| 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 | 49.8 | Very low | 49.1 | Very low | 146 Ų | 146 | 124 Ų | 124 | 95% | 0.948 | 64% | 0.636 | S | S | * | * | 0 | -52 | 0 | -8.9 | 27.9 | 0 | 0 | 0 | 114 | |||||
| 2 | I | 53.6 | Low | 48.9 | Very low | 164 Ų | 164 | 125.6 Ų | 125.6 | 84% | 0.841 | 64% | 0.641 | S | S | * | * | trans | -84.9 | -28.5 | -178.6 | -66 | 160 | 0 | 0 | 0 | 112.8 | ||||
| 3 | L | 45.6 | Very low | 49.1 | Very low | 121 Ų | 121 | 126.8 Ų | 126.8 | 63% | 0.634 | 64% | 0.64 | S | S | * | * | S | Bend | trans | -91.6 | 4.5 | 175.8 | -71.7 | 169.7 | 0 | 0 | 0 | 114.2 | M5 I58 | L3-M5 PolarHBondContact O-N 3.31Å; L3-I58 HydrophobicContact CD1-CG2 4.41Å |
| 4 | H | 44.5 | Very low | 50.1 | Low | 145 Ų | 145 | 118.3 Ų | 118.3 | 67% | 0.671 | 60% | 0.596 | S | S | * | * | trans | -77.5 | 91 | 174.3 | -77.9 | -66.1 | 0 | 0 | 0 | 109.9 | S6 | H4-S6 VanDerWaalsContact C-N 3.32Š| ||
| 5 | M | 55.9 | Low | 51.3 | Low | 152 Ų | 152 | 116.9 Ų | 116.9 | 75% | 0.749 | 60% | 0.599 | S | S | * | * | trans | -91.4 | 7.9 | 169 | -66.1 | -143.2 | 142.6 | 0 | 0 | 113.3 | L3 | L3-M5 PolarHBondContact O-N 3.31Š| ||
| 6 | S | 44.1 | Very low | 52.5 | Low | 33 Ų | 33 | 113.9 Ų | 113.9 | 23% | 0.231 | 58% | 0.584 | C | S | . | * | trans | -92.3 | 123.6 | 177.9 | 176.4 | 0 | 0 | 0 | 0 | 111.1 | H4 Q8 R14 | H4-S6 VanDerWaalsContact C-N 3.32Å; S6-Q8 PolarHBondContact O-N 3.04Å; S6-Q8 PolarHBondContact OG-N 3.46Å; S6-Q8 PolarHBondContact OG-O 2.91Å; S6-R14 PolarHBondContact OG-NH1 2.74Å | ||
| 7 | K | 52.3 | Low | 53.8 | Low | 188 Ų | 188 | 108 Ų | 108 | 82% | 0.817 | 56% | 0.555 | S | S | * | * | S | Bend | trans | -72.4 | -10.4 | 171.9 | -87.5 | -174.3 | 179.7 | 176 | 0 | 113.9 | ||
| 8 | Q | 43.6 | Very low | 55 | Low | 58 Ų | 58 | 106.3 Ų | 106.3 | 27% | 0.271 | 54% | 0.544 | S | S | . | . | trans | -103.9 | 127.8 | 172.9 | -78.4 | 178.5 | -56.4 | 0 | 0 | 110.6 | S6 S10 | S6-Q8 PolarHBondContact O-N 3.04Å; S6-Q8 PolarHBondContact OG-N 3.46Å; S6-Q8 PolarHBondContact OG-O 2.91Å; Q8-S10 VanDerWaalsContact C-N 3.29Å | ||
| 9 | Q | 50.9 | Low | 56.4 | Low | 210 Ų | 210 | 104.2 Ų | 104.2 | 98% | 0.981 | 54% | 0.54 | S | S | * | . | S | Bend | trans | -77.5 | -13.9 | 179.2 | -167.3 | 170.8 | -14.8 | 0 | 0 | 112.9 | ||
| 10 | S | 46.3 | Very low | 57.7 | Low | 60 Ų | 60 | 99.5 Ų | 99.5 | 42% | 0.42 | 52% | 0.516 | S | S | . | . | trans | -113.3 | 126.9 | -177.4 | -177.6 | 0 | 0 | 0 | 0 | 111.8 | Q8 M12 | Q8-S10 VanDerWaalsContact C-N 3.29Å; S10-M12 PolarHBondContact O-N 3.27Å; S10-M12 VanDerWaalsContact OG-CB 3.27Å; S10-M12 WeakPolarHBondContact OG-CB 3.49Å; S10-M12 PolarHBondContact OG-N 3.27Å | ||
| 11 | M | 53.3 | Low | 58.9 | Low | 87 Ų | 87 | 100.4 Ų | 100.4 | 43% | 0.429 | 51% | 0.513 | S | S | . | . | G | 310 helix | trans | -68.5 | -2 | 170.9 | -109.4 | 172.7 | -165.1 | 0 | 0 | 113.2 | F13 Q18 Y21 | M11-F13 VanDerWaalsContact C-N 3.33Å; M11-F13 PolarHBondContact O-N 2.89Å; M11-Q18 WeakPolarHBondContact O-CG 3.39Å; M11-Q18 PolarHBondContact O-NE2 3.4Å; M11-Y21 HydrophobicContact CE-CD2 4.3Å; M11-Y21 HydrophobicContact CE-CG 4.47Å; M11-Y21 HydrophobicContact SD-CD2 4.39Å; M11-Y21 HydrophobicContact SD-CG 4.26Å |
| 12 | M | 47.2 | Very low | 60.5 | Low | 143 Ų | 143 | 102.1 Ų | 102.1 | 70% | 0.704 | 50% | 0.501 | S | S | * | . | G | 310 helix | trans | -69.9 | -23.9 | -170.5 | -164.5 | 173.5 | 179.7 | 0 | 0 | 114.2 | S10 | S10-M12 PolarHBondContact O-N 3.27Å; S10-M12 VanDerWaalsContact OG-CB 3.27Å; S10-M12 WeakPolarHBondContact OG-CB 3.49Å; S10-M12 PolarHBondContact OG-N 3.27Å |
| 13 | F | 51.7 | Low | 62.1 | Low | 142 Ų | 142 | 98.3 Ų | 98.3 | 62% | 0.623 | 48% | 0.482 | S | S | * | . | G | 310 helix | trans | -105.8 | 17.5 | -176.5 | -67 | -74.7 | 0 | 0 | 0 | 114.4 | M11 | M11-F13 VanDerWaalsContact C-N 3.33Å; M11-F13 PolarHBondContact O-N 2.89Å |
| 14 | R | 63.2 | Low | 64.2 | Low | 7 Ų | 7 | 93.5 Ų | 93.5 | 3% | 0.026 | 46% | 0.456 | C | S | . | . | trans | -134.8 | 79.9 | -168.2 | -63.1 | -173.8 | 68.5 | 163.4 | 18.4 | 111.5 | S6 L16 S17 Q18 S66 E69 | S6-R14 PolarHBondContact OG-NH1 2.74Å; R14-L16 PolarHBondContact O-N 2.95Å; R14-S17 PolarHBondContact NE-OG 3.31Å; R14-S17 PolarHBondContact O-N 2.93Å; R14-S17 VanDerWaalsContact O-N 3.17Å; R14-Q18 PolarHBondContact O-N 3.02Å; R14-S66 PolarHBondContact NH2-O 3.16Å; R14-E69 VanDerWaalsContact CA-OE1 3.23Å; R14-E69 WeakPolarHBondContact CA-OE1 3.44Å; R14-E69 WeakPolarHBondContact CB-OE1 3.47Å; R14-E69 WeakPolarHBondContact CB-OE2 3.48Å; R14-E69 IonicContact CZ-OE2 3.09Å; R14-E69 IonicContact NE-OE2 2.68Å; R14-E69 PolarHBondContact NE-OE2 3.46Å; R14-E69 VanDerWaalsContact NH2-CB 3.31Å; R14-E69 IonicContact NH2-OE2 2.73Å; R14-E69 PolarHBondContact NH2-OE2 3.39Å | ||
| 15 | P | 67.3 | Low | 66.3 | Low | 98 Ų | 98 | 87.9 Ų | 87.9 | 64% | 0.636 | 44% | 0.435 | S | S | * | . | H | α-helix | trans | -61.2 | -30.2 | -173.6 | 23.9 | -32.8 | 0 | 0 | 0 | 112.8 | S19 | P15-S19 PolarHBondContact O-N 3.3Å; P15-S19 VanDerWaalsContact O-N 3.15Å |
| 16 | L | 71.4 | Confident | 68 | Low | 69 Ų | 69 | 82.9 Ų | 82.9 | 36% | 0.361 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -74 | -42.2 | 177 | -60.1 | 169.9 | 0 | 0 | 0 | 110.8 | R14 Q18 S19 L20 I65 E69 M72 | R14-L16 PolarHBondContact O-N 2.95Å; L16-Q18 VanDerWaalsContact C-N 3.32Å; L16-Q18 PolarHBondContact O-N 3.32Å; L16-S19 PolarHBondContact O-N 3.03Å; L16-S19 PolarHBondContact O-OG 3.18Å; L16-L20 PolarHBondContact O-N 3.43Å; L16-L20 VanDerWaalsContact O-N 3.12Å; L16-I65 HydrophobicContact CB-CD1 4.29Å; L16-I65 HydrophobicContact CB-CG2 3.59Å; L16-E69 WeakPolarHBondContact CA-OE1 3.38Å; L16-E69 HydrophobicContact CB-CG 4.12Å; L16-E69 VanDerWaalsContact CB-OE1 3.28Å; L16-E69 WeakPolarHBondContact CB-OE1 3.46Å; L16-E69 HydrophobicContact CD1-CG 3.87Å; L16-E69 HydrophobicContact CG-CG 4.38Å; L16-E69 PolarHBondContact N-OE1 2.91Å; L16-M72 HydrophobicContact CD1-SD 4.46Å |
| 17 | S | 73.4 | Confident | 70.2 | Confident | 13 Ų | 13 | 81.8 Ų | 81.8 | 9% | 0.091 | 41% | 0.41 | C | S | . | . | H | α-helix | trans | -64.1 | -34.2 | 174.7 | -68.3 | 0 | 0 | 0 | 0 | 113.1 | R14 L20 Y21 E69 | R14-S17 PolarHBondContact NE-OG 3.31Å; R14-S17 PolarHBondContact O-N 2.93Å; R14-S17 VanDerWaalsContact O-N 3.17Å; S17-L20 PolarHBondContact O-N 3.44Å; S17-Y21 PolarHBondContact O-N 3.2Å; S17-Y21 VanDerWaalsContact O-N 3.11Å; S17-E69 PolarHBondContact N-OE1 3.27Å; S17-E69 PolarHBondContact OG-OE2 2.93Å |
| 18 | Q | 75.9 | Confident | 72 | Confident | 77 Ų | 77 | 76.1 Ų | 76.1 | 36% | 0.36 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -65.3 | -42.8 | 172.8 | -73.8 | -179 | 8.2 | 0 | 0 | 112.1 | M11 R14 L16 L20 Y21 W22 | M11-Q18 WeakPolarHBondContact O-CG 3.39Å; M11-Q18 PolarHBondContact O-NE2 3.4Å; R14-Q18 PolarHBondContact O-N 3.02Å; L16-Q18 VanDerWaalsContact C-N 3.32Å; L16-Q18 PolarHBondContact O-N 3.32Å; Q18-L20 VanDerWaalsContact C-N 3.31Å; Q18-L20 PolarHBondContact O-N 3.29Å; Q18-Y21 WeakPolarHBondContact O-CB 3.28Å; Q18-Y21 PolarHBondContact O-N 2.97Å; Q18-W22 VanDerWaalsContact O-CD1 3.29Å; Q18-W22 PolarHBondContact O-N 3Å; Q18-W22 VanDerWaalsContact O-N 3.11Å |
| 19 | S | 82.1 | Confident | 74.4 | Confident | 66 Ų | 66 | 79.5 Ų | 79.5 | 46% | 0.462 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -61.5 | -39.3 | 177.2 | 74.1 | 0 | 0 | 0 | 0 | 112.3 | P15 L16 W22 L23 | P15-S19 PolarHBondContact O-N 3.3Å; P15-S19 VanDerWaalsContact O-N 3.15Å; L16-S19 PolarHBondContact O-N 3.03Å; L16-S19 PolarHBondContact O-OG 3.18Å; S19-W22 PolarHBondContact O-N 2.99Å; S19-L23 WeakPolarHBondContact O-CB 3.39Å; S19-L23 PolarHBondContact O-N 3.37Å |
| 20 | L | 82.6 | Confident | 76.2 | Confident | 11 Ų | 11 | 73.4 Ų | 73.4 | 6% | 0.058 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -65 | -38 | 174.6 | -85.3 | 176.6 | 0 | 0 | 0 | 113.1 | L16 S17 Q18 W22 L23 L24 T57 L61 I65 | L16-L20 PolarHBondContact O-N 3.43Å; L16-L20 VanDerWaalsContact O-N 3.12Å; S17-L20 PolarHBondContact O-N 3.44Å; Q18-L20 VanDerWaalsContact C-N 3.31Å; Q18-L20 PolarHBondContact O-N 3.29Å; L20-W22 VanDerWaalsContact C-N 3.35Å; L20-L23 PolarHBondContact O-N 3.38Å; L20-L24 WeakPolarHBondContact O-CB 3.3Å; L20-L24 PolarHBondContact O-N 2.97Å; L20-T57 HydrophobicContact CD2-CG2 4.16Å; L20-L61 HydrophobicContact CD1-CB 4.16Å; L20-L61 HydrophobicContact CD2-CB 3.77Å; L20-L61 HydrophobicContact CD2-CD2 3.6Å; L20-L61 HydrophobicContact CD2-CG 4.28Å; L20-I65 HydrophobicContact CD1-CB 3.58Å; L20-I65 HydrophobicContact CD1-CD1 3.4Å; L20-I65 HydrophobicContact CD1-CG1 3.52Å; L20-I65 HydrophobicContact CD1-CG2 3.97Å; L20-I65 HydrophobicContact CD2-CD1 4.38Å; L20-I65 HydrophobicContact CG-CD1 3.78Å; L20-I65 HydrophobicContact CG-CG1 4.43Å |
| 21 | Y | 82.2 | Confident | 78.2 | Confident | 119 Ų | 119 | 72.6 Ų | 72.6 | 47% | 0.467 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -62.4 | -44.8 | 176.1 | 176.5 | -98.5 | 0 | 0 | 0 | 111.3 | M11 S17 Q18 L23 L24 A25 | M11-Y21 HydrophobicContact CE-CD2 4.3Å; M11-Y21 HydrophobicContact CE-CG 4.47Å; M11-Y21 HydrophobicContact SD-CD2 4.39Å; M11-Y21 HydrophobicContact SD-CG 4.26Å; S17-Y21 PolarHBondContact O-N 3.2Å; S17-Y21 VanDerWaalsContact O-N 3.11Å; Q18-Y21 WeakPolarHBondContact O-CB 3.28Å; Q18-Y21 PolarHBondContact O-N 2.97Å; Y21-L23 VanDerWaalsContact C-N 3.34Å; Y21-L23 PolarHBondContact O-N 3.31Å; Y21-L24 PolarHBondContact O-N 3.23Å; Y21-A25 WeakPolarHBondContact O-CB 3.39Å; Y21-A25 PolarHBondContact O-N 3.43Å |
| 22 | W | 84.3 | Confident | 79.9 | Confident | 182 Ų | 182 | 73.5 Ų | 73.5 | 69% | 0.689 | 38% | 0.382 | S | S | * | . | H | α-helix | trans | -65.6 | -36.3 | 175.4 | -78.8 | 107.9 | 0 | 0 | 0 | 112.8 | Q18 S19 L20 A25 A26 | Q18-W22 VanDerWaalsContact O-CD1 3.29Å; Q18-W22 PolarHBondContact O-N 3Å; Q18-W22 VanDerWaalsContact O-N 3.11Å; S19-W22 PolarHBondContact O-N 2.99Å; L20-W22 VanDerWaalsContact C-N 3.35Å; W22-A25 PolarHBondContact O-N 2.71Å; W22-A26 WeakPolarHBondContact O-CB 3.44Å; W22-A26 PolarHBondContact O-N 3.38Å |
| 23 | L | 86.6 | Confident | 81.9 | Confident | 83 Ų | 83 | 75.3 Ų | 75.3 | 44% | 0.435 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -62.3 | -45 | 173.5 | -169.3 | 153.1 | 0 | 0 | 0 | 111.2 | S19 L20 Y21 A26 D27 T57 | S19-L23 WeakPolarHBondContact O-CB 3.39Å; S19-L23 PolarHBondContact O-N 3.37Å; L20-L23 PolarHBondContact O-N 3.38Å; Y21-L23 VanDerWaalsContact C-N 3.34Å; Y21-L23 PolarHBondContact O-N 3.31Å; L23-A26 PolarHBondContact O-N 2.64Å; L23-D27 WeakPolarHBondContact O-CB 3.37Å; L23-D27 PolarHBondContact O-N 2.69Å; L23-T57 HydrophobicContact CD2-CG2 4.23Å |
| 24 | L | 88.5 | Confident | 83.8 | Confident | 20 Ų | 20 | 69.8 Ų | 69.8 | 11% | 0.105 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -62.6 | -42.1 | 174.9 | -171.2 | 101.8 | 0 | 0 | 0 | 111.9 | L20 Y21 A26 D27 L28 Y54 T57 I58 | L20-L24 WeakPolarHBondContact O-CB 3.3Å; L20-L24 PolarHBondContact O-N 2.97Å; Y21-L24 PolarHBondContact O-N 3.23Å; L24-A26 VanDerWaalsContact C-N 3.33Å; L24-A26 PolarHBondContact O-N 2.73Å; L24-D27 PolarHBondContact O-N 2.96Å; L24-L28 HydrophobicContact CD2-CD1 4.34Å; L24-L28 WeakPolarHBondContact O-CG 3.4Å; L24-L28 PolarHBondContact O-N 3.25Å; L24-Y54 HydrophobicContact CD1-CD2 4.2Å; L24-Y54 HydrophobicContact CD1-CE2 4.07Å; L24-Y54 HydrophobicContact CG-CE2 4.45Å; L24-T57 HydrophobicContact CB-CG2 4.47Å; L24-T57 HydrophobicContact CD1-CG2 3.98Å; L24-I58 HydrophobicContact CD1-CD1 3.91Å; L24-I58 HydrophobicContact CD1-CG1 3.47Å; L24-I58 VanDerWaalsContact CD1-CG1 3.47Å |
| 25 | A | 89.7 | Confident | 84.9 | Confident | 28 Ų | 28 | 72.8 Ų | 72.8 | 23% | 0.231 | 39% | 0.391 | C | S | . | . | H | α-helix | trans | -62.2 | -41.8 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.5 | Y21 W22 L28 L29 | Y21-A25 WeakPolarHBondContact O-CB 3.39Å; Y21-A25 PolarHBondContact O-N 3.43Å; W22-A25 PolarHBondContact O-N 2.71Å; A25-L28 PolarHBondContact O-N 3.12Å; A25-L29 WeakPolarHBondContact O-CG 3.35Å; A25-L29 PolarHBondContact O-N 3.24Å; A25-L29 VanDerWaalsContact O-N 3.12Å |
| 26 | A | 91.6 | Very high | 85.9 | Confident | 47 Ų | 47 | 71.2 Ų | 71.2 | 39% | 0.388 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -64.7 | -42.2 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | W22 L23 L24 L28 L29 I30 | W22-A26 WeakPolarHBondContact O-CB 3.44Å; W22-A26 PolarHBondContact O-N 3.38Å; L23-A26 PolarHBondContact O-N 2.64Å; L24-A26 VanDerWaalsContact C-N 3.33Å; L24-A26 PolarHBondContact O-N 2.73Å; A26-L28 PolarHBondContact O-N 2.68Å; A26-L29 WeakPolarHBondContact O-CB 3.19Å; A26-L29 PolarHBondContact O-N 3.27Å; A26-I30 WeakPolarHBondContact O-CG1 3.13Å; A26-I30 PolarHBondContact O-N 3.02Å |
| 27 | D | 90.4 | Very high | 86.6 | Confident | 9 Ų | 9 | 71.2 Ų | 71.2 | 5% | 0.048 | 39% | 0.39 | C | S | . | . | H | α-helix | trans | -63.2 | -40.3 | 177.9 | -170.4 | 73.9 | 0 | 0 | 0 | 112.1 | L23 L24 L29 I30 L31 Y54 | L23-D27 WeakPolarHBondContact O-CB 3.37Å; L23-D27 PolarHBondContact O-N 2.69Å; L24-D27 PolarHBondContact O-N 2.96Å; D27-L29 PolarHBondContact O-N 3.4Å; D27-I30 PolarHBondContact O-N 3.48Å; D27-L31 PolarHBondContact O-N 3.37Å; D27-Y54 WeakPolarHBondContact OD2-CA 3.3Å; D27-Y54 VanDerWaalsContact OD2-CB 3.22Å; D27-Y54 WeakPolarHBondContact OD2-CB 3.47Å; D27-Y54 PolarHBondContact OD2-N 3Å |
| 28 | L | 90.3 | Very high | 87.1 | Confident | 70 Ų | 70 | 74.6 Ų | 74.6 | 37% | 0.366 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -62.8 | -39.3 | 172.5 | -77.4 | 172.9 | 0 | 0 | 0 | 112.9 | L24 A25 A26 I30 L31 T32 Y54 | L24-L28 HydrophobicContact CD2-CD1 4.34Å; L24-L28 WeakPolarHBondContact O-CG 3.4Å; L24-L28 PolarHBondContact O-N 3.25Å; A25-L28 PolarHBondContact O-N 3.12Å; A26-L28 PolarHBondContact O-N 2.68Å; L28-I30 VanDerWaalsContact C-N 3.35Å; L28-L31 PolarHBondContact O-N 3.3Å; L28-T32 WeakPolarHBondContact O-CB 3.28Å; L28-T32 PolarHBondContact O-N 3.44Å; L28-T32 PolarHBondContact O-OG1 2.85Å; L28-Y54 HydrophobicContact CD1-CE2 4.49Å; L28-Y54 HydrophobicContact CD2-CD2 4.12Å; 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 | 87.2 | Confident | 129 Ų | 129 | 77.3 Ų | 77.3 | 68% | 0.675 | 43% | 0.434 | S | S | * | . | H | α-helix | trans | -64.2 | -41.1 | 174.4 | -71.4 | 171.6 | 0 | 0 | 0 | 111.3 | A25 A26 D27 T32 W33 | A25-L29 WeakPolarHBondContact O-CG 3.35Å; A25-L29 PolarHBondContact O-N 3.24Å; A25-L29 VanDerWaalsContact O-N 3.12Å; A26-L29 WeakPolarHBondContact O-CB 3.19Å; A26-L29 PolarHBondContact O-N 3.27Å; D27-L29 PolarHBondContact O-N 3.4Å; L29-T32 PolarHBondContact O-N 3.08Å; L29-W33 WeakPolarHBondContact O-CB 3.37Å; L29-W33 PolarHBondContact O-N 2.94Å |
| 30 | I | 88.6 | Confident | 87.2 | Confident | 81 Ų | 81 | 76.6 Ų | 76.6 | 42% | 0.415 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -64.5 | -45.7 | 176.8 | -67.9 | 165.3 | 0 | 0 | 0 | 110.8 | A26 D27 L28 T32 W33 I34 A50 | A26-I30 WeakPolarHBondContact O-CG1 3.13Å; A26-I30 PolarHBondContact O-N 3.02Å; D27-I30 PolarHBondContact O-N 3.48Å; L28-I30 VanDerWaalsContact C-N 3.35Å; I30-T32 VanDerWaalsContact C-N 3.33Å; I30-T32 PolarHBondContact O-N 3.14Å; I30-W33 WeakPolarHBondContact O-CB 3.28Å; I30-W33 PolarHBondContact O-N 3.43Å; I30-I34 HydrophobicContact CG2-CD1 3.65Å; I30-I34 HydrophobicContact CG2-CG1 4.42Å; I30-I34 VanDerWaalsContact O-CG1 3.28Å; I30-I34 WeakPolarHBondContact O-CG1 3.48Å; I30-I34 PolarHBondContact O-N 2.98Å; I30-A50 HydrophobicContact CG2-CB 4.39Å |
| 31 | L | 88.1 | Confident | 87.2 | Confident | 43 Ų | 43 | 85.2 Ų | 85.2 | 23% | 0.225 | 46% | 0.462 | C | S | . | . | H | α-helix | trans | -61 | -42.1 | 176.1 | -80 | 164 | 0 | 0 | 0 | 112 | D27 L28 I34 G35 A50 Y54 | D27-L31 PolarHBondContact O-N 3.37Å; L28-L31 PolarHBondContact O-N 3.3Å; L31-I34 PolarHBondContact O-N 2.92Å; L31-G35 PolarHBondContact O-N 3.43Å; L31-A50 HydrophobicContact CD2-CB 3.82Å; L31-A50 HydrophobicContact CG-CB 3.98Å; L31-Y54 HydrophobicContact CD1-CD2 4.27Å; L31-Y54 HydrophobicContact CD1-CG 4.26Å |
| 32 | T | 90.6 | Very high | 87.1 | Confident | 106 Ų | 106 | 82.3 Ų | 82.3 | 65% | 0.65 | 46% | 0.457 | S | S | * | . | H | α-helix | trans | -63.5 | -42.8 | 176.7 | -55.5 | 0 | 0 | 0 | 0 | 111.1 | L28 L29 I30 G35 | L28-T32 WeakPolarHBondContact O-CB 3.28Å; L28-T32 PolarHBondContact O-N 3.44Å; L28-T32 PolarHBondContact O-OG1 2.85Å; L29-T32 PolarHBondContact O-N 3.08Å; I30-T32 VanDerWaalsContact C-N 3.33Å; I30-T32 PolarHBondContact O-N 3.14Å; T32-G35 PolarHBondContact O-N 2.88Å |
| 33 | W | 89.1 | Confident | 87.2 | Confident | 182 Ų | 182 | 76.8 Ų | 76.8 | 69% | 0.689 | 44% | 0.438 | S | S | * | . | H | α-helix | trans | -61.5 | -47.1 | 175.7 | -177.1 | -71.7 | 0 | 0 | 0 | 111.7 | L29 I30 G35 G36 | L29-W33 WeakPolarHBondContact O-CB 3.37Å; L29-W33 PolarHBondContact O-N 2.94Å; I30-W33 WeakPolarHBondContact O-CB 3.28Å; I30-W33 PolarHBondContact O-N 3.43Å; W33-G35 VanDerWaalsContact C-N 3.32Å; W33-G35 PolarHBondContact O-N 2.72Å; W33-G36 PolarHBondContact O-N 2.98Å |
| 34 | I | 90.8 | Very high | 87.2 | Confident | 25 Ų | 25 | 75.5 Ų | 75.5 | 13% | 0.128 | 43% | 0.434 | C | S | . | . | H | α-helix | trans | -67.3 | -33.6 | -178.4 | -68.4 | 167.9 | 0 | 0 | 0 | 111.5 | I30 L31 G36 Q37 I46 | I30-I34 HydrophobicContact CG2-CD1 3.65Å; I30-I34 HydrophobicContact CG2-CG1 4.42Å; I30-I34 VanDerWaalsContact O-CG1 3.28Å; I30-I34 WeakPolarHBondContact O-CG1 3.48Å; I30-I34 PolarHBondContact O-N 2.98Å; L31-I34 PolarHBondContact O-N 2.92Å; I34-G36 PolarHBondContact O-N 3.34Å; I34-Q37 PolarHBondContact O-N 3Å; I34-I46 HydrophobicContact CD1-CB 3.88Å; I34-I46 HydrophobicContact CD1-CG2 3.38Å; I34-I46 HydrophobicContact CG1-CG2 4.5Å |
| 35 | G | 87.5 | Confident | 87.3 | Confident | 70 Ų | 70 | 78.5 Ų | 78.5 | 72% | 0.722 | 45% | 0.449 | S | S | * | . | H | α-helix | trans | -60.3 | -23.3 | 175.8 | 0 | 0 | 0 | 0 | 0 | 114.1 | L31 T32 W33 | L31-G35 PolarHBondContact O-N 3.43Å; T32-G35 PolarHBondContact O-N 2.88Å; W33-G35 VanDerWaalsContact C-N 3.32Å; W33-G35 PolarHBondContact O-N 2.72Å |
| 36 | G | 86.8 | Confident | 87.2 | Confident | 65 Ų | 65 | 80.9 Ų | 80.9 | 67% | 0.67 | 46% | 0.457 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -91.5 | -7.5 | 174.7 | 0 | 0 | 0 | 0 | 0 | 114.9 | W33 I34 | W33-G36 PolarHBondContact O-N 2.98Å; I34-G36 PolarHBondContact O-N 3.34Å |
| 37 | Q | 85.6 | Confident | 87.1 | Confident | 69 Ų | 69 | 79.2 Ų | 79.2 | 32% | 0.322 | 45% | 0.445 | S | S | . | . | S | Bend | trans | -88.2 | 148.7 | 179.3 | -64.1 | -59.6 | -42.7 | 0 | 0 | 110.9 | I34 V39 F43 | I34-Q37 PolarHBondContact O-N 3Å; Q37-V39 PolarHBondContact O-N 3.36Å; Q37-F43 HydrophobicContact CB-CB 4.47Å; Q37-F43 HydrophobicContact CB-CD1 4.37Å; Q37-F43 HydrophobicContact CB-CD2 4.35Å; Q37-F43 HydrophobicContact CB-CG 4.14Å; Q37-F43 HydrophobicContact CG-CD1 4.32Å; Q37-F43 HydrophobicContact CG-CE1 4.42Å |
| 38 | P | 83.9 | Confident | 87.1 | Confident | 84 Ų | 84 | 84.6 Ų | 84.6 | 55% | 0.545 | 47% | 0.47 | S | S | . | . | trans | -62.5 | 139 | 173.9 | 26.5 | -33.4 | 0 | 0 | 0 | 110.3 | S40 | P38-S40 PolarHBondContact O-N 2.95Å; P38-S40 PolarHBondContact O-OG 2.97Å | ||
| 39 | V | 79.4 | Confident | 87.2 | Confident | 134 Ų | 134 | 85.1 Ų | 85.1 | 81% | 0.812 | 48% | 0.476 | S | S | * | . | S | Bend | trans | -70.2 | 78.5 | 178.9 | -170.4 | 0 | 0 | 0 | 0 | 109.7 | Q37 | Q37-V39 PolarHBondContact O-N 3.36Š|
| 40 | S | 82.3 | Confident | 87.1 | Confident | 51 Ų | 51 | 79.2 Ų | 79.2 | 36% | 0.357 | 45% | 0.446 | S | S | . | . | trans | -132.6 | 151.8 | -179.5 | 55.4 | 0 | 0 | 0 | 0 | 109.1 | P38 F43 T44 | P38-S40 PolarHBondContact O-N 2.95Å; P38-S40 PolarHBondContact O-OG 2.97Å; S40-F43 PolarHBondContact O-N 2.85Å; S40-T44 PolarHBondContact O-N 3.15Å | ||
| 41 | Y | 81.3 | Confident | 87.2 | Confident | 192 Ų | 192 | 77.8 Ų | 77.8 | 75% | 0.753 | 44% | 0.442 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.2 | 127.1 | 170.1 | -176.2 | -90.3 | 0 | 0 | 0 | 108.3 | I45 | Y41-I45 HydrophobicContact CD2-CD1 3.98Å; Y41-I45 HydrophobicContact CE2-CD1 3.5Å |
| 42 | P | 81.8 | Confident | 87.4 | Confident | 58 Ų | 58 | 80.3 Ų | 80.3 | 38% | 0.377 | 46% | 0.459 | S | S | . | . | T | Hydrogen-bonded Turn | cis | -102.5 | -1.1 | 16.4 | 37.9 | -35.3 | 0 | 0 | 0 | 116.1 | T44 I45 I46 | P42-T44 VanDerWaalsContact C-N 3.27Å; P42-T44 PolarHBondContact O-N 3.17Å; P42-I45 PolarHBondContact O-N 3.42Å; P42-I45 VanDerWaalsContact O-N 3.17Å; P42-I46 PolarHBondContact O-N 3.47Å |
| 43 | F | 86.1 | Confident | 87.4 | Confident | 66 Ų | 66 | 79.2 Ų | 79.2 | 29% | 0.289 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -63.5 | -29.8 | -171.4 | -58.7 | -66.5 | 0 | 0 | 0 | 113.7 | Q37 S40 I45 I46 G47 | Q37-F43 HydrophobicContact CB-CB 4.47Å; Q37-F43 HydrophobicContact CB-CD1 4.37Å; Q37-F43 HydrophobicContact CB-CD2 4.35Å; Q37-F43 HydrophobicContact CB-CG 4.14Å; Q37-F43 HydrophobicContact CG-CD1 4.32Å; Q37-F43 HydrophobicContact CG-CE1 4.42Å; S40-F43 PolarHBondContact O-N 2.85Å; F43-I45 VanDerWaalsContact C-N 3.33Å; F43-I45 PolarHBondContact O-N 3.22Å; F43-I46 HydrophobicContact CD1-CD1 4.5Å; F43-I46 PolarHBondContact O-N 2.89Å; F43-G47 PolarHBondContact O-N 2.91Å |
| 44 | T | 86.3 | Confident | 87.4 | Confident | 57 Ų | 57 | 73.7 Ų | 73.7 | 35% | 0.35 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -59.6 | -41.9 | 175.3 | -50.3 | 0 | 0 | 0 | 0 | 112.4 | S40 P42 Q48 | S40-T44 PolarHBondContact O-N 3.15Å; P42-T44 VanDerWaalsContact C-N 3.27Å; P42-T44 PolarHBondContact O-N 3.17Å; T44-Q48 WeakPolarHBondContact O-CG 3.34Å; T44-Q48 PolarHBondContact O-N 3.33Å; T44-Q48 VanDerWaalsContact O-N 3.09Å |
| 45 | I | 89.9 | Confident | 87.4 | Confident | 82 Ų | 82 | 78.5 Ų | 78.5 | 42% | 0.421 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -70.8 | -42 | -179.5 | -66.3 | 173.3 | 0 | 0 | 0 | 110.1 | Y41 P42 F43 G47 Q48 V49 | Y41-I45 HydrophobicContact CD2-CD1 3.98Å; Y41-I45 HydrophobicContact CE2-CD1 3.5Å; P42-I45 PolarHBondContact O-N 3.42Å; P42-I45 VanDerWaalsContact O-N 3.17Å; F43-I45 VanDerWaalsContact C-N 3.33Å; F43-I45 PolarHBondContact O-N 3.22Å; I45-G47 VanDerWaalsContact C-N 3.3Å; I45-G47 PolarHBondContact O-N 2.92Å; I45-Q48 PolarHBondContact O-N 2.86Å; I45-V49 HydrophobicContact CG2-CG2 4.33Å; I45-V49 WeakPolarHBondContact O-CG2 3.44Å; I45-V49 PolarHBondContact O-N 3.31Å |
| 46 | I | 88.6 | Confident | 87.5 | Confident | 78 Ų | 78 | 77.5 Ų | 77.5 | 40% | 0.4 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -62.4 | -41.9 | 178.6 | -52.9 | 173.1 | 0 | 0 | 0 | 109.9 | I34 P42 F43 Q48 V49 A50 | I34-I46 HydrophobicContact CD1-CB 3.88Å; I34-I46 HydrophobicContact CD1-CG2 3.38Å; I34-I46 HydrophobicContact CG1-CG2 4.5Å; P42-I46 PolarHBondContact O-N 3.47Å; F43-I46 HydrophobicContact CD1-CD1 4.5Å; F43-I46 PolarHBondContact O-N 2.89Å; I46-Q48 PolarHBondContact O-N 2.72Å; I46-V49 PolarHBondContact O-N 3.31Å; I46-A50 VanDerWaalsContact O-CB 3.24Å; I46-A50 WeakPolarHBondContact O-CB 3.5Å; I46-A50 PolarHBondContact O-N 3.42Å |
| 47 | G | 89.6 | Confident | 87.4 | Confident | 12 Ų | 12 | 74.6 Ų | 74.6 | 12% | 0.124 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -62.8 | -40.2 | 175.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | F43 I45 S51 | F43-G47 PolarHBondContact O-N 2.91Å; I45-G47 VanDerWaalsContact C-N 3.3Å; I45-G47 PolarHBondContact O-N 2.92Å; G47-S51 WeakPolarHBondContact O-CB 3.4Å; G47-S51 PolarHBondContact O-N 3.49Å; G47-S51 PolarHBondContact O-OG 3.34Å |
| 48 | Q | 89.4 | Confident | 87.3 | Confident | 123 Ų | 123 | 73.2 Ų | 73.2 | 58% | 0.575 | 39% | 0.392 | S | S | * | . | H | α-helix | trans | -64.7 | -47.4 | 175.1 | -74.4 | 176.2 | -2.5 | 0 | 0 | 112 | T44 I45 I46 S51 V52 | T44-Q48 WeakPolarHBondContact O-CG 3.34Å; T44-Q48 PolarHBondContact O-N 3.33Å; T44-Q48 VanDerWaalsContact O-N 3.09Å; I45-Q48 PolarHBondContact O-N 2.86Å; I46-Q48 PolarHBondContact O-N 2.72Å; Q48-S51 PolarHBondContact O-N 3.11Å; Q48-V52 WeakPolarHBondContact O-CG2 3.49Å; Q48-V52 PolarHBondContact O-N 3.21Å |
| 49 | V | 92.6 | Very high | 87.3 | Confident | 81 Ų | 81 | 74 Ų | 74 | 49% | 0.491 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -62.8 | -44.3 | 178.3 | 173.2 | 0 | 0 | 0 | 0 | 111 | I45 I46 S51 V52 L53 | I45-V49 HydrophobicContact CG2-CG2 4.33Å; I45-V49 WeakPolarHBondContact O-CG2 3.44Å; I45-V49 PolarHBondContact O-N 3.31Å; I46-V49 PolarHBondContact O-N 3.31Å; V49-S51 VanDerWaalsContact C-N 3.34Å; V49-S51 PolarHBondContact O-N 3.5Å; V49-V52 PolarHBondContact O-N 3.2Å; V49-L53 HydrophobicContact CG1-CD1 4.06Å; V49-L53 WeakPolarHBondContact O-CB 3.23Å; V49-L53 PolarHBondContact O-N 3.11Å |
| 50 | A | 90.3 | Very high | 87.6 | Confident | 5 Ų | 5 | 72.2 Ų | 72.2 | 4% | 0.041 | 38% | 0.376 | C | S | . | . | H | α-helix | trans | -61.2 | -41.9 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | I30 L31 I46 V52 L53 Y54 | I30-A50 HydrophobicContact CG2-CB 4.39Å; L31-A50 HydrophobicContact CD2-CB 3.82Å; L31-A50 HydrophobicContact CG-CB 3.98Å; I46-A50 VanDerWaalsContact O-CB 3.24Å; I46-A50 WeakPolarHBondContact O-CB 3.5Å; I46-A50 PolarHBondContact O-N 3.42Å; A50-V52 PolarHBondContact O-N 3.26Å; A50-L53 WeakPolarHBondContact O-CB 3.12Å; A50-L53 PolarHBondContact O-N 3.09Å; A50-Y54 WeakPolarHBondContact O-CB 3.36Å; A50-Y54 PolarHBondContact O-N 3.45Å |
| 51 | S | 90.3 | Very high | 87.6 | Confident | 50 Ų | 50 | 72.4 Ų | 72.4 | 35% | 0.35 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -64.1 | -41.9 | 177.3 | -58.3 | 0 | 0 | 0 | 0 | 112.1 | G47 Q48 V49 L53 Y54 F55 | G47-S51 WeakPolarHBondContact O-CB 3.4Å; G47-S51 PolarHBondContact O-N 3.49Å; G47-S51 PolarHBondContact O-OG 3.34Å; Q48-S51 PolarHBondContact O-N 3.11Å; V49-S51 VanDerWaalsContact C-N 3.34Å; V49-S51 PolarHBondContact O-N 3.5Å; S51-L53 VanDerWaalsContact C-N 3.35Å; S51-Y54 WeakPolarHBondContact O-CB 3.43Å; S51-Y54 PolarHBondContact O-N 2.75Å; S51-F55 VanDerWaalsContact O-CD2 3.28Å; S51-F55 WeakPolarHBondContact O-CD2 3.23Å; S51-F55 PolarHBondContact O-N 3.28Å |
| 52 | V | 93.9 | Very high | 87.6 | Confident | 96 Ų | 96 | 66.4 Ų | 66.4 | 58% | 0.582 | 35% | 0.353 | S | S | * | . | H | α-helix | trans | -64 | -42.1 | 174.9 | 172.4 | 0 | 0 | 0 | 0 | 110.7 | Q48 V49 A50 T56 | Q48-V52 WeakPolarHBondContact O-CG2 3.49Å; Q48-V52 PolarHBondContact O-N 3.21Å; V49-V52 PolarHBondContact O-N 3.2Å; A50-V52 PolarHBondContact O-N 3.26Å; V52-T56 VanDerWaalsContact O-CB 3.23Å; V52-T56 WeakPolarHBondContact O-CB 3.47Å; V52-T56 PolarHBondContact O-N 2.93Å; V52-T56 PolarHBondContact O-OG1 2.82Å |
| 53 | L | 90 | Very high | 87.4 | Confident | 83 Ų | 83 | 66 Ų | 66 | 44% | 0.435 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -61.3 | -44.1 | 175.6 | -87.2 | 167.6 | 0 | 0 | 0 | 112 | V49 A50 S51 T56 T57 | V49-L53 HydrophobicContact CG1-CD1 4.06Å; V49-L53 WeakPolarHBondContact O-CB 3.23Å; V49-L53 PolarHBondContact O-N 3.11Å; A50-L53 WeakPolarHBondContact O-CB 3.12Å; A50-L53 PolarHBondContact O-N 3.09Å; S51-L53 VanDerWaalsContact C-N 3.35Å; L53-T56 PolarHBondContact O-N 3.2Å; L53-T57 VanDerWaalsContact O-CB 3.27Å; L53-T57 WeakPolarHBondContact O-CB 3.49Å; L53-T57 PolarHBondContact O-N 3.49Å; L53-T57 PolarHBondContact O-OG1 2.95Å |
| 54 | Y | 89.8 | Confident | 87.2 | Confident | 67 Ų | 67 | 65.9 Ų | 65.9 | 26% | 0.263 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -55 | -55.8 | 176.6 | -177 | -104.5 | 0 | 0 | 0 | 111.9 | L24 D27 L28 L31 A50 S51 T56 T57 I58 | L24-Y54 HydrophobicContact CD1-CD2 4.2Å; L24-Y54 HydrophobicContact CD1-CE2 4.07Å; L24-Y54 HydrophobicContact CG-CE2 4.45Å; D27-Y54 WeakPolarHBondContact OD2-CA 3.3Å; D27-Y54 VanDerWaalsContact OD2-CB 3.22Å; D27-Y54 WeakPolarHBondContact OD2-CB 3.47Å; D27-Y54 PolarHBondContact OD2-N 3Å; L28-Y54 HydrophobicContact CD1-CE2 4.49Å; L28-Y54 HydrophobicContact CD2-CD2 4.12Å; 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 4.27Å; L31-Y54 HydrophobicContact CD1-CG 4.26Å; A50-Y54 WeakPolarHBondContact O-CB 3.36Å; A50-Y54 PolarHBondContact O-N 3.45Å; S51-Y54 WeakPolarHBondContact O-CB 3.43Å; S51-Y54 PolarHBondContact O-N 2.75Å; Y54-T56 PolarHBondContact O-N 3.4Å; Y54-T57 PolarHBondContact O-N 3.23Å; Y54-I58 HydrophobicContact CD1-CD1 4.25Å; Y54-I58 HydrophobicContact CD2-CD1 4.37Å; Y54-I58 HydrophobicContact CE1-CD1 3.62Å; Y54-I58 HydrophobicContact CE2-CD1 3.74Å; Y54-I58 PolarHBondContact O-N 3.36Å; Y54-I58 VanDerWaalsContact O-N 3.14Å; Y54-I58 WeakPolarHBondContact OH-CD1 3.47Å |
| 55 | F | 89.1 | Confident | 87 | Confident | 126 Ų | 126 | 64.6 Ų | 64.6 | 55% | 0.553 | 35% | 0.346 | S | S | * | . | H | α-helix | trans | -65.4 | -41 | -179 | -80.5 | -71.6 | 0 | 0 | 0 | 112.3 | S51 T57 I58 L59 | S51-F55 VanDerWaalsContact O-CD2 3.28Å; S51-F55 WeakPolarHBondContact O-CD2 3.23Å; S51-F55 PolarHBondContact O-N 3.28Å; F55-T57 VanDerWaalsContact C-N 3.3Å; F55-T57 PolarHBondContact O-N 2.87Å; F55-I58 PolarHBondContact O-N 3.43Å; F55-L59 HydrophobicContact CD1-CD1 4.41Å; F55-L59 VanDerWaalsContact O-CB 3.3Å; F55-L59 WeakPolarHBondContact O-CB 3.48Å; F55-L59 WeakPolarHBondContact O-CG 3.37Å; F55-L59 PolarHBondContact O-N 3.43Å |
| 56 | T | 90.3 | Very high | 86.4 | Confident | 49 Ų | 49 | 61.6 Ų | 61.6 | 30% | 0.301 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -62.9 | -39.7 | 177.6 | -58.3 | 0 | 0 | 0 | 0 | 111 | V52 L53 Y54 I60 L61 | V52-T56 VanDerWaalsContact O-CB 3.23Å; V52-T56 WeakPolarHBondContact O-CB 3.47Å; V52-T56 PolarHBondContact O-N 2.93Å; V52-T56 PolarHBondContact O-OG1 2.82Å; L53-T56 PolarHBondContact O-N 3.2Å; Y54-T56 PolarHBondContact O-N 3.4Å; T56-I60 HydrophobicContact CG2-CB 4.45Å; T56-I60 HydrophobicContact CG2-CD1 4.25Å; T56-I60 WeakPolarHBondContact O-CA 3.27Å; T56-I60 WeakPolarHBondContact O-CB 3.36Å; T56-I60 PolarHBondContact O-N 3.17Å; T56-L61 HydrophobicContact CG2-CD1 3.86Å; T56-L61 PolarHBondContact O-N 3.24Å; T56-L61 VanDerWaalsContact O-N 3.08Å |
| 57 | T | 85.4 | Confident | 85.9 | Confident | 3 Ų | 3 | 62.8 Ų | 62.8 | 2% | 0.018 | 34% | 0.338 | C | S | . | . | I | π-helix | trans | -64.8 | -46.4 | 179.7 | -60.3 | 0 | 0 | 0 | 0 | 111.4 | L20 L23 L24 L53 Y54 F55 L61 M62 | L20-T57 HydrophobicContact CD2-CG2 4.16Å; L23-T57 HydrophobicContact CD2-CG2 4.23Å; L24-T57 HydrophobicContact CB-CG2 4.47Å; L24-T57 HydrophobicContact CD1-CG2 3.98Å; L53-T57 VanDerWaalsContact O-CB 3.27Å; L53-T57 WeakPolarHBondContact O-CB 3.49Å; L53-T57 PolarHBondContact O-N 3.49Å; L53-T57 PolarHBondContact O-OG1 2.95Å; Y54-T57 PolarHBondContact O-N 3.23Å; F55-T57 VanDerWaalsContact C-N 3.3Å; F55-T57 PolarHBondContact O-N 2.87Å; T57-L61 PolarHBondContact O-N 3.39Å; T57-M62 PolarHBondContact O-N 3.5Å |
| 58 | I | 83.9 | Confident | 85.5 | Confident | 40 Ų | 40 | 66.2 Ų | 66.2 | 21% | 0.205 | 35% | 0.353 | C | S | . | . | I | π-helix | trans | -72.2 | -47.3 | -179.6 | -65.3 | 178.3 | 0 | 0 | 0 | 112 | L3 L24 Y54 F55 | L3-I58 HydrophobicContact CD1-CG2 4.41Å; L24-I58 HydrophobicContact CD1-CD1 3.91Å; L24-I58 HydrophobicContact CD1-CG1 3.47Å; L24-I58 VanDerWaalsContact CD1-CG1 3.47Å; Y54-I58 HydrophobicContact CD1-CD1 4.25Å; Y54-I58 HydrophobicContact CD2-CD1 4.37Å; Y54-I58 HydrophobicContact CE1-CD1 3.62Å; Y54-I58 HydrophobicContact CE2-CD1 3.74Å; Y54-I58 PolarHBondContact O-N 3.36Å; Y54-I58 VanDerWaalsContact O-N 3.14Å; Y54-I58 WeakPolarHBondContact OH-CD1 3.47Å; F55-I58 PolarHBondContact O-N 3.43Å |
| 59 | L | 83.6 | Confident | 84.8 | Confident | 100 Ų | 100 | 60.8 Ų | 60.8 | 52% | 0.524 | 33% | 0.328 | S | S | . | . | I | π-helix | trans | -82.2 | -33.6 | -171.5 | -68 | 174.3 | 0 | 0 | 0 | 113.1 | F55 P63 | F55-L59 HydrophobicContact CD1-CD1 4.41Å; F55-L59 VanDerWaalsContact O-CB 3.3Å; F55-L59 WeakPolarHBondContact O-CB 3.48Å; F55-L59 WeakPolarHBondContact O-CG 3.37Å; F55-L59 PolarHBondContact O-N 3.43Å; L59-P63 WeakPolarHBondContact O-CD 3.27Å; L59-P63 WeakPolarHBondContact O-CG 3.22Å |
| 60 | I | 84.6 | Confident | 83.9 | Confident | 97 Ų | 97 | 59.5 Ų | 59.5 | 50% | 0.497 | 32% | 0.318 | S | S | . | . | I | π-helix | trans | -112.8 | -51.2 | -171.4 | -59.6 | 171.2 | 0 | 0 | 0 | 111.3 | T56 P63 T64 | T56-I60 HydrophobicContact CG2-CB 4.45Å; T56-I60 HydrophobicContact CG2-CD1 4.25Å; T56-I60 WeakPolarHBondContact O-CA 3.27Å; T56-I60 WeakPolarHBondContact O-CB 3.36Å; T56-I60 PolarHBondContact O-N 3.17Å; I60-P63 VanDerWaalsContact O-CD 3.28Å; I60-P63 WeakPolarHBondContact O-CD 3.37Å; I60-P63 WeakPolarHBondContact O-CG 3.38Å; I60-T64 HydrophobicContact CG2-CG2 4.37Å; I60-T64 WeakPolarHBondContact O-CB 3.28Å; I60-T64 WeakPolarHBondContact O-CG2 3.46Å; I60-T64 PolarHBondContact O-N 3.47Å; I60-T64 PolarHBondContact O-OG1 3.49Å |
| 61 | L | 82.3 | Confident | 83.2 | Confident | 56 Ų | 56 | 66.5 Ų | 66.5 | 29% | 0.293 | 35% | 0.348 | S | S | . | . | I | π-helix | trans | -70.7 | -40.8 | -174.6 | -83 | 68.7 | 0 | 0 | 0 | 112.4 | L20 T56 T57 T64 I65 | L20-L61 HydrophobicContact CD1-CB 4.16Å; L20-L61 HydrophobicContact CD2-CB 3.77Å; L20-L61 HydrophobicContact CD2-CD2 3.6Å; L20-L61 HydrophobicContact CD2-CG 4.28Å; T56-L61 HydrophobicContact CG2-CD1 3.86Å; T56-L61 PolarHBondContact O-N 3.24Å; T56-L61 VanDerWaalsContact O-N 3.08Å; T57-L61 PolarHBondContact O-N 3.39Å; L61-T64 VanDerWaalsContact CA-OG1 3.3Å; L61-T64 WeakPolarHBondContact CA-OG1 3.24Å; L61-T64 PolarHBondContact O-N 3.48Å; L61-T64 PolarHBondContact O-OG1 3.31Å; L61-I65 WeakPolarHBondContact O-CB 3.28Å; L61-I65 PolarHBondContact O-N 2.93Å |
| 62 | M | 81.7 | Confident | 82.3 | Confident | 66 Ų | 66 | 70.6 Ų | 70.6 | 33% | 0.325 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -56.4 | -51.6 | 177 | -82.5 | -163.3 | 174.6 | 0 | 0 | 113.7 | T57 S66 | T57-M62 PolarHBondContact O-N 3.5Å; M62-S66 WeakPolarHBondContact O-CB 3.47Å; M62-S66 PolarHBondContact O-N 3.32Å; M62-S66 PolarHBondContact O-OG 3.23Å |
| 63 | P | 78.1 | Confident | 81.3 | Confident | 50 Ų | 50 | 70.2 Ų | 70.2 | 33% | 0.325 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -70.5 | -33.6 | 178.9 | 24.5 | -32.6 | 0 | 0 | 0 | 113.2 | L59 I60 S66 L67 | L59-P63 WeakPolarHBondContact O-CD 3.27Å; L59-P63 WeakPolarHBondContact O-CG 3.22Å; I60-P63 VanDerWaalsContact O-CD 3.28Å; I60-P63 WeakPolarHBondContact O-CD 3.37Å; I60-P63 WeakPolarHBondContact O-CG 3.38Å; P63-S66 WeakPolarHBondContact O-CB 3.46Å; P63-S66 PolarHBondContact O-N 2.92Å; P63-L67 PolarHBondContact O-N 3.34Å |
| 64 | T | 82.4 | Confident | 79.8 | Confident | 63 Ų | 63 | 75.2 Ų | 75.2 | 39% | 0.387 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -70.4 | -49.2 | -179.4 | 51.4 | 0 | 0 | 0 | 0 | 112.2 | I60 L61 S66 L67 I68 | I60-T64 HydrophobicContact CG2-CG2 4.37Å; I60-T64 WeakPolarHBondContact O-CB 3.28Å; I60-T64 WeakPolarHBondContact O-CG2 3.46Å; I60-T64 PolarHBondContact O-N 3.47Å; I60-T64 PolarHBondContact O-OG1 3.49Å; L61-T64 VanDerWaalsContact CA-OG1 3.3Å; L61-T64 WeakPolarHBondContact CA-OG1 3.24Å; L61-T64 PolarHBondContact O-N 3.48Å; L61-T64 PolarHBondContact O-OG1 3.31Å; T64-S66 PolarHBondContact O-N 2.88Å; T64-L67 PolarHBondContact O-N 2.98Å; T64-L67 VanDerWaalsContact O-N 3.16Å; T64-I68 VanDerWaalsContact O-CG1 3.28Å; T64-I68 WeakPolarHBondContact O-CG1 3.45Å; T64-I68 PolarHBondContact O-N 3.2Å |
| 65 | I | 82.2 | Confident | 78 | Confident | 30 Ų | 30 | 80.1 Ų | 80.1 | 15% | 0.154 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -62.2 | -33.5 | 171.5 | -64.8 | -145.8 | 0 | 0 | 0 | 110.1 | L16 L20 L61 L67 I68 E69 | L16-I65 HydrophobicContact CB-CD1 4.29Å; L16-I65 HydrophobicContact CB-CG2 3.59Å; L20-I65 HydrophobicContact CD1-CB 3.58Å; L20-I65 HydrophobicContact CD1-CD1 3.4Å; L20-I65 HydrophobicContact CD1-CG1 3.52Å; L20-I65 HydrophobicContact CD1-CG2 3.97Å; L20-I65 HydrophobicContact CD2-CD1 4.38Å; L20-I65 HydrophobicContact CG-CD1 3.78Å; L20-I65 HydrophobicContact CG-CG1 4.43Å; L61-I65 WeakPolarHBondContact O-CB 3.28Å; L61-I65 PolarHBondContact O-N 2.93Å; I65-L67 VanDerWaalsContact C-N 3.31Å; I65-L67 PolarHBondContact O-N 3.49Å; I65-I68 PolarHBondContact O-N 3.48Å; I65-E69 HydrophobicContact CG2-CG 4.38Å; I65-E69 PolarHBondContact O-N 3.46Å |
| 66 | S | 76 | Confident | 76 | Confident | 19 Ų | 19 | 82 Ų | 82 | 13% | 0.133 | 42% | 0.418 | C | S | . | . | H | α-helix | trans | -56.8 | -46.6 | 175 | -73.1 | 0 | 0 | 0 | 0 | 112.7 | R14 M62 P63 T64 N70 | R14-S66 PolarHBondContact NH2-O 3.16Å; M62-S66 WeakPolarHBondContact O-CB 3.47Å; M62-S66 PolarHBondContact O-N 3.32Å; M62-S66 PolarHBondContact O-OG 3.23Å; P63-S66 WeakPolarHBondContact O-CB 3.46Å; P63-S66 PolarHBondContact O-N 2.92Å; T64-S66 PolarHBondContact O-N 2.88Å; S66-N70 PolarHBondContact O-N 2.73Å; S66-N70 PolarHBondContact O-ND2 3.12Å; S66-N70 PolarHBondContact O-OD1 3.5Å |
| 67 | L | 77.8 | Confident | 75.3 | Confident | 102 Ų | 102 | 83.6 Ų | 83.6 | 53% | 0.534 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -70.8 | -39.4 | 178.5 | -174.5 | 68.9 | 0 | 0 | 0 | 112.9 | P63 T64 I65 N70 K71 | P63-L67 PolarHBondContact O-N 3.34Å; T64-L67 PolarHBondContact O-N 2.98Å; T64-L67 VanDerWaalsContact O-N 3.16Å; I65-L67 VanDerWaalsContact C-N 3.31Å; I65-L67 PolarHBondContact O-N 3.49Å; L67-N70 PolarHBondContact O-N 2.91Å; L67-K71 WeakPolarHBondContact O-CG 3.48Å; L67-K71 PolarHBondContact O-N 2.95Å |
| 68 | I | 81.4 | Confident | 74.8 | Confident | 84 Ų | 84 | 87.8 Ų | 87.8 | 43% | 0.431 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -63.5 | -49.3 | -179.4 | -69.8 | 164.2 | 0 | 0 | 0 | 110.4 | T64 I65 N70 K71 M72 | T64-I68 VanDerWaalsContact O-CG1 3.28Å; T64-I68 WeakPolarHBondContact O-CG1 3.45Å; T64-I68 PolarHBondContact O-N 3.2Å; I65-I68 PolarHBondContact O-N 3.48Å; I68-N70 VanDerWaalsContact C-N 3.33Å; I68-N70 PolarHBondContact O-N 3.17Å; I68-K71 PolarHBondContact O-N 3.24Å; I68-M72 HydrophobicContact CG2-CG 4.43Å; I68-M72 HydrophobicContact CG2-SD 4.07Å; I68-M72 WeakPolarHBondContact O-CG 3.44Å; I68-M72 PolarHBondContact O-N 3.18Å |
| 69 | E | 75.5 | Confident | 74.3 | Confident | 9 Ų | 9 | 90.5 Ų | 90.5 | 4% | 0.042 | 46% | 0.459 | C | S | . | . | H | α-helix | trans | -65.6 | -36 | 178.4 | -75.9 | 176.7 | 137.5 | 0 | 0 | 111.8 | R14 L16 S17 I65 K71 M72 L73 | R14-E69 VanDerWaalsContact CA-OE1 3.23Å; R14-E69 WeakPolarHBondContact CA-OE1 3.44Å; R14-E69 WeakPolarHBondContact CB-OE1 3.47Å; R14-E69 WeakPolarHBondContact CB-OE2 3.48Å; R14-E69 IonicContact CZ-OE2 3.09Å; R14-E69 IonicContact NE-OE2 2.68Å; R14-E69 PolarHBondContact NE-OE2 3.46Å; R14-E69 VanDerWaalsContact NH2-CB 3.31Å; R14-E69 IonicContact NH2-OE2 2.73Å; R14-E69 PolarHBondContact NH2-OE2 3.39Å; L16-E69 WeakPolarHBondContact CA-OE1 3.38Å; L16-E69 HydrophobicContact CB-CG 4.12Å; L16-E69 VanDerWaalsContact CB-OE1 3.28Å; L16-E69 WeakPolarHBondContact CB-OE1 3.46Å; L16-E69 HydrophobicContact CD1-CG 3.87Å; L16-E69 HydrophobicContact CG-CG 4.38Å; L16-E69 PolarHBondContact N-OE1 2.91Å; S17-E69 PolarHBondContact N-OE1 3.27Å; S17-E69 PolarHBondContact OG-OE2 2.93Å; I65-E69 HydrophobicContact CG2-CG 4.38Å; I65-E69 PolarHBondContact O-N 3.46Å; E69-K71 VanDerWaalsContact C-N 3.33Å; E69-K71 PolarHBondContact O-N 3.49Å; E69-M72 PolarHBondContact O-N 3.45Å; E69-L73 WeakPolarHBondContact O-CB 3.34Å; E69-L73 WeakPolarHBondContact O-CG 3.39Å; E69-L73 PolarHBondContact O-N 3.36Å |
| 70 | N | 73.6 | Confident | 73.7 | Confident | 54 Ų | 54 | 89.9 Ų | 89.9 | 29% | 0.289 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -60.5 | -42.2 | 173.1 | -71.8 | -10.7 | 0 | 0 | 0 | 111.7 | S66 L67 I68 K74 | S66-N70 PolarHBondContact O-N 2.73Å; S66-N70 PolarHBondContact O-ND2 3.12Å; S66-N70 PolarHBondContact O-OD1 3.5Å; L67-N70 PolarHBondContact O-N 2.91Å; I68-N70 VanDerWaalsContact C-N 3.33Å; I68-N70 PolarHBondContact O-N 3.17Å; N70-K74 PolarHBondContact O-N 2.74Å |
| 71 | K | 75.5 | Confident | 73 | Confident | 153 Ų | 153 | 89.5 Ų | 89.5 | 67% | 0.665 | 45% | 0.452 | S | S | * | . | H | α-helix | trans | -66.7 | -40.8 | 175.4 | -77.1 | 176 | 177 | -78.5 | 0 | 112.2 | L67 I68 E69 K74 | L67-K71 WeakPolarHBondContact O-CG 3.48Å; L67-K71 PolarHBondContact O-N 2.95Å; I68-K71 PolarHBondContact O-N 3.24Å; E69-K71 VanDerWaalsContact C-N 3.33Å; E69-K71 PolarHBondContact O-N 3.49Å; K71-K74 PolarHBondContact O-N 3.02Å |
| 72 | M | 72.1 | Confident | 72.4 | Confident | 136 Ų | 136 | 91.7 Ų | 91.7 | 67% | 0.67 | 46% | 0.463 | S | S | * | . | H | α-helix | trans | -66.2 | -38.6 | 178.7 | -73.4 | -178.2 | 72.4 | 0 | 0 | 112.3 | L16 I68 E69 K74 | L16-M72 HydrophobicContact CD1-SD 4.46Å; I68-M72 HydrophobicContact CG2-CG 4.43Å; I68-M72 HydrophobicContact CG2-SD 4.07Å; I68-M72 WeakPolarHBondContact O-CG 3.44Å; I68-M72 PolarHBondContact O-N 3.18Å; E69-M72 PolarHBondContact O-N 3.45Å; M72-K74 PolarHBondContact O-N 2.93Å |
| 73 | L | 71.8 | Confident | 71.8 | Confident | 88 Ų | 88 | 93.6 Ų | 93.6 | 46% | 0.461 | 47% | 0.473 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -77.9 | 2.1 | 179 | -70.1 | 168.4 | 0 | 0 | 0 | 113.4 | E69 W75 | E69-L73 WeakPolarHBondContact O-CB 3.34Å; E69-L73 WeakPolarHBondContact O-CG 3.39Å; E69-L73 PolarHBondContact O-N 3.36Å; L73-W75 PolarHBondContact O-N 2.94Å |
| 74 | K | 59.6 | Low | 71.3 | Confident | 188 Ų | 188 | 96.9 Ų | 96.9 | 82% | 0.817 | 48% | 0.484 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 43.7 | 39.7 | 179.5 | -65.7 | -173.9 | -179.8 | 179.4 | 0 | 113 | N70 K71 M72 | N70-K74 PolarHBondContact O-N 2.74Å; K71-K74 PolarHBondContact O-N 3.02Å; M72-K74 PolarHBondContact O-N 2.93Å |
| 75 | W | 50.9 | Low | 70.4 | Confident | 169 Ų | 169 | 99.8 Ų | 99.8 | 64% | 0.64 | 49% | 0.492 | S | S | * | . | trans | -78.5 | 131.1 | 173.1 | -133.7 | -62.6 | 0 | 0 | 0 | 108.4 | L73 | L73-W75 PolarHBondContact O-N 2.94Š| ||
| 76 | P | 48 | Very low | 69.3 | Low | 165 Ų | 165 | 106.1 Ų | 106.1 | 100% | 1.071 | 52% | 0.523 | S | S | * | . | trans | -63 | 0 | 170.4 | 26.8 | -35.7 | 0 | 0 | 0 | 112.9 |
Retrieved 76 of 76 residues in 16 ms
(Link to these results)