarHBondContact O-CB 3.46Å; L23-D27 PolarHBondContact O-N 2.71Å; L23-T57 HydrophobicContact CD2-CG2 4.21Å |
| 24 | L | 88.8 | Confident | 83.7 | Confident | 20 Ų | 20 | 69.3 Ų | 69.3 | 11% | 0.105 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -62.6 | -41.3 | 174.8 | -170 | 83.3 | 0 | 0 | 0 | 112 | L20 Y21 A26 D27 L28 Y54 T57 I58 M62 | L20-L24 PolarHBondContact O-N 2.96Å; Y21-L24 PolarHBondContact O-N 3.13Å; L24-A26 VanDerWaalsContact C-N 3.35Å; L24-D27 PolarHBondContact O-N 2.97Å; L24-L28 WeakPolarHBondContact O-CG 3.11Å; L24-L28 PolarHBondContact O-N 3.07Å; L24-Y54 HydrophobicContact CD1-CD2 3.9Å; L24-Y54 HydrophobicContact CD1-CE2 3.88Å; L24-Y54 HydrophobicContact CG-CE2 4.45Å; L24-T57 HydrophobicContact CB-CG2 4.43Å; L24-T57 HydrophobicContact CD1-CG2 3.96Å; L24-I58 HydrophobicContact CD1-CD1 3.94Å; L24-I58 HydrophobicContact CD1-CG1 3.63Å; L24-I58 HydrophobicContact CD2-CG1 4.49Å; L24-M62 HydrophobicContact CD2-CE 4.34Å |
| 25 | A | 89.7 | Confident | 84.9 | Confident | 28 Ų | 28 | 72.2 Ų | 72.2 | 23% | 0.231 | 39% | 0.39 | C | S | . | . | H | α-helix | trans | -63 | -41.9 | 177 | 0 | 0 | 0 | 0 | 0 | 111.6 | Y21 W22 L23 L28 L29 | Y21-A25 PolarHBondContact O-N 2.66Å; W22-A25 PolarHBondContact O-N 2.97Å; L23-A25 PolarHBondContact O-N 3.26Å; A25-L28 PolarHBondContact O-N 3.43Å; A25-L29 WeakPolarHBondContact O-CG 3.38Å; A25-L29 PolarHBondContact O-N 2.65Å; A25-L29 VanDerWaalsContact O-N 3.13Å |
| 26 | A | 92.2 | Very high | 85.9 | Confident | 47 Ų | 47 | 70.7 Ų | 70.7 | 39% | 0.388 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -64.3 | -42.1 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | W22 L23 L24 L28 L29 I30 | W22-A26 WeakPolarHBondContact O-CB 3.43Å; W22-A26 PolarHBondContact O-N 2.81Å; L23-A26 PolarHBondContact O-N 2.68Å; L24-A26 VanDerWaalsContact C-N 3.35Å; A26-L28 PolarHBondContact O-N 3.22Å; A26-L29 WeakPolarHBondContact O-CB 3.36Å; A26-L29 PolarHBondContact O-N 3.18Å; A26-I30 WeakPolarHBondContact O-CG1 3.27Å; A26-I30 PolarHBondContact O-N 3.19Å |
| 27 | D | 90.6 | Very high | 86.6 | Confident | 10 Ų | 10 | 70.4 Ų | 70.4 | 5% | 0.053 | 39% | 0.389 | C | S | . | . | H | α-helix | trans | -63.4 | -40.4 | 178 | -170.4 | 74.8 | 0 | 0 | 0 | 112.2 | L23 L24 L29 I30 L31 Y54 | L23-D27 WeakPolarHBondContact O-CB 3.46Å; L23-D27 PolarHBondContact O-N 2.71Å; L24-D27 PolarHBondContact O-N 2.97Å; D27-L29 PolarHBondContact O-N 3.4Å; D27-I30 PolarHBondContact O-N 3.49Å; D27-L31 PolarHBondContact O-N 3.41Å; D27-Y54 WeakPolarHBondContact OD2-CA 3.24Å; D27-Y54 VanDerWaalsContact OD2-CB 3.24Å; D27-Y54 WeakPolarHBondContact OD2-CB 3.48Å |
| 28 | L | 90.4 | Very high | 87.1 | Confident | 74 Ų | 74 | 73.7 Ų | 73.7 | 39% | 0.387 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -63 | -38.3 | 172.5 | -77.3 | 172.7 | 0 | 0 | 0 | 112.9 | L24 A25 A26 L31 T32 Y54 | L24-L28 WeakPolarHBondContact O-CG 3.11Å; L24-L28 PolarHBondContact O-N 3.07Å; A25-L28 PolarHBondContact O-N 3.43Å; A26-L28 PolarHBondContact O-N 3.22Å; L28-L31 PolarHBondContact O-N 3.26Å; L28-T32 WeakPolarHBondContact O-CB 3.35Å; L28-T32 PolarHBondContact O-N 2.84Å; L28-T32 PolarHBondContact O-OG1 2.97Å; L28-Y54 HydrophobicContact CD1-CE2 4.49Å; L28-Y54 HydrophobicContact CD2-CD2 4.11Å; L28-Y54 HydrophobicContact CD2-CE2 3.54Å; L28-Y54 HydrophobicContact CG-CD2 4.44Å; L28-Y54 HydrophobicContact CG-CE2 3.97Å |
| 29 | L | 93.1 | Very high | 87.4 | Confident | 128 Ų | 128 | 76.2 Ų | 76.2 | 67% | 0.67 | 43% | 0.43 | S | S | * | . | H | α-helix | trans | -64.8 | -41.5 | 174.5 | -72.3 | 171.9 | 0 | 0 | 0 | 111.2 | A25 A26 D27 T32 W33 | A25-L29 WeakPolarHBondContact O-CG 3.38Å; A25-L29 PolarHBondContact O-N 2.65Å; A25-L29 VanDerWaalsContact O-N 3.13Å; A26-L29 WeakPolarHBondContact O-CB 3.36Å; A26-L29 PolarHBondContact O-N 3.18Å; D27-L29 PolarHBondContact O-N 3.4Å; L29-T32 PolarHBondContact O-N 2.89Å; L29-W33 WeakPolarHBondContact O-CB 3.39Å; L29-W33 PolarHBondContact O-N 3.44Å |
| 30 | I | 88.7 | Confident | 87.4 | Confident | 72 Ų | 72 | 75.4 Ų | 75.4 | 37% | 0.369 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -63.8 | -46.2 | 176.5 | -68.1 | 165.6 | 0 | 0 | 0 | 110.8 | A26 D27 T32 W33 I34 A50 | A26-I30 WeakPolarHBondContact O-CG1 3.27Å; A26-I30 PolarHBondContact O-N 3.19Å; D27-I30 PolarHBondContact O-N 3.49Å; I30-T32 VanDerWaalsContact C-N 3.34Å; I30-T32 PolarHBondContact O-N 3.14Å; I30-W33 PolarHBondContact O-N 2.96Å; I30-I34 HydrophobicContact CG2-CD1 3.64Å; I30-I34 HydrophobicContact CG2-CG1 4.42Å; I30-I34 VanDerWaalsContact O-CG1 3.29Å; I30-I34 WeakPolarHBondContact O-CG1 3.33Å; I30-I34 PolarHBondContact O-N 3.42Å; I30-A50 HydrophobicContact CG2-CB 4.31Å |
| 31 | L | 88.3 | Confident | 87.4 | Confident | 45 Ų | 45 | 83.6 Ų | 83.6 | 24% | 0.236 | 46% | 0.456 | C | S | . | . | H | α-helix | trans | -60.8 | -42.5 | 176.5 | -81 | 162 | 0 | 0 | 0 | 112.1 | D27 L28 W33 I34 G35 A50 Y54 | D27-L31 PolarHBondContact O-N 3.41Å; L28-L31 PolarHBondContact O-N 3.26Å; L31-W33 VanDerWaalsContact C-N 3.34Å; L31-I34 PolarHBondContact O-N 2.94Å; L31-G35 PolarHBondContact O-N 3.41Å; L31-A50 HydrophobicContact CD2-CB 3.93Å; L31-A50 HydrophobicContact CG-CB 3.99Å; L31-Y54 HydrophobicContact CD1-CD2 4.25Å; L31-Y54 HydrophobicContact CD1-CG 4.28Å |
| 32 | T | 90.3 | Very high | 87.4 | Confident | 108 Ų | 108 | 80.5 Ų | 80.5 | 66% | 0.663 | 45% | 0.45 | S | S | * | . | H | α-helix | trans | -63.2 | -42.7 | 176.8 | -55.8 | 0 | 0 | 0 | 0 | 111.1 | L28 L29 I30 G35 | L28-T32 WeakPolarHBondContact O-CB 3.35Å; L28-T32 PolarHBondContact O-N 2.84Å; L28-T32 PolarHBondContact O-OG1 2.97Å; L29-T32 PolarHBondContact O-N 2.89Å; I30-T32 VanDerWaalsContact C-N 3.34Å; I30-T32 PolarHBondContact O-N 3.14Å; T32-G35 PolarHBondContact O-N 3.05Å |
| 33 | W | 89.4 | Confident | 87.5 | Confident | 152 Ų | 152 | 74.2 Ų | 74.2 | 58% | 0.576 | 43% | 0.428 | S | S | * | . | H | α-helix | trans | -64.6 | -43.7 | 177.6 | 178.5 | 52 | 0 | 0 | 0 | 112.2 | L29 I30 L31 G35 G36 | L29-W33 WeakPolarHBondContact O-CB 3.39Å; L29-W33 PolarHBondContact O-N 3.44Å; I30-W33 PolarHBondContact O-N 2.96Å; L31-W33 VanDerWaalsContact C-N 3.34Å; W33-G35 VanDerWaalsContact C-N 3.33Å; W33-G35 PolarHBondContact O-N 2.71Å; W33-G36 PolarHBondContact O-N 2.94Å |
| 34 | I | 91.1 | Very high | 87.4 | Confident | 20 Ų | 20 | 72.8 Ų | 72.8 | 10% | 0.103 | 42% | 0.423 | C | S | . | . | H | α-helix | trans | -67.4 | -34.1 | 178.6 | -68.3 | 168.1 | 0 | 0 | 0 | 111.7 | I30 L31 G36 Q37 I46 | I30-I34 HydrophobicContact CG2-CD1 3.64Å; I30-I34 HydrophobicContact CG2-CG1 4.42Å; I30-I34 VanDerWaalsContact O-CG1 3.29Å; I30-I34 WeakPolarHBondContact O-CG1 3.33Å; I30-I34 PolarHBondContact O-N 3.42Å; L31-I34 PolarHBondContact O-N 2.94Å; I34-G36 PolarHBondContact O-N 3.26Å; I34-G36 VanDerWaalsContact O-N 3.16Å; I34-Q37 PolarHBondContact O-N 3.33Å; I34-I46 HydrophobicContact CD1-CB 3.86Å; I34-I46 HydrophobicContact CD1-CG2 3.39Å; I34-I46 HydrophobicContact CG1-CG2 4.5Å |
| 35 | G | 87.4 | Confident | 87.5 | Confident | 71 Ų | 71 | 75.8 Ų | 75.8 | 73% | 0.732 | 44% | 0.438 | S | S | * | . | H | α-helix | trans | -60.4 | -22.6 | 176.1 | 0 | 0 | 0 | 0 | 0 | 114.1 | L31 T32 W33 | L31-G35 PolarHBondContact O-N 3.41Å; T32-G35 PolarHBondContact O-N 3.05Å; W33-G35 VanDerWaalsContact C-N 3.33Å; W33-G35 PolarHBondContact O-N 2.71Å |
| 36 | G | 86.8 | Confident | 87.5 | Confident | 65 Ų | 65 | 77.9 Ų | 77.9 | 67% | 0.67 | 45% | 0.445 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -93.2 | -7.2 | 174.4 | 0 | 0 | 0 | 0 | 0 | 114.9 | W33 I34 | W33-G36 PolarHBondContact O-N 2.94Å; I34-G36 PolarHBondContact O-N 3.26Å; I34-G36 VanDerWaalsContact O-N 3.16Å |
| 37 | Q | 86.3 | Confident | 87.4 | Confident | 67 Ų | 67 | 76.3 Ų | 76.3 | 31% | 0.313 | 43% | 0.433 | S | S | . | . | S | Bend | trans | -86.3 | 150.8 | 177.9 | -65.1 | -56 | -50.1 | 0 | 0 | 110.9 | I34 F43 | I34-Q37 PolarHBondContact O-N 3.33Å; Q37-F43 HydrophobicContact CB-CB 4.4Å; Q37-F43 HydrophobicContact CB-CD1 4.3Å; Q37-F43 HydrophobicContact CB-CD2 4.27Å; Q37-F43 HydrophobicContact CB-CG 4.07Å; Q37-F43 HydrophobicContact CG-CD1 4.2Å; Q37-F43 HydrophobicContact CG-CE1 4.29Å; Q37-F43 HydrophobicContact CG-CG 4.46Å |
| 38 | P | 84.3 | Confident | 87.3 | Confident | 84 Ų | 84 | 81.7 Ų | 81.7 | 55% | 0.545 | 46% | 0.458 | S | S | . | . | trans | -60.5 | 144.7 | 171.9 | 26.1 | -33.5 | 0 | 0 | 0 | 110.3 | S40 | P38-S40 PolarHBondContact O-N 3.48Š| ||
| 39 | V | 80.3 | Confident | 87.4 | Confident | 133 Ų | 133 | 82 Ų | 82 | 81% | 0.806 | 46% | 0.463 | S | S | * | . | S | Bend | trans | -75.5 | 69.6 | 177.2 | -169.2 | 0 | 0 | 0 | 0 | 109.4 | ||
| 40 | S | 82.1 | Confident | 87.3 | Confident | 51 Ų | 51 | 76.2 Ų | 76.2 | 36% | 0.357 | 43% | 0.433 | S | S | . | . | trans | -121.4 | 155.6 | 174.5 | 58.8 | 0 | 0 | 0 | 0 | 110.4 | P38 F43 T44 | P38-S40 PolarHBondContact O-N 3.48Å; S40-F43 PolarHBondContact O-N 3.23Å; S40-T44 PolarHBondContact O-N 3.14Å | ||
| 41 | Y | 82.4 | Confident | 87.4 | Confident | 189 Ų | 189 | 75 Ų | 75 | 74% | 0.741 | 43% | 0.431 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.5 | 128.6 | 167.5 | -175.5 | -90.2 | 0 | 0 | 0 | 108.5 | I45 | Y41-I45 HydrophobicContact CD2-CD1 3.99Å; Y41-I45 HydrophobicContact CE2-CD1 3.52Å |
| 42 | P | 81.5 | Confident | 87.7 | Confident | 57 Ų | 57 | 77.4 Ų | 77.4 | 37% | 0.37 | 45% | 0.448 | S | S | . | . | T | Hydrogen-bonded Turn | cis | -101.6 | -0.9 | 14.3 | 37.8 | -35.2 | 0 | 0 | 0 | 116 | T44 I45 I46 | P42-T44 VanDerWaalsContact C-N 3.28Å; P42-T44 PolarHBondContact O-N 3.42Å; P42-I45 PolarHBondContact O-N 3.22Å; P42-I45 VanDerWaalsContact O-N 3.17Å; P42-I46 PolarHBondContact O-N 2.89Å |
| 43 | F | 86.3 | Confident | 87.7 | Confident | 52 Ų | 52 | 76.3 Ų | 76.3 | 23% | 0.228 | 44% | 0.437 | C | S | . | . | H | α-helix | trans | -63.3 | -30.4 | -171.2 | -58.9 | -66.1 | 0 | 0 | 0 | 113.6 | Q37 S40 I45 I46 G47 | Q37-F43 HydrophobicContact CB-CB 4.4Å; Q37-F43 HydrophobicContact CB-CD1 4.3Å; Q37-F43 HydrophobicContact CB-CD2 4.27Å; Q37-F43 HydrophobicContact CB-CG 4.07Å; Q37-F43 HydrophobicContact CG-CD1 4.2Å; Q37-F43 HydrophobicContact CG-CE1 4.29Å; Q37-F43 HydrophobicContact CG-CG 4.46Å; S40-F43 PolarHBondContact O-N 3.23Å; F43-I45 VanDerWaalsContact C-N 3.34Å; F43-I45 PolarHBondContact O-N 2.92Å; F43-I46 PolarHBondContact O-N 3.39Å; F43-G47 PolarHBondContact O-N 2.7Å |
| 44 | T | 86.5 | Confident | 87.7 | Confident | 55 Ų | 55 | 72.3 Ų | 72.3 | 34% | 0.337 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -59.6 | -42.1 | 175.5 | -49.4 | 0 | 0 | 0 | 0 | 112.5 | S40 P42 G47 Q48 | S40-T44 PolarHBondContact O-N 3.14Å; P42-T44 VanDerWaalsContact C-N 3.28Å; P42-T44 PolarHBondContact O-N 3.42Å; T44-G47 PolarHBondContact O-N 3.29Å; T44-Q48 WeakPolarHBondContact O-CG 3.46Å; T44-Q48 PolarHBondContact O-N 2.93Å; T44-Q48 VanDerWaalsContact O-N 3.08Å |
| 45 | I | 90.1 | Very high | 87.6 | Confident | 83 Ų | 83 | 77.4 Ų | 77.4 | 43% | 0.426 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -70.7 | -41.7 | -179.5 | -66.2 | 175.7 | 0 | 0 | 0 | 110 | Y41 P42 F43 G47 Q48 V49 | Y41-I45 HydrophobicContact CD2-CD1 3.99Å; Y41-I45 HydrophobicContact CE2-CD1 3.52Å; P42-I45 PolarHBondContact O-N 3.22Å; P42-I45 VanDerWaalsContact O-N 3.17Å; F43-I45 VanDerWaalsContact C-N 3.34Å; F43-I45 PolarHBondContact O-N 2.92Å; I45-G47 VanDerWaalsContact C-N 3.3Å; I45-G47 PolarHBondContact O-N 2.86Å; I45-Q48 PolarHBondContact O-N 3.28Å; I45-V49 HydrophobicContact CG2-CG2 4.33Å; I45-V49 WeakPolarHBondContact O-CG2 3.49Å; I45-V49 PolarHBondContact O-N 3.47Å |
| 46 | I | 89.1 | Confident | 87.8 | Confident | 73 Ų | 73 | 76.5 Ų | 76.5 | 37% | 0.374 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -62.4 | -41.8 | 178.3 | -52.8 | 172.8 | 0 | 0 | 0 | 109.8 | I34 P42 F43 Q48 V49 A50 | I34-I46 HydrophobicContact CD1-CB 3.86Å; I34-I46 HydrophobicContact CD1-CG2 3.39Å; I34-I46 HydrophobicContact CG1-CG2 4.5Å; P42-I46 PolarHBondContact O-N 2.89Å; F43-I46 PolarHBondContact O-N 3.39Å; I46-Q48 PolarHBondContact O-N 3.22Å; I46-V49 PolarHBondContact O-N 3.22Å; I46-A50 VanDerWaalsContact O-CB 3.25Å; I46-A50 WeakPolarHBondContact O-CB 3.45Å; I46-A50 PolarHBondContact O-N 3.09Å |
| 47 | G | 89.9 | Confident | 87.7 | Confident | 13 Ų | 13 | 73.4 Ų | 73.4 | 13% | 0.134 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -63.5 | -39.3 | 176.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | F43 T44 I45 S51 | F43-G47 PolarHBondContact O-N 2.7Å; T44-G47 PolarHBondContact O-N 3.29Å; I45-G47 VanDerWaalsContact C-N 3.3Å; I45-G47 PolarHBondContact O-N 2.86Å; G47-S51 WeakPolarHBondContact O-CB 3.42Å; G47-S51 PolarHBondContact O-N 3.08Å; G47-S51 PolarHBondContact O-OG 2.98Å |
| 48 | Q | 89.4 | Confident | 87.6 | Confident | 123 Ų | 123 | 72.1 Ų | 72.1 | 58% | 0.575 | 39% | 0.387 | S | S | * | . | H | α-helix | trans | -65.2 | -47.5 | 175.2 | -74.7 | 176 | -3.1 | 0 | 0 | 111.8 | T44 I45 I46 S51 V52 | T44-Q48 WeakPolarHBondContact O-CG 3.46Å; T44-Q48 PolarHBondContact O-N 2.93Å; T44-Q48 VanDerWaalsContact O-N 3.08Å; I45-Q48 PolarHBondContact O-N 3.28Å; I46-Q48 PolarHBondContact O-N 3.22Å; Q48-S51 PolarHBondContact O-N 3.42Å; Q48-V52 WeakPolarHBondContact O-CG2 3.18Å; Q48-V52 PolarHBondContact O-N 3.22Å |
| 49 | V | 92.9 | Very high | 87.6 | Confident | 82 Ų | 82 | 73 Ų | 73 | 50% | 0.497 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -63.1 | -44.3 | 178.5 | 173.3 | 0 | 0 | 0 | 0 | 110.9 | I45 I46 S51 V52 L53 | I45-V49 HydrophobicContact CG2-CG2 4.33Å; I45-V49 WeakPolarHBondContact O-CG2 3.49Å; I45-V49 PolarHBondContact O-N 3.47Å; I46-V49 PolarHBondContact O-N 3.22Å; V49-S51 VanDerWaalsContact C-N 3.35Å; V49-S51 PolarHBondContact O-N 3.07Å; V49-V52 PolarHBondContact O-N 3.36Å; V49-L53 HydrophobicContact CG1-CD1 4.02Å; V49-L53 WeakPolarHBondContact O-CB 3.21Å; V49-L53 WeakPolarHBondContact O-CG 3.31Å; V49-L53 PolarHBondContact O-N 3.45Å |
| 50 | A | 90.8 | Very high | 87.8 | Confident | 5 Ų | 5 | 71.4 Ų | 71.4 | 4% | 0.041 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -61.3 | -42.1 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | I30 L31 I46 V52 L53 Y54 | I30-A50 HydrophobicContact CG2-CB 4.31Å; L31-A50 HydrophobicContact CD2-CB 3.93Å; L31-A50 HydrophobicContact CG-CB 3.99Å; I46-A50 VanDerWaalsContact O-CB 3.25Å; I46-A50 WeakPolarHBondContact O-CB 3.45Å; I46-A50 PolarHBondContact O-N 3.09Å; A50-V52 PolarHBondContact O-N 3.29Å; A50-L53 WeakPolarHBondContact O-CB 3.29Å; A50-L53 PolarHBondContact O-N 2.87Å; A50-Y54 WeakPolarHBondContact O-CB 3.29Å; A50-Y54 PolarHBondContact O-N 3.4Å |
| 51 | S | 90.7 | Very high | 87.8 | Confident | 48 Ų | 48 | 72 Ų | 72 | 34% | 0.336 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -63.2 | -41.9 | 176.5 | -58.6 | 0 | 0 | 0 | 0 | 112.2 | G47 Q48 V49 L53 Y54 F55 | G47-S51 WeakPolarHBondContact O-CB 3.42Å; G47-S51 PolarHBondContact O-N 3.08Å; G47-S51 PolarHBondContact O-OG 2.98Å; Q48-S51 PolarHBondContact O-N 3.42Å; V49-S51 VanDerWaalsContact C-N 3.35Å; V49-S51 PolarHBondContact O-N 3.07Å; S51-L53 VanDerWaalsContact C-N 3.34Å; S51-Y54 WeakPolarHBondContact O-CB 3.5Å; S51-Y54 PolarHBondContact O-N 3.08Å; S51-F55 VanDerWaalsContact O-CD2 3.27Å; S51-F55 WeakPolarHBondContact O-CD2 3.48Å; S51-F55 PolarHBondContact O-N 3Å |
| 52 | V | 94.2 | Very high | 87.8 | Confident | 95 Ų | 95 | 66.4 Ų | 66.4 | 58% | 0.576 | 35% | 0.353 | S | S | * | . | H | α-helix | trans | -63.9 | -41.9 | 175.2 | 171.9 | 0 | 0 | 0 | 0 | 110.8 | Q48 V49 A50 T56 | Q48-V52 WeakPolarHBondContact O-CG2 3.18Å; Q48-V52 PolarHBondContact O-N 3.22Å; V49-V52 PolarHBondContact O-N 3.36Å; A50-V52 PolarHBondContact O-N 3.29Å; V52-T56 VanDerWaalsContact O-CB 3.24Å; V52-T56 WeakPolarHBondContact O-CB 3.45Å; V52-T56 PolarHBondContact O-N 3.43Å; V52-T56 PolarHBondContact O-OG1 2.94Å |
| 53 | L | 90.4 | Very high | 87.7 | Confident | 85 Ų | 85 | 66 Ų | 66 | 45% | 0.445 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -62 | -43.6 | 175.6 | -80.1 | 169.9 | 0 | 0 | 0 | 111.9 | V49 A50 S51 T56 T57 | V49-L53 HydrophobicContact CG1-CD1 4.02Å; V49-L53 WeakPolarHBondContact O-CB 3.21Å; V49-L53 WeakPolarHBondContact O-CG 3.31Å; V49-L53 PolarHBondContact O-N 3.45Å; A50-L53 WeakPolarHBondContact O-CB 3.29Å; A50-L53 PolarHBondContact O-N 2.87Å; S51-L53 VanDerWaalsContact C-N 3.34Å; L53-T56 PolarHBondContact O-N 2.77Å; L53-T57 VanDerWaalsContact O-CB 3.27Å; L53-T57 WeakPolarHBondContact O-CB 3.4Å; L53-T57 PolarHBondContact O-N 3.19Å; L53-T57 PolarHBondContact O-OG1 3.49Å |
| 54 | Y | 90.1 | Very high | 87.5 | Confident | 68 Ų | 68 | 66.2 Ų | 66.2 | 27% | 0.267 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -54.7 | -55.7 | 176.4 | -176.9 | -102.9 | 0 | 0 | 0 | 112 | L24 D27 L28 L31 A50 S51 T56 T57 I58 | L24-Y54 HydrophobicContact CD1-CD2 3.9Å; L24-Y54 HydrophobicContact CD1-CE2 3.88Å; L24-Y54 HydrophobicContact CG-CE2 4.45Å; D27-Y54 WeakPolarHBondContact OD2-CA 3.24Å; D27-Y54 VanDerWaalsContact OD2-CB 3.24Å; D27-Y54 WeakPolarHBondContact OD2-CB 3.48Å; L28-Y54 HydrophobicContact CD1-CE2 4.49Å; L28-Y54 HydrophobicContact CD2-CD2 4.11Å; L28-Y54 HydrophobicContact CD2-CE2 3.54Å; L28-Y54 HydrophobicContact CG-CD2 4.44Å; L28-Y54 HydrophobicContact CG-CE2 3.97Å; L31-Y54 HydrophobicContact CD1-CD2 4.25Å; L31-Y54 HydrophobicContact CD1-CG 4.28Å; A50-Y54 WeakPolarHBondContact O-CB 3.29Å; A50-Y54 PolarHBondContact O-N 3.4Å; S51-Y54 WeakPolarHBondContact O-CB 3.5Å; S51-Y54 PolarHBondContact O-N 3.08Å; Y54-T56 PolarHBondContact O-N 3.29Å; Y54-T57 PolarHBondContact O-N 3.39Å; Y54-I58 HydrophobicContact CD1-CD1 4.2Å; Y54-I58 HydrophobicContact CD2-CD1 4.31Å; Y54-I58 HydrophobicContact CE1-CD1 3.58Å; Y54-I58 HydrophobicContact CE2-CD1 3.69Å; Y54-I58 PolarHBondContact O-N 2.93Å; Y54-I58 VanDerWaalsContact O-N 3.14Å; Y54-I58 WeakPolarHBondContact OH-CD1 3.48Å |
| 55 | F | 89.2 | Confident | 87.3 | Confident | 126 Ų | 126 | 64.5 Ų | 64.5 | 55% | 0.553 | 35% | 0.346 | S | S | * | . | H | α-helix | trans | -65.5 | -41.1 | -179 | -80 | -71.6 | 0 | 0 | 0 | 112.2 | S51 T57 I58 L59 | S51-F55 VanDerWaalsContact O-CD2 3.27Å; S51-F55 WeakPolarHBondContact O-CD2 3.48Å; S51-F55 PolarHBondContact O-N 3Å; F55-T57 VanDerWaalsContact C-N 3.28Å; F55-T57 PolarHBondContact O-N 2.82Å; F55-I58 PolarHBondContact O-N 3.48Å; F55-L59 HydrophobicContact CD1-CD1 4.39Å; F55-L59 VanDerWaalsContact O-CB 3.29Å; F55-L59 WeakPolarHBondContact O-CB 3.36Å; F55-L59 WeakPolarHBondContact O-CG 3.42Å; F55-L59 PolarHBondContact O-N 3.35Å |
| 56 | T | 90 | Very high | 86.6 | Confident | 52 Ų | 52 | 61.1 Ų | 61.1 | 32% | 0.319 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -62 | -39.3 | 176.7 | -58.9 | 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 3.43Å; V52-T56 PolarHBondContact O-OG1 2.94Å; L53-T56 PolarHBondContact O-N 2.77Å; Y54-T56 PolarHBondContact O-N 3.29Å; T56-I60 HydrophobicContact CG2-CB 4.47Å; T56-I60 HydrophobicContact CG2-CD1 4.34Å; T56-I60 WeakPolarHBondContact O-CA 3.45Å; T56-I60 WeakPolarHBondContact O-CB 3.36Å; T56-I60 PolarHBondContact O-N 3.41Å; T56-L61 HydrophobicContact CG2-CD1 4.35Å; T56-L61 PolarHBondContact O-N 3.43Å |
| 57 | T | 85.8 | Confident | 86.1 | Confident | 1 Ų | 1 | 62.5 Ų | 62.5 | 1% | 0.006 | 34% | 0.337 | C | S | . | . | I | π-helix | trans | -65 | -46.8 | -179.5 | -59 | 0 | 0 | 0 | 0 | 111.5 | L20 L23 L24 L53 Y54 F55 L61 M62 | L20-T57 HydrophobicContact CD2-CG2 4.36Å; L23-T57 HydrophobicContact CD2-CG2 4.21Å; L24-T57 HydrophobicContact CB-CG2 4.43Å; L24-T57 HydrophobicContact CD1-CG2 3.96Å; L53-T57 VanDerWaalsContact O-CB 3.27Å; L53-T57 WeakPolarHBondContact O-CB 3.4Å; L53-T57 PolarHBondContact O-N 3.19Å; L53-T57 PolarHBondContact O-OG1 3.49Å; Y54-T57 PolarHBondContact O-N 3.39Å; F55-T57 VanDerWaalsContact C-N 3.28Å; F55-T57 PolarHBondContact O-N 2.82Å; T57-L61 WeakPolarHBondContact O-CB 3.38Å; T57-L61 PolarHBondContact O-N 3.17Å; T57-M62 PolarHBondContact O-N 2.89Å |
| 58 | I | 84.1 | Confident | 85.6 | Confident | 39 Ų | 39 | 66 Ų | 66 | 20% | 0.2 | 35% | 0.352 | C | S | . | . | I | π-helix | trans | -74.1 | -45.7 | -179 | -66.3 | 173 | 0 | 0 | 0 | 111.9 | L3 L24 Y54 F55 | L3-I58 HydrophobicContact CD1-CG2 4.49Å; L24-I58 HydrophobicContact CD1-CD1 3.94Å; L24-I58 HydrophobicContact CD1-CG1 3.63Å; L24-I58 HydrophobicContact CD2-CG1 4.49Å; Y54-I58 HydrophobicContact CD1-CD1 4.2Å; Y54-I58 HydrophobicContact CD2-CD1 4.31Å; Y54-I58 HydrophobicContact CE1-CD1 3.58Å; Y54-I58 HydrophobicContact CE2-CD1 3.69Å; Y54-I58 PolarHBondContact O-N 2.93Å; Y54-I58 VanDerWaalsContact O-N 3.14Å; Y54-I58 WeakPolarHBondContact OH-CD1 3.48Å; F55-I58 PolarHBondContact O-N 3.48Å |
| 59 | L | 83.8 | Confident | 84.9 | Confident | 103 Ų | 103 | 60.5 Ų | 60.5 | 54% | 0.539 | 33% | 0.326 | S | S | . | . | I | π-helix | trans | -82.4 | -33.1 | -171.7 | -67.8 | 174.6 | 0 | 0 | 0 | 113.4 | F55 P63 | F55-L59 HydrophobicContact CD1-CD1 4.39Å; F55-L59 VanDerWaalsContact O-CB 3.29Å; F55-L59 WeakPolarHBondContact O-CB 3.36Å; F55-L59 WeakPolarHBondContact O-CG 3.42Å; F55-L59 PolarHBondContact O-N 3.35Å; L59-P63 WeakPolarHBondContact O-CG 3.41Å |
| 60 | I | 85.3 | Confident | 84 | Confident | 100 Ų | 100 | 58.4 Ų | 58.4 | 51% | 0.513 | 31% | 0.312 | S | S | . | . | I | π-helix | trans | -113.5 | -52.1 | -171.7 | -56 | 178.9 | 0 | 0 | 0 | 111.1 | T56 P63 T64 | T56-I60 HydrophobicContact CG2-CB 4.47Å; T56-I60 HydrophobicContact CG2-CD1 4.34Å; T56-I60 WeakPolarHBondContact O-CA 3.45Å; T56-I60 WeakPolarHBondContact O-CB 3.36Å; T56-I60 PolarHBondContact O-N 3.41Å; I60-P63 VanDerWaalsContact O-CD 3.27Å; I60-P63 WeakPolarHBondContact O-CD 3.24Å; I60-P63 WeakPolarHBondContact O-CG 3.47Å; I60-T64 HydrophobicContact CG2-CG2 4.3Å; I60-T64 WeakPolarHBondContact O-CB 3.41Å; I60-T64 WeakPolarHBondContact O-CG2 3.27Å; I60-T64 PolarHBondContact O-N 3.48Å; I60-T64 VanDerWaalsContact O-N 3.13Å; I60-T64 PolarHBondContact O-OG1 3.23Å |
| 61 | L | 82 | Confident | 83.1 | Confident | 63 Ų | 63 | 66.2 Ų | 66.2 | 33% | 0.33 | 35% | 0.345 | S | S | . | . | I | π-helix | trans | -69.4 | -41.5 | -174.4 | -77 | 148.1 | 0 | 0 | 0 | 112.7 | L20 T56 T57 T64 V65 | L20-L61 HydrophobicContact CD1-CB 4.15Å; L20-L61 HydrophobicContact CD2-CB 3.89Å; L20-L61 HydrophobicContact CD2-CD2 4.2Å; L20-L61 HydrophobicContact CD2-CG 4.43Å; T56-L61 HydrophobicContact CG2-CD1 4.35Å; T56-L61 PolarHBondContact O-N 3.43Å; T57-L61 WeakPolarHBondContact O-CB 3.38Å; T57-L61 PolarHBondContact O-N 3.17Å; L61-T64 VanDerWaalsContact CA-OG1 3.29Å; L61-T64 WeakPolarHBondContact CA-OG1 3.27Å; L61-T64 PolarHBondContact O-N 3.25Å; L61-T64 PolarHBondContact O-OG1 3.46Å; L61-V65 WeakPolarHBondContact O-CB 3.42Å; L61-V65 PolarHBondContact O-N 2.88Å |
| 62 | M | 82.1 | Confident | 82.2 | Confident | 72 Ų | 72 | 70.3 Ų | 70.3 | 36% | 0.355 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -56.4 | -53.9 | 175.6 | -82.2 | -162.5 | 175.9 | 0 | 0 | 113.2 | L24 T57 S66 | L24-M62 HydrophobicContact CD2-CE 4.34Å; T57-M62 PolarHBondContact O-N 2.89Å; M62-S66 WeakPolarHBondContact O-CB 3.25Å; M62-S66 PolarHBondContact O-N 2.98Å |
| 63 | P | 78.1 | Confident | 81.1 | Confident | 48 Ų | 48 | 70.2 Ų | 70.2 | 31% | 0.312 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -67.6 | -37.2 | 179.7 | 22.2 | -30.8 | 0 | 0 | 0 | 112.9 | L59 I60 S66 L67 | L59-P63 WeakPolarHBondContact O-CG 3.41Å; I60-P63 VanDerWaalsContact O-CD 3.27Å; I60-P63 WeakPolarHBondContact O-CD 3.24Å; I60-P63 WeakPolarHBondContact O-CG 3.47Å; P63-S66 WeakPolarHBondContact CA-OG 3.46Å; P63-S66 WeakPolarHBondContact O-CB 3.35Å; P63-S66 PolarHBondContact O-N 3.2Å; P63-S66 PolarHBondContact O-OG 3.13Å; P63-L67 WeakPolarHBondContact O-CG 3.44Å; P63-L67 PolarHBondContact O-N 3.49Å |
| 64 | T | 82.5 | Confident | 79.6 | Confident | 57 Ų | 57 | 75 Ų | 75 | 35% | 0.35 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -66.9 | -48.7 | -179 | 51.3 | 0 | 0 | 0 | 0 | 112.4 | I60 L61 S66 L67 I68 | I60-T64 HydrophobicContact CG2-CG2 4.3Å; I60-T64 WeakPolarHBondContact O-CB 3.41Å; I60-T64 WeakPolarHBondContact O-CG2 3.27Å; I60-T64 PolarHBondContact O-N 3.48Å; I60-T64 VanDerWaalsContact O-N 3.13Å; I60-T64 PolarHBondContact O-OG1 3.23Å; L61-T64 VanDerWaalsContact CA-OG1 3.29Å; L61-T64 WeakPolarHBondContact CA-OG1 3.27Å; L61-T64 PolarHBondContact O-N 3.25Å; L61-T64 PolarHBondContact O-OG1 3.46Å; T64-S66 PolarHBondContact O-N 3.49Å; T64-L67 PolarHBondContact O-N 3.49Å; T64-I68 VanDerWaalsContact O-CG1 3.29Å; T64-I68 WeakPolarHBondContact O-CG1 3.46Å; T64-I68 PolarHBondContact O-N 3.5Å |
| 65 | V | 82.5 | Confident | 78.1 | Confident | 19 Ų | 19 | 79.4 Ų | 79.4 | 12% | 0.115 | 39% | 0.39 | C | S | . | . | H | α-helix | trans | -62.8 | -33.5 | 172.3 | 171.2 | 0 | 0 | 0 | 0 | 110.5 | L16 L20 L61 L67 I68 E69 | L16-V65 HydrophobicContact CB-CG1 3.54Å; L20-V65 HydrophobicContact CD1-CB 3.52Å; L20-V65 HydrophobicContact CD1-CG1 3.91Å; L20-V65 HydrophobicContact CD1-CG2 3.37Å; L20-V65 HydrophobicContact CG-CG2 4.32Å; L61-V65 WeakPolarHBondContact O-CB 3.42Å; L61-V65 PolarHBondContact O-N 2.88Å; V65-L67 VanDerWaalsContact C-N 3.29Å; V65-L67 PolarHBondContact O-N 3.33Å; V65-I68 PolarHBondContact O-N 2.96Å; V65-E69 HydrophobicContact CG1-CG 4.42Å; V65-E69 PolarHBondContact O-N 2.92Å |
| 66 | S | 75.7 | Confident | 75.9 | Confident | 12 Ų | 12 | 81.5 Ų | 81.5 | 8% | 0.084 | 43% | 0.43 | C | S | . | . | H | α-helix | trans | -60.2 | -41.9 | 177 | 84.9 | 0 | 0 | 0 | 0 | 112.7 | R14 M62 P63 T64 N70 | R14-S66 PolarHBondContact NH2-O 2.94Å; M62-S66 WeakPolarHBondContact O-CB 3.25Å; M62-S66 PolarHBondContact O-N 2.98Å; P63-S66 WeakPolarHBondContact CA-OG 3.46Å; P63-S66 WeakPolarHBondContact O-CB 3.35Å; P63-S66 PolarHBondContact O-N 3.2Å; P63-S66 PolarHBondContact O-OG 3.13Å; T64-S66 PolarHBondContact O-N 3.49Å; S66-N70 PolarHBondContact O-N 3.32Å; S66-N70 PolarHBondContact O-ND2 3.33Å; S66-N70 PolarHBondContact O-OD1 2.93Å |
| 67 | L | 77.6 | Confident | 75.2 | Confident | 102 Ų | 102 | 83 Ų | 83 | 53% | 0.534 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -72.5 | -40.1 | 178 | -71.1 | 164 | 0 | 0 | 0 | 112.7 | P63 T64 V65 N70 K71 | P63-L67 WeakPolarHBondContact O-CG 3.44Å; P63-L67 PolarHBondContact O-N 3.49Å; T64-L67 PolarHBondContact O-N 3.49Å; V65-L67 VanDerWaalsContact C-N 3.29Å; V65-L67 PolarHBondContact O-N 3.33Å; L67-N70 PolarHBondContact O-N 2.92Å; L67-K71 WeakPolarHBondContact O-CG 3.41Å; L67-K71 PolarHBondContact O-N 3.48Å |
| 68 | I | 80.8 | Confident | 74.7 | Confident | 86 Ų | 86 | 87.3 Ų | 87.3 | 44% | 0.441 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -63.2 | -48.8 | 179.8 | -69.8 | 164.2 | 0 | 0 | 0 | 110.3 | T64 V65 N70 K71 M72 | T64-I68 VanDerWaalsContact O-CG1 3.29Å; T64-I68 WeakPolarHBondContact O-CG1 3.46Å; T64-I68 PolarHBondContact O-N 3.5Å; V65-I68 PolarHBondContact O-N 2.96Å; I68-N70 VanDerWaalsContact C-N 3.35Å; I68-N70 PolarHBondContact O-N 2.78Å; I68-K71 PolarHBondContact O-N 3.01Å; I68-M72 HydrophobicContact CG2-CG 4.45Å; I68-M72 HydrophobicContact CG2-SD 4.07Å; I68-M72 WeakPolarHBondContact O-CG 3.38Å; I68-M72 PolarHBondContact O-N 3.48Å |
| 69 | E | 74.5 | Confident | 74.1 | Confident | 8 Ų | 8 | 90 Ų | 90 | 4% | 0.037 | 47% | 0.473 | C | S | . | . | H | α-helix | trans | -66.1 | -36.6 | 178.3 | -78.6 | 176.7 | 140.8 | 0 | 0 | 112 | R14 L16 S17 V65 K71 M72 L73 | R14-E69 WeakPolarHBondContact CA-OE1 3.25Å; R14-E69 VanDerWaalsContact CB-OE1 3.29Å; R14-E69 WeakPolarHBondContact CB-OE1 3.46Å; R14-E69 WeakPolarHBondContact CB-OE2 3.29Å; R14-E69 IonicContact CZ-OE2 3.17Å; R14-E69 IonicContact NE-OE2 2.68Å; R14-E69 PolarHBondContact NE-OE2 3.46Å; R14-E69 IonicContact NH2-OE2 2.81Å; R14-E69 PolarHBondContact NH2-OE2 3.4Å; L16-E69 WeakPolarHBondContact CA-OE1 3.39Å; L16-E69 HydrophobicContact CB-CG 4.12Å; L16-E69 VanDerWaalsContact CB-OE1 3.31Å; L16-E69 WeakPolarHBondContact CB-OE1 3.29Å; L16-E69 HydrophobicContact CD1-CG 3.88Å; L16-E69 HydrophobicContact CG-CG 4.41Å; L16-E69 PolarHBondContact N-OE1 3.04Å; S17-E69 PolarHBondContact N-OE1 3.26Å; S17-E69 PolarHBondContact OG-OE2 2.95Å; V65-E69 HydrophobicContact CG1-CG 4.42Å; V65-E69 PolarHBondContact O-N 2.92Å; E69-K71 VanDerWaalsContact C-N 3.32Å; E69-K71 PolarHBondContact O-N 3.16Å; E69-M72 PolarHBondContact O-N 3.43Å; E69-L73 WeakPolarHBondContact O-CB 3.49Å; E69-L73 WeakPolarHBondContact O-CG 3.4Å; E69-L73 PolarHBondContact O-N 3.4Å |
| 70 | N | 73.1 | Confident | 73.6 | Confident | 38 Ų | 38 | 89.2 Ų | 89.2 | 20% | 0.203 | 47% | 0.469 | C | S | . | . | H | α-helix | trans | -60 | -42.9 | 173.2 | -72.1 | -10 | 0 | 0 | 0 | 111.4 | S66 L67 I68 | S66-N70 PolarHBondContact O-N 3.32Å; S66-N70 PolarHBondContact O-ND2 3.33Å; S66-N70 PolarHBondContact O-OD1 2.93Å; L67-N70 PolarHBondContact O-N 2.92Å; I68-N70 VanDerWaalsContact C-N 3.35Å; I68-N70 PolarHBondContact O-N 2.78Å |
| 71 | K | 73.5 | Confident | 72.8 | Confident | 168 Ų | 168 | 88.6 Ų | 88.6 | 73% | 0.73 | 47% | 0.466 | S | S | * | . | H | α-helix | trans | -66.1 | -40.9 | 175.5 | -75.4 | 178 | 177.6 | -71.1 | 0 | 112.3 | L67 I68 E69 K74 | L67-K71 WeakPolarHBondContact O-CG 3.41Å; L67-K71 PolarHBondContact O-N 3.48Å; I68-K71 PolarHBondContact O-N 3.01Å; E69-K71 VanDerWaalsContact C-N 3.32Å; E69-K71 PolarHBondContact O-N 3.16Å; K71-K74 PolarHBondContact O-N 3.26Å |
| 72 | M | 71.4 | Confident | 72.2 | Confident | 135 Ų | 135 | 90.3 Ų | 90.3 | 67% | 0.665 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -65.2 | -37.8 | 178.1 | -75.1 | -179.6 | 67 | 0 | 0 | 112.5 | L16 I68 E69 K74 | L16-M72 HydrophobicContact CD1-SD 4.4Å; I68-M72 HydrophobicContact CG2-CG 4.45Å; I68-M72 HydrophobicContact CG2-SD 4.07Å; I68-M72 WeakPolarHBondContact O-CG 3.38Å; I68-M72 PolarHBondContact O-N 3.48Å; E69-M72 PolarHBondContact O-N 3.43Å; M72-K74 PolarHBondContact O-N 2.94Å |
| 73 | L | 71.6 | Confident | 71.5 | Confident | 92 Ų | 92 | 91.6 Ų | 91.6 | 48% | 0.482 | 48% | 0.484 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -80.1 | 6.7 | 179.6 | -67.7 | 170.9 | 0 | 0 | 0 | 113.6 | E69 W75 | E69-L73 WeakPolarHBondContact O-CB 3.49Å; E69-L73 WeakPolarHBondContact O-CG 3.4Å; E69-L73 PolarHBondContact O-N 3.4Å; L73-W75 PolarHBondContact O-N 2.73Å; L73-W75 VanDerWaalsContact O-N 3.11Å |
| 74 | K | 58.8 | Low | 71 | Confident | 186 Ų | 186 | 94.9 Ų | 94.9 | 81% | 0.809 | 50% | 0.497 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 49.6 | 34.1 | 178.6 | -68.7 | -174.8 | 177.7 | 179.6 | 0 | 114.1 | K71 M72 A76 | K71-K74 PolarHBondContact O-N 3.26Å; M72-K74 PolarHBondContact O-N 2.94Å; K74-A76 PolarHBondContact O-N 2.94Å |
| 75 | W | 56.9 | Low | 70.1 | Confident | 161 Ų | 161 | 98.1 Ų | 98.1 | 61% | 0.61 | 51% | 0.51 | S | S | * | . | trans | -84.6 | 96.8 | 161 | -79.1 | -1.6 | 0 | 0 | 0 | 107.4 | Q8 L73 | Q8-W75 HydrophobicContact CG-CH2 4.2Å; Q8-W75 HydrophobicContact CG-CZ3 3.95Å; L73-W75 PolarHBondContact O-N 2.73Å; L73-W75 VanDerWaalsContact O-N 3.11Å | ||
| 76 | A | 44.2 | Very low | 68.9 | Low | 170 Ų | 170 | 105.3 Ų | 105.3 | 100% | 1.405 | 55% | 0.545 | S | S | * | . | trans | -63.5 | 0 | 166 | 0 | 0 | 0 | 0 | 0 | 110.6 | K74 | K74-A76 PolarHBondContact O-N 2.94Š|
Retrieved 76 of 76 residues in 78.5 ms
(Link to these results)