| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 60.8 | Low | 75.1 | Confident | 205 Ų | 205 | 89.7 Ų | 89.7 | 100% | 1.01 | 57% | 0.566 | S | S | * | * | 0 | -53 | 0 | -145.7 | 165.4 | -78.4 | 0 | 0 | 111.7 | A3 A4 V5 | M1-A3 PolarHBondContact O-N 3.5Å; M1-A4 PolarHBondContact O-N 3.28Å; M1-V5 WeakPolarHBondContact O-CG2 3.28Å; M1-V5 PolarHBondContact O-N 2.64Å | |||
| 2 | A | 66.6 | Low | 75.7 | Confident | 84 Ų | 84 | 92.3 Ų | 92.3 | 69% | 0.694 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -55.2 | -43.5 | 178.4 | 0 | 0 | 0 | 0 | 0 | 115.1 | A4 V5 A6 | A2-A4 PolarHBondContact O-N 3.07Å; A2-V5 PolarHBondContact O-N 2.89Å; A2-A6 PolarHBondContact O-N 2.76Å |
| 3 | A | 69.4 | Low | 76 | Confident | 82 Ų | 82 | 93.8 Ų | 93.8 | 68% | 0.678 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -64.7 | -36.9 | 179 | 0 | 0 | 0 | 0 | 0 | 113.5 | M1 A6 A7 | M1-A3 PolarHBondContact O-N 3.5Å; A3-A6 PolarHBondContact O-N 3.19Å; A3-A7 PolarHBondContact O-N 3.1Å |
| 4 | A | 73.9 | Confident | 75.9 | Confident | 67 Ų | 67 | 89.9 Ų | 89.9 | 55% | 0.554 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -69.1 | -36.7 | 177.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | M1 A2 A7 A8 | M1-A4 PolarHBondContact O-N 3.28Å; A2-A4 PolarHBondContact O-N 3.07Å; A4-A7 PolarHBondContact O-N 3.34Å; A4-A8 WeakPolarHBondContact O-CB 3.21Å; A4-A8 PolarHBondContact O-N 2.84Å |
| 5 | V | 81.5 | Confident | 75.8 | Confident | 82 Ų | 82 | 87.6 Ų | 87.6 | 50% | 0.497 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -66.2 | -43.9 | 174.8 | 176.9 | 0 | 0 | 0 | 0 | 110.5 | M1 A2 A7 A8 L9 | M1-V5 WeakPolarHBondContact O-CG2 3.28Å; M1-V5 PolarHBondContact O-N 2.64Å; A2-V5 PolarHBondContact O-N 2.89Å; V5-A7 PolarHBondContact O-N 3.44Å; V5-A8 PolarHBondContact O-N 3.34Å; V5-L9 HydrophobicContact CG1-CD1 4.1Å; V5-L9 HydrophobicContact CG1-CG 4.5Å; V5-L9 WeakPolarHBondContact O-CG 3.46Å; V5-L9 PolarHBondContact O-N 2.66Å |
| 6 | A | 77.4 | Confident | 75.8 | Confident | 57 Ų | 57 | 91.1 Ų | 91.1 | 47% | 0.471 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -60.5 | -43.8 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | A2 A3 A8 L9 A10 | A2-A6 PolarHBondContact O-N 2.76Å; A3-A6 PolarHBondContact O-N 3.19Å; A6-A8 PolarHBondContact O-N 3.16Å; A6-L9 PolarHBondContact O-N 3.45Å; A6-A10 WeakPolarHBondContact O-CB 3.47Å; A6-A10 PolarHBondContact O-N 2.95Å |
| 7 | A | 75.4 | Confident | 75.5 | Confident | 37 Ų | 37 | 92.6 Ų | 92.6 | 31% | 0.306 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -66.5 | -36.1 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | A3 A4 V5 R11 | A3-A7 PolarHBondContact O-N 3.1Å; A4-A7 PolarHBondContact O-N 3.34Å; V5-A7 PolarHBondContact O-N 3.44Å; A7-R11 VanDerWaalsContact O-CG 3.3Å; A7-R11 WeakPolarHBondContact O-CG 3.14Å; A7-R11 PolarHBondContact O-N 3.21Å; A7-R11 VanDerWaalsContact O-N 3.11Å |
| 8 | A | 79.8 | Confident | 75.1 | Confident | 46 Ų | 46 | 92.2 Ų | 92.2 | 38% | 0.38 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -66.4 | -43.3 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | A4 V5 A6 R11 L12 | A4-A8 WeakPolarHBondContact O-CB 3.21Å; A4-A8 PolarHBondContact O-N 2.84Å; V5-A8 PolarHBondContact O-N 3.34Å; A6-A8 PolarHBondContact O-N 3.16Å; A8-R11 PolarHBondContact O-N 3.3Å; A8-L12 WeakPolarHBondContact O-CG 3.49Å; A8-L12 PolarHBondContact O-N 3.45Å |
| 9 | L | 80.2 | Confident | 74.7 | Confident | 99 Ų | 99 | 92.8 Ų | 92.8 | 52% | 0.518 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -63.5 | -42.9 | 176 | -69.5 | 172 | 0 | 0 | 0 | 111.9 | V5 A6 R11 L12 L13 | V5-L9 HydrophobicContact CG1-CD1 4.1Å; V5-L9 HydrophobicContact CG1-CG 4.5Å; V5-L9 WeakPolarHBondContact O-CG 3.46Å; V5-L9 PolarHBondContact O-N 2.66Å; A6-L9 PolarHBondContact O-N 3.45Å; L9-R11 VanDerWaalsContact C-N 3.32Å; L9-R11 PolarHBondContact O-N 3.15Å; L9-L12 PolarHBondContact O-N 3.1Å; L9-L13 WeakPolarHBondContact O-CB 3.25Å; L9-L13 VanDerWaalsContact O-CG 3.32Å; L9-L13 WeakPolarHBondContact O-CG 3.48Å; L9-L13 PolarHBondContact O-N 3.43Å |
| 10 | A | 79.8 | Confident | 74.1 | Confident | 57 Ų | 57 | 90.5 Ų | 90.5 | 47% | 0.471 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -59.9 | -41.8 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | A6 L13 A14 | A6-A10 WeakPolarHBondContact O-CB 3.47Å; A6-A10 PolarHBondContact O-N 2.95Å; A10-L13 PolarHBondContact O-N 3.27Å; A10-A14 WeakPolarHBondContact O-CB 3.4Å; A10-A14 PolarHBondContact O-N 3.09Å |
| 11 | R | 81.4 | Confident | 73.3 | Confident | 171 Ų | 171 | 87.1 Ų | 87.1 | 65% | 0.645 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -65.1 | -41.3 | 176.4 | -73.4 | 176.5 | 178.2 | 110.4 | 2.1 | 112.4 | A7 A8 L9 A14 A15 | A7-R11 VanDerWaalsContact O-CG 3.3Å; A7-R11 WeakPolarHBondContact O-CG 3.14Å; A7-R11 PolarHBondContact O-N 3.21Å; A7-R11 VanDerWaalsContact O-N 3.11Å; A8-R11 PolarHBondContact O-N 3.3Å; L9-R11 VanDerWaalsContact C-N 3.32Å; L9-R11 PolarHBondContact O-N 3.15Å; R11-A14 PolarHBondContact O-N 3.28Å; R11-A15 WeakPolarHBondContact O-CB 3.31Å; R11-A15 PolarHBondContact O-N 3.35Å |
| 12 | L | 82.3 | Confident | 73.2 | Confident | 120 Ų | 120 | 83.7 Ų | 83.7 | 63% | 0.628 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -65.1 | -42.6 | 176.6 | -71.3 | 170.5 | 0 | 0 | 0 | 111.8 | A8 L9 A15 F16 | A8-L12 WeakPolarHBondContact O-CG 3.49Å; A8-L12 PolarHBondContact O-N 3.45Å; L9-L12 PolarHBondContact O-N 3.1Å; L12-A15 PolarHBondContact O-N 3.4Å; L12-F16 WeakPolarHBondContact O-CB 3.39Å; L12-F16 PolarHBondContact O-N 3.37Å |
| 13 | L | 80 | Confident | 72.6 | Confident | 113 Ų | 113 | 85.4 Ų | 85.4 | 59% | 0.592 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -64.2 | -43.7 | 175.9 | -70.4 | 172.3 | 0 | 0 | 0 | 111.7 | L9 A10 F16 L17 | L9-L13 WeakPolarHBondContact O-CB 3.25Å; L9-L13 VanDerWaalsContact O-CG 3.32Å; L9-L13 WeakPolarHBondContact O-CG 3.48Å; L9-L13 PolarHBondContact O-N 3.43Å; A10-L13 PolarHBondContact O-N 3.27Å; L13-F16 PolarHBondContact O-N 3.24Å; L13-L17 WeakPolarHBondContact O-CB 3.25Å; L13-L17 VanDerWaalsContact O-CG 3.28Å; L13-L17 WeakPolarHBondContact O-CG 3.49Å; L13-L17 PolarHBondContact O-N 2.64Å |
| 14 | A | 73.6 | Confident | 71.7 | Confident | 38 Ų | 38 | 84.2 Ų | 84.2 | 31% | 0.314 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -61.5 | -44.7 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112 | A10 R11 F16 L17 L18 | A10-A14 WeakPolarHBondContact O-CB 3.4Å; A10-A14 PolarHBondContact O-N 3.09Å; R11-A14 PolarHBondContact O-N 3.28Å; A14-F16 VanDerWaalsContact C-N 3.34Å; A14-F16 PolarHBondContact O-N 3.11Å; A14-L17 PolarHBondContact O-N 3.33Å; A14-L18 VanDerWaalsContact O-CG 3.3Å; A14-L18 WeakPolarHBondContact O-CG 3.44Å; A14-L18 PolarHBondContact O-N 2.94Å |
| 15 | A | 74.3 | Confident | 70.7 | Confident | 56 Ų | 56 | 82.3 Ų | 82.3 | 46% | 0.463 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -62 | -41.5 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | R11 L12 L18 L19 | R11-A15 WeakPolarHBondContact O-CB 3.31Å; R11-A15 PolarHBondContact O-N 3.35Å; L12-A15 PolarHBondContact O-N 3.4Å; A15-L18 PolarHBondContact O-N 3.49Å; A15-L19 WeakPolarHBondContact O-CB 3.39Å; A15-L19 PolarHBondContact O-N 3.3Å |
| 16 | F | 77.1 | Confident | 69 | Low | 144 Ų | 144 | 83.8 Ų | 83.8 | 63% | 0.632 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -64.1 | -43.4 | 176.4 | -176.9 | -98.7 | 0 | 0 | 0 | 112.2 | L12 L13 A14 L19 A20 | L12-F16 WeakPolarHBondContact O-CB 3.39Å; L12-F16 PolarHBondContact O-N 3.37Å; L13-F16 PolarHBondContact O-N 3.24Å; A14-F16 VanDerWaalsContact C-N 3.34Å; A14-F16 PolarHBondContact O-N 3.11Å; F16-L19 PolarHBondContact O-N 2.99Å; F16-A20 WeakPolarHBondContact O-CB 3.4Å; F16-A20 PolarHBondContact O-N 3.01Å |
| 17 | L | 69.3 | Low | 67.6 | Low | 116 Ų | 116 | 87.8 Ų | 87.8 | 61% | 0.607 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -64.6 | -39.2 | 176.7 | -71.5 | 171.2 | 0 | 0 | 0 | 112.2 | L13 A14 A20 A21 | L13-L17 WeakPolarHBondContact O-CB 3.25Å; L13-L17 VanDerWaalsContact O-CG 3.28Å; L13-L17 WeakPolarHBondContact O-CG 3.49Å; L13-L17 PolarHBondContact O-N 2.64Å; A14-L17 PolarHBondContact O-N 3.33Å; L17-A20 PolarHBondContact O-N 3.36Å; L17-A21 WeakPolarHBondContact O-CB 3.35Å; L17-A21 PolarHBondContact O-N 2.78Å |
| 18 | L | 69.6 | Low | 66.4 | Low | 86 Ų | 86 | 86.8 Ų | 86.8 | 45% | 0.45 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -64.5 | -41.3 | 174.6 | -72.9 | 170.3 | 0 | 0 | 0 | 111.8 | A14 A15 A21 Q22 L75 | A14-L18 VanDerWaalsContact O-CG 3.3Å; A14-L18 WeakPolarHBondContact O-CG 3.44Å; A14-L18 PolarHBondContact O-N 2.94Å; A15-L18 PolarHBondContact O-N 3.49Å; L18-A21 PolarHBondContact O-N 3.12Å; L18-Q22 WeakPolarHBondContact O-CG 3.33Å; L18-Q22 PolarHBondContact O-N 3.07Å; L18-L75 HydrophobicContact CD1-CD1 4.38Å |
| 19 | L | 67.3 | Low | 64.6 | Low | 104 Ų | 104 | 89.5 Ų | 89.5 | 55% | 0.545 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -66.9 | -42.5 | 176.9 | -162.1 | 70.8 | 0 | 0 | 0 | 111.2 | A15 F16 A21 Q22 V23 | A15-L19 WeakPolarHBondContact O-CB 3.39Å; A15-L19 PolarHBondContact O-N 3.3Å; F16-L19 PolarHBondContact O-N 2.99Å; L19-A21 VanDerWaalsContact C-N 3.32Å; L19-A21 PolarHBondContact O-N 3.04Å; L19-Q22 WeakPolarHBondContact O-CB 3.3Å; L19-Q22 PolarHBondContact O-N 3.26Å; L19-V23 WeakPolarHBondContact O-CG2 3.3Å; L19-V23 PolarHBondContact O-N 3.21Å |
| 20 | A | 61.8 | Low | 63.1 | Low | 45 Ų | 45 | 86.7 Ų | 86.7 | 37% | 0.372 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -62.8 | -38.5 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | F16 L17 V23 A24 | F16-A20 WeakPolarHBondContact O-CB 3.4Å; F16-A20 PolarHBondContact O-N 3.01Å; L17-A20 PolarHBondContact O-N 3.36Å; A20-V23 PolarHBondContact O-N 3.46Å; A20-A24 WeakPolarHBondContact O-CB 3.48Å; A20-A24 PolarHBondContact O-N 2.86Å |
| 21 | A | 58.4 | Low | 61.6 | Low | 20 Ų | 20 | 89.4 Ų | 89.4 | 17% | 0.165 | 47% | 0.473 | C | S | . | . | H | α-helix | trans | -66.3 | -34.9 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | L17 L18 L19 C25 | L17-A21 WeakPolarHBondContact O-CB 3.35Å; L17-A21 PolarHBondContact O-N 2.78Å; L18-A21 PolarHBondContact O-N 3.12Å; L19-A21 VanDerWaalsContact C-N 3.32Å; L19-A21 PolarHBondContact O-N 3.04Å; A21-C25 PolarHBondContact O-N 3.42Å; A21-C25 PolarHBondContact O-SG 3.27Å |
| 22 | Q | 58.2 | Low | 60.1 | Low | 133 Ų | 133 | 84.4 Ų | 84.4 | 62% | 0.621 | 46% | 0.462 | S | S | * | . | H | α-helix | trans | -66.1 | -38.2 | 172 | -73 | -179.6 | 3.1 | 0 | 0 | 112.1 | L18 L19 C25 | L18-Q22 WeakPolarHBondContact O-CG 3.33Å; L18-Q22 PolarHBondContact O-N 3.07Å; L19-Q22 WeakPolarHBondContact O-CB 3.3Å; L19-Q22 PolarHBondContact O-N 3.26Å; Q22-C25 WeakPolarHBondContact O-CB 3.45Å; Q22-C25 PolarHBondContact O-N 3.49Å |
| 23 | V | 53.5 | Low | 58.4 | Low | 120 Ų | 120 | 83.9 Ų | 83.9 | 73% | 0.727 | 46% | 0.464 | S | S | * | . | H | α-helix | trans | -77.2 | -29.4 | 177.8 | 177.7 | 0 | 0 | 0 | 0 | 112.1 | L19 A20 C25 | L19-V23 WeakPolarHBondContact O-CG2 3.3Å; L19-V23 PolarHBondContact O-N 3.21Å; A20-V23 PolarHBondContact O-N 3.46Å; V23-C25 PolarHBondContact O-N 3.28Å |
| 24 | A | 51.8 | Low | 56.9 | Low | 57 Ų | 57 | 81.4 Ų | 81.4 | 47% | 0.471 | 46% | 0.455 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -79.3 | -0.4 | 174.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | A20 E26 | A20-A24 WeakPolarHBondContact O-CB 3.48Å; A20-A24 PolarHBondContact O-N 2.86Å; A24-E26 PolarHBondContact O-N 3.22Å; A24-E26 VanDerWaalsContact O-N 3.16Å |
| 25 | C | 51.4 | Low | 55.7 | Low | 27 Ų | 27 | 89.3 Ų | 89.3 | 18% | 0.182 | 49% | 0.486 | C | S | . | . | S | Bend | trans | -63.8 | 113.5 | 163.2 | -65.2 | 0 | 0 | 0 | 0 | 107.8 | A21 Q22 V23 Y27 Y48 N49 | A21-C25 PolarHBondContact O-N 3.42Å; A21-C25 PolarHBondContact O-SG 3.27Å; Q22-C25 WeakPolarHBondContact O-CB 3.45Å; Q22-C25 PolarHBondContact O-N 3.49Å; V23-C25 PolarHBondContact O-N 3.28Å; C25-Y27 PolarHBondContact O-N 3.46Å; C25-Y48 CarbonylContact C-O 3.46Å; C25-Y48 WeakPolarHBondContact CA-O 3.39Å; C25-Y48 WeakPolarHBondContact CB-O 3.41Å; C25-N49 VanDerWaalsContact SG-CB 3.57Å |
| 26 | E | 47.2 | Very low | 54.5 | Low | 114 Ų | 114 | 90.5 Ų | 90.5 | 53% | 0.533 | 50% | 0.496 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -66.9 | 128.5 | -177.8 | -166.6 | -179.1 | 105.9 | 0 | 0 | 109.4 | A24 G28 Y48 | A24-E26 PolarHBondContact O-N 3.22Å; A24-E26 VanDerWaalsContact O-N 3.16Å; E26-G28 PolarHBondContact O-N 3.16Å; E26-G28 VanDerWaalsContact O-N 3.09Å; E26-Y48 HydrophobicContact CB-CE1 3.83Å; E26-Y48 HydrophobicContact CG-CE1 4.25Å; E26-Y48 PolarHBondContact N-O 3.49Å; E26-Y48 VanDerWaalsContact N-O 3.11Å; E26-Y48 VanDerWaalsContact O-CD1 3.25Å; E26-Y48 WeakPolarHBondContact O-CD1 3.35Å; E26-Y48 WeakPolarHBondContact O-CE1 3.2Å; E26-Y48 PolarHBondContact OE1-OH 3.26Å |
| 27 | Y | 47.2 | Very low | 53 | Low | 140 Ų | 140 | 87.6 Ų | 87.6 | 55% | 0.549 | 51% | 0.506 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -77.4 | 95.4 | 178.5 | -171.7 | -93.1 | 0 | 0 | 0 | 109.3 | C25 M29 C45 L47 | C25-Y27 PolarHBondContact O-N 3.46Å; Y27-M29 HydrophobicContact CD1-CG 4.19Å; Y27-M29 HydrophobicContact CE1-CG 3.56Å; Y27-M29 HydrophobicContact CE1-SD 3.66Å; Y27-C45 HydrophobicContact CE2-CB 4.19Å; Y27-C45 WeakPolarHBondContact OH-CB 3.32Å; Y27-C45 PolarHBondContact OH-SG 3Å; Y27-L47 HydrophobicContact CD2-CD1 3.85Å; Y27-L47 HydrophobicContact CE2-CD1 4.17Å |
| 28 | G | 50.2 | Low | 52.2 | Low | 16 Ų | 16 | 83.8 Ų | 83.8 | 17% | 0.165 | 50% | 0.495 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -94.1 | 113.3 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111.3 | E26 I46 | E26-G28 PolarHBondContact O-N 3.16Å; E26-G28 VanDerWaalsContact O-N 3.09Å; G28-I46 PolarHBondContact O-N 3.49Å |
| 29 | M | 41.7 | Very low | 51.3 | Low | 103 Ų | 103 | 86.6 Ų | 86.6 | 51% | 0.507 | 52% | 0.519 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -82.1 | 113.9 | 166.2 | -74.2 | -67.9 | -69.5 | 0 | 0 | 108.6 | Y27 D43 C45 | Y27-M29 HydrophobicContact CD1-CG 4.19Å; Y27-M29 HydrophobicContact CE1-CG 3.56Å; Y27-M29 HydrophobicContact CE1-SD 3.66Å; M29-D43 HydrophobicContact CE-CB 4.22Å; M29-C45 HydrophobicContact SD-CB 3.93Å; M29-C45 PolarHBondContact SD-SG 3.26Å |
| 30 | V | 48.4 | Very low | 50.6 | Low | 41 Ų | 41 | 88.4 Ų | 88.4 | 25% | 0.248 | 52% | 0.524 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -107.2 | 114.4 | 177.5 | 179 | 0 | 0 | 0 | 0 | 109.1 | V32 Y44 | V30-V32 HydrophobicContact CG1-CG2 4.32Å; V30-V32 PolarHBondContact O-N 2.95Å; V30-Y44 PolarHBondContact N-O 2.92Å |
| 31 | H | 48.3 | Very low | 50.2 | Low | 113 Ų | 113 | 87.4 Ų | 87.4 | 52% | 0.523 | 52% | 0.519 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -82.7 | 107.5 | 175.2 | -167.8 | 77.6 | 0 | 0 | 0 | 109.1 | V33 D43 | H31-V33 VanDerWaalsContact CD2-CG2 3.48Å; H31-V33 WeakPolarHBondContact CD2-CG2 3.37Å; H31-V33 PolarHBondContact O-N 2.95Å; H31-D43 IonicContact CE1-OD1 3.62Å; H31-D43 IonicContact CG-OD1 3.57Å; H31-D43 IonicContact ND1-OD1 2.66Å; H31-D43 PolarHBondContact ND1-OD1 3.34Å; H31-D43 IonicContact ND1-OD2 3.91Å |
| 32 | V | 51.3 | Low | 49.8 | Very low | 67 Ų | 67 | 91.7 Ų | 91.7 | 41% | 0.406 | 53% | 0.534 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -89.4 | 104.2 | 176.8 | -176.8 | 0 | 0 | 0 | 0 | 108.7 | V30 G41 Y44 | V30-V32 HydrophobicContact CG1-CG2 4.32Å; V30-V32 PolarHBondContact O-N 2.95Å; V32-G41 WeakPolarHBondContact O-CA 3.48Å; V32-Y44 HydrophobicContact CG2-CD2 4.41Å |
| 33 | V | 45.7 | Very low | 49.4 | Very low | 109 Ų | 109 | 90 Ų | 90 | 66% | 0.661 | 53% | 0.529 | S | S | * | . | trans | -81 | 117.9 | 170 | -170.6 | 0 | 0 | 0 | 0 | 108.2 | H31 Q35 | H31-V33 VanDerWaalsContact CD2-CG2 3.48Å; H31-V33 WeakPolarHBondContact CD2-CG2 3.37Å; H31-V33 PolarHBondContact O-N 2.95Å; V33-Q35 PolarHBondContact O-N 3.32Å | ||
| 34 | S | 49.4 | Very low | 49.1 | Very low | 60 Ų | 60 | 90.4 Ų | 90.4 | 42% | 0.42 | 52% | 0.518 | S | S | . | . | trans | -61.7 | 122.9 | 173.9 | -176.2 | 0 | 0 | 0 | 0 | 109.6 | A36 | S34-A36 PolarHBondContact O-N 3.42Å; S34-A36 PolarHBondContact OG-N 3.47Å | ||
| 35 | Q | 47.6 | Very low | 49 | Very low | 204 Ų | 204 | 91.2 Ų | 91.2 | 95% | 0.953 | 52% | 0.519 | S | S | * | . | S | Bend | trans | -59.1 | -19.9 | 175.5 | -170.5 | -179.3 | 65 | 0 | 0 | 111.9 | V33 G37 | V33-Q35 PolarHBondContact O-N 3.32Å; Q35-G37 VanDerWaalsContact C-N 3.3Å; Q35-G37 PolarHBondContact O-N 3.41Å |
| 36 | A | 48.7 | Very low | 49.1 | Very low | 81 Ų | 81 | 92.5 Ų | 92.5 | 67% | 0.669 | 52% | 0.524 | S | S | * | . | S | Bend | trans | -87.5 | 54.7 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | S34 G38 | S34-A36 PolarHBondContact O-N 3.42Å; S34-A36 PolarHBondContact OG-N 3.47Å; A36-G38 PolarHBondContact O-N 2.85Å |
| 37 | G | 47.1 | Very low | 49.2 | Very low | 83 Ų | 83 | 92.7 Ų | 92.7 | 86% | 0.856 | 53% | 0.528 | S | S | * | . | trans | 43.7 | 16.6 | 156.8 | 0 | 0 | 0 | 0 | 0 | 120.3 | Q35 | Q35-G37 VanDerWaalsContact C-N 3.3Å; Q35-G37 PolarHBondContact O-N 3.41Å | ||
| 38 | G | 52.1 | Low | 49.3 | Very low | 36 Ų | 36 | 88 Ų | 88 | 37% | 0.371 | 51% | 0.51 | S | S | . | . | trans | -104.5 | 139.9 | -174.1 | 0 | 0 | 0 | 0 | 0 | 110.1 | A36 E40 | A36-G38 PolarHBondContact O-N 2.85Å; G38-E40 PolarHBondContact O-N 3.44Å | ||
| 39 | P | 50.2 | Low | 49.1 | Very low | 146 Ų | 146 | 88.1 Ų | 88.1 | 95% | 0.948 | 51% | 0.506 | S | S | * | . | S | Bend | trans | -69.5 | 8.8 | -168.6 | 28.3 | -36 | 0 | 0 | 0 | 115.6 | ||
| 40 | E | 53.5 | Low | 49.4 | Very low | 141 Ų | 141 | 85.7 Ų | 85.7 | 66% | 0.659 | 50% | 0.498 | S | S | * | . | trans | -111 | 72.2 | -175.6 | -135.6 | -168.1 | 128.5 | 0 | 0 | 110.5 | G38 K42 | G38-E40 PolarHBondContact O-N 3.44Å; E40-K42 PolarHBondContact O-N 2.95Å; E40-K42 VanDerWaalsContact OE1-CE 3.28Å; E40-K42 WeakPolarHBondContact OE1-CE 3.28Å | ||
| 41 | G | 52.3 | Low | 49.4 | Very low | 25 Ų | 25 | 90.6 Ų | 90.6 | 26% | 0.258 | 52% | 0.519 | S | S | . | . | trans | -69.4 | 113.3 | 161 | 0 | 0 | 0 | 0 | 0 | 108.2 | V32 | V32-G41 WeakPolarHBondContact O-CA 3.48Š| ||
| 42 | K | 50.5 | Low | 49.2 | Very low | 110 Ų | 110 | 94.4 Ų | 94.4 | 48% | 0.478 | 53% | 0.528 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -82.9 | 121.7 | 177.2 | -75.6 | -158.8 | 176.8 | -167.6 | 0 | 109.6 | E40 Y44 | E40-K42 PolarHBondContact O-N 2.95Å; E40-K42 VanDerWaalsContact OE1-CE 3.28Å; E40-K42 WeakPolarHBondContact OE1-CE 3.28Å; K42-Y44 HydrophobicContact CB-CD2 4.18Å; K42-Y44 HydrophobicContact CB-CE2 3.45Å; K42-Y44 VanDerWaalsContact CB-CE2 3.45Å; K42-Y44 WeakPolarHBondContact CD-OH 3.44Å; K42-Y44 VanDerWaalsContact O-CD2 3.25Å; K42-Y44 WeakPolarHBondContact O-CD2 3.36Å; K42-Y44 PolarHBondContact O-N 2.92Å |
| 43 | D | 49.3 | Very low | 48.9 | Very low | 96 Ų | 96 | 93.8 Ų | 93.8 | 51% | 0.513 | 53% | 0.53 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -73.5 | 118.3 | 171.2 | -70.5 | -52.3 | 0 | 0 | 0 | 109.7 | M29 H31 | M29-D43 HydrophobicContact CE-CB 4.22Å; H31-D43 IonicContact CE1-OD1 3.62Å; H31-D43 IonicContact CG-OD1 3.57Å; H31-D43 IonicContact ND1-OD1 2.66Å; H31-D43 PolarHBondContact ND1-OD1 3.34Å; H31-D43 IonicContact ND1-OD2 3.91Å |
| 44 | Y | 48.1 | Very low | 49.1 | Very low | 129 Ų | 129 | 96.9 Ų | 96.9 | 51% | 0.506 | 54% | 0.537 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -112.4 | 124 | 172.4 | -64.2 | -82.3 | 0 | 0 | 0 | 109.2 | V30 V32 K42 | V30-Y44 PolarHBondContact N-O 2.92Å; V32-Y44 HydrophobicContact CG2-CD2 4.41Å; K42-Y44 HydrophobicContact CB-CD2 4.18Å; K42-Y44 HydrophobicContact CB-CE2 3.45Å; K42-Y44 VanDerWaalsContact CB-CE2 3.45Å; K42-Y44 WeakPolarHBondContact CD-OH 3.44Å; K42-Y44 VanDerWaalsContact O-CD2 3.25Å; K42-Y44 WeakPolarHBondContact O-CD2 3.36Å; K42-Y44 PolarHBondContact O-N 2.92Å |
| 45 | C | 48.7 | Very low | 49 | Very low | 74 Ų | 74 | 97.8 Ų | 97.8 | 50% | 0.5 | 54% | 0.537 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -79 | 119.1 | 170.3 | -45.2 | 0 | 0 | 0 | 0 | 108.2 | Y27 M29 | Y27-C45 HydrophobicContact CE2-CB 4.19Å; Y27-C45 WeakPolarHBondContact OH-CB 3.32Å; Y27-C45 PolarHBondContact OH-SG 3Å; M29-C45 HydrophobicContact SD-CB 3.93Å; M29-C45 PolarHBondContact SD-SG 3.26Å |
| 46 | I | 52.8 | Low | 48.9 | Very low | 55 Ų | 55 | 91.9 Ų | 91.9 | 28% | 0.282 | 52% | 0.517 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -115.9 | 115.8 | 176.4 | -55.9 | 176.5 | 0 | 0 | 0 | 107.5 | G28 Y48 L59 | G28-I46 PolarHBondContact O-N 3.49Å; I46-Y48 PolarHBondContact O-N 3.11Å; I46-L59 HydrophobicContact CD1-CD2 3.33Å |
| 47 | L | 49.3 | Very low | 49 | Very low | 117 Ų | 117 | 97.3 Ų | 97.3 | 61% | 0.613 | 53% | 0.527 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -72.9 | 110.9 | 163.1 | -103.2 | 75.7 | 0 | 0 | 0 | 107.1 | Y27 | Y27-L47 HydrophobicContact CD2-CD1 3.85Å; Y27-L47 HydrophobicContact CE2-CD1 4.17Å |
| 48 | Y | 49.7 | Very low | 49 | Very low | 43 Ų | 43 | 98.8 Ų | 98.8 | 17% | 0.169 | 52% | 0.516 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.8 | 138.5 | 175.2 | 85.3 | -84.7 | 0 | 0 | 0 | 109.7 | C25 E26 I46 P50 L55 | C25-Y48 CarbonylContact C-O 3.46Å; C25-Y48 WeakPolarHBondContact CA-O 3.39Å; C25-Y48 WeakPolarHBondContact CB-O 3.41Å; E26-Y48 HydrophobicContact CB-CE1 3.83Å; E26-Y48 HydrophobicContact CG-CE1 4.25Å; E26-Y48 PolarHBondContact N-O 3.49Å; E26-Y48 VanDerWaalsContact N-O 3.11Å; E26-Y48 VanDerWaalsContact O-CD1 3.25Å; E26-Y48 WeakPolarHBondContact O-CD1 3.35Å; E26-Y48 WeakPolarHBondContact O-CE1 3.2Å; E26-Y48 PolarHBondContact OE1-OH 3.26Å; I46-Y48 PolarHBondContact O-N 3.11Å; Y48-P50 HydrophobicContact CE2-CB 3.95Å; Y48-P50 HydrophobicContact CE2-CG 4.45Å; Y48-P50 WeakPolarHBondContact O-CD 3.5Å; Y48-L55 HydrophobicContact CD2-CB 4.37Å; Y48-L55 HydrophobicContact CE2-CB 4.48Å; Y48-L55 HydrophobicContact CG-CD1 4.39Å |
| 49 | N | 46.6 | Very low | 48.8 | Very low | 17 Ų | 17 | 99.7 Ų | 99.7 | 9% | 0.091 | 51% | 0.512 | C | S | . | . | trans | -98.9 | 106.4 | 175.3 | -171.4 | -6.3 | 0 | 0 | 0 | 108.7 | C25 Q51 W52 A53 | C25-N49 VanDerWaalsContact SG-CB 3.57Å; N49-Q51 PolarHBondContact O-N 3.02Å; N49-Q51 VanDerWaalsContact O-N 3.07Å; N49-Q51 PolarHBondContact OD1-N 3.41Å; N49-W52 WeakPolarHBondContact ND2-CZ3 3.45Å; N49-W52 PolarHBondContact O-N 3.33Å; N49-W52 VanDerWaalsContact O-N 3.12Å; N49-A53 PolarHBondContact O-N 2.92Å | ||
| 50 | P | 47.5 | Very low | 48.6 | Very low | 53 Ų | 53 | 98.2 Ų | 98.2 | 34% | 0.344 | 51% | 0.505 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -63 | -16.8 | -177.4 | 23.6 | -32.3 | 0 | 0 | 0 | 113.4 | Y48 | Y48-P50 HydrophobicContact CE2-CB 3.95Å; Y48-P50 HydrophobicContact CE2-CG 4.45Å; Y48-P50 WeakPolarHBondContact O-CD 3.5Å |
| 51 | Q | 48.9 | Very low | 48 | Very low | 144 Ų | 144 | 100 Ų | 100 | 67% | 0.673 | 51% | 0.511 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -81 | -19.3 | 178 | -61.8 | -172.5 | -93.1 | 0 | 0 | 113.8 | N49 | N49-Q51 PolarHBondContact O-N 3.02Å; N49-Q51 VanDerWaalsContact O-N 3.07Å; N49-Q51 PolarHBondContact OD1-N 3.41Å |
| 52 | W | 44.5 | Very low | 47.5 | Very low | 192 Ų | 192 | 102.7 Ų | 102.7 | 73% | 0.727 | 53% | 0.53 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -129.8 | -15.9 | -176.3 | -55.6 | -32.3 | 0 | 0 | 0 | 115.3 | N49 | N49-W52 WeakPolarHBondContact ND2-CZ3 3.45Å; N49-W52 PolarHBondContact O-N 3.33Å; N49-W52 VanDerWaalsContact O-N 3.12Å |
| 53 | A | 44.2 | Very low | 46.9 | Very low | 54 Ų | 54 | 105.1 Ų | 105.1 | 45% | 0.446 | 55% | 0.545 | S | S | . | . | trans | -138.4 | 95.5 | 175.8 | 0 | 0 | 0 | 0 | 0 | 108.2 | N49 L55 | N49-A53 PolarHBondContact O-N 2.92Å; A53-L55 PolarHBondContact O-N 3.37Å; A53-L55 VanDerWaalsContact O-N 3.1Å | ||
| 54 | H | 49.2 | Very low | 46.6 | Very low | 175 Ų | 175 | 107.1 Ų | 107.1 | 81% | 0.81 | 56% | 0.563 | S | S | * | * | trans | -54.3 | 120.4 | 161.4 | -80.1 | -64.8 | 0 | 0 | 0 | 107.2 | P56 | H54-P56 WeakPolarHBondContact O-CD 3.44Š| ||
| 55 | L | 48.2 | Very low | 46.2 | Very low | 78 Ų | 78 | 103.4 Ų | 103.4 | 41% | 0.408 | 57% | 0.565 | S | S | . | * | trans | -59.3 | 111.6 | 177.8 | -168.5 | 70.7 | 0 | 0 | 0 | 107.2 | Y48 A53 H57 L59 | Y48-L55 HydrophobicContact CD2-CB 4.37Å; Y48-L55 HydrophobicContact CE2-CB 4.48Å; Y48-L55 HydrophobicContact CG-CD1 4.39Å; A53-L55 PolarHBondContact O-N 3.37Å; A53-L55 VanDerWaalsContact O-N 3.1Å; L55-H57 PolarHBondContact O-N 2.96Å; L55-L59 HydrophobicContact CD1-CD1 3.81Å; L55-L59 HydrophobicContact CG-CD1 4.33Å | ||
| 56 | P | 46.4 | Very low | 45.6 | Very low | 81 Ų | 81 | 111.9 Ų | 111.9 | 53% | 0.526 | 59% | 0.586 | S | S | . | * | trans | -64.6 | 129.9 | 179.5 | 24.4 | -28.9 | 0 | 0 | 0 | 107.6 | H54 D58 L59 | H54-P56 WeakPolarHBondContact O-CD 3.44Å; P56-D58 PolarHBondContact O-N 3.44Å; P56-L59 HydrophobicContact CG-CD1 4.31Å | ||
| 57 | H | 50.3 | Low | 44.9 | Very low | 194 Ų | 194 | 113 Ų | 113 | 90% | 0.898 | 61% | 0.611 | S | S | * | * | S | Bend | trans | -57.4 | -16.5 | -177.8 | -155.7 | 70.9 | 0 | 0 | 0 | 112.7 | L55 | L55-H57 PolarHBondContact O-N 2.96Š|
| 58 | D | 46.4 | Very low | 44.5 | Very low | 114 Ų | 114 | 111.4 Ų | 111.4 | 61% | 0.61 | 62% | 0.624 | S | S | * | * | trans | -117.5 | 78.5 | 176.8 | -77.2 | -52.6 | 0 | 0 | 0 | 112.4 | P56 S60 K61 | P56-D58 PolarHBondContact O-N 3.44Å; D58-S60 PolarHBondContact O-N 2.95Å; D58-S60 VanDerWaalsContact O-N 3.16Å; D58-K61 PolarHBondContact O-N 3.22Å | ||
| 59 | L | 49.2 | Very low | 44.1 | Very low | 55 Ų | 55 | 114.4 Ų | 114.4 | 29% | 0.288 | 66% | 0.657 | S | S | . | * | G | 310 helix | trans | -65.8 | -10.2 | 171.5 | -127.3 | 88.3 | 0 | 0 | 0 | 113.7 | I46 L55 P56 K61 A62 | I46-L59 HydrophobicContact CD1-CD2 3.33Å; L55-L59 HydrophobicContact CD1-CD1 3.81Å; L55-L59 HydrophobicContact CG-CD1 4.33Å; P56-L59 HydrophobicContact CG-CD1 4.31Å; L59-K61 PolarHBondContact O-N 3.03Å; L59-K61 VanDerWaalsContact O-N 3.1Å; L59-A62 PolarHBondContact O-N 3.42Å |
| 60 | S | 44.8 | Very low | 43.8 | Very low | 115 Ų | 115 | 117.9 Ų | 117.9 | 80% | 0.804 | 69% | 0.688 | S | S | * | * | G | 310 helix | trans | -57.7 | -17.6 | 171.7 | 165 | 0 | 0 | 0 | 0 | 113.3 | D58 | D58-S60 PolarHBondContact O-N 2.95Å; D58-S60 VanDerWaalsContact O-N 3.16Å |
| 61 | K | 41.3 | Very low | 43.6 | Very low | 180 Ų | 180 | 121.9 Ų | 121.9 | 78% | 0.783 | 71% | 0.711 | S | S | * | * | G | 310 helix | trans | -98.2 | 9.7 | -179.1 | -70.7 | -88.4 | -175.4 | 169.5 | 0 | 114.4 | D58 L59 M63 | D58-K61 PolarHBondContact O-N 3.22Å; L59-K61 PolarHBondContact O-N 3.03Å; L59-K61 VanDerWaalsContact O-N 3.1Å; K61-M63 VanDerWaalsContact C-N 3.34Å; K61-M63 PolarHBondContact O-N 3.45Å |
| 62 | A | 41.7 | Very low | 43.2 | Very low | 81 Ų | 81 | 117.3 Ų | 117.3 | 67% | 0.669 | 70% | 0.703 | S | S | * | * | trans | -68.1 | 91 | 176.8 | 0 | 0 | 0 | 0 | 0 | 110.7 | L59 | L59-A62 PolarHBondContact O-N 3.42Š| ||
| 63 | M | 38.9 | Very low | 43.1 | Very low | 160 Ų | 160 | 113.2 Ų | 113.2 | 79% | 0.788 | 70% | 0.699 | S | S | * | * | trans | -58.4 | 135.3 | 170.5 | -175.7 | -174.3 | -65.2 | 0 | 0 | 109.2 | K61 G65 | K61-M63 VanDerWaalsContact C-N 3.34Å; K61-M63 PolarHBondContact O-N 3.45Å; M63-G65 PolarHBondContact O-N 3.34Å | ||
| 64 | P | 41.1 | Very low | 42.9 | Very low | 138 Ų | 138 | 118.6 Ų | 118.6 | 90% | 0.896 | 72% | 0.715 | S | S | * | * | trans | -74.9 | 73 | 172.6 | 32.4 | -32.2 | 0 | 0 | 0 | 108.2 | ||||
| 65 | G | 40 | Very low | 42.4 | Very low | 52 Ų | 52 | 115.5 Ų | 115.5 | 54% | 0.536 | 70% | 0.704 | S | S | . | * | trans | -125 | 83.9 | -173.6 | 0 | 0 | 0 | 0 | 0 | 110.1 | M63 | M63-G65 PolarHBondContact O-N 3.34Š| ||
| 66 | R | 36.9 | Very low | 42.1 | Very low | 251 Ų | 251 | 116.8 Ų | 116.8 | 95% | 0.947 | 71% | 0.714 | S | S | * | * | trans | 55.5 | 104.7 | 149.6 | -140.8 | 172.9 | -172 | -166.7 | 1.4 | 116.3 | ||||
| 67 | G | 38.5 | Very low | 41.8 | Very low | 79 Ų | 79 | 119.3 Ų | 119.3 | 81% | 0.814 | 72% | 0.723 | S | S | * | * | trans | -57.9 | 158.2 | 179.6 | 0 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 68 | G | 40.5 | Very low | 41.3 | Very low | 84 Ų | 84 | 116.3 Ų | 116.3 | 87% | 0.866 | 71% | 0.713 | S | S | * | * | trans | 73.6 | 77.8 | 146.3 | 0 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 69 | A | 40 | Very low | 40.9 | Very low | 105 Ų | 105 | 115.8 Ų | 115.8 | 87% | 0.868 | 72% | 0.718 | S | S | * | * | trans | -157.2 | 69.5 | 162.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 70 | A | 41.2 | Very low | 40.5 | Very low | 91 Ų | 91 | 120.5 Ų | 120.5 | 75% | 0.752 | 74% | 0.744 | S | S | * | * | S | Bend | trans | -149.1 | 14.2 | 164.3 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||
| 71 | V | 44.3 | Very low | 40.5 | Very low | 136 Ų | 136 | 125.4 Ų | 125.4 | 82% | 0.824 | 76% | 0.76 | S | S | * | * | S | Bend | trans | -115.9 | 12.8 | 176.2 | 179.8 | 0 | 0 | 0 | 0 | 111.3 | ||
| 72 | G | 40 | Very low | 40.5 | Very low | 49 Ų | 49 | 122.7 Ų | 122.7 | 51% | 0.505 | 76% | 0.759 | S | S | . | * | S | Bend | trans | -108.3 | -14.1 | -172.3 | 0 | 0 | 0 | 0 | 0 | 116.7 | V76 | G72-V76 VanDerWaalsContact O-CG2 3.31Å; G72-V76 WeakPolarHBondContact O-CG2 3.33Å |
| 73 | T | 42.5 | Very low | 40.4 | Very low | 105 Ų | 105 | 124.9 Ų | 124.9 | 64% | 0.644 | 76% | 0.763 | S | S | * | * | S | Bend | trans | -102 | -25.9 | -168.9 | 44.9 | 0 | 0 | 0 | 0 | 114.5 | ||
| 74 | H | 38.6 | Very low | 40.5 | Very low | 168 Ų | 168 | 122.9 Ų | 122.9 | 78% | 0.778 | 76% | 0.762 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.5 | -25.7 | -179.9 | -94.7 | -90.4 | 0 | 0 | 0 | 114.4 | ||
| 75 | L | 39.9 | Very low | 40.5 | Very low | 110 Ų | 110 | 122.1 Ų | 122.1 | 58% | 0.576 | 75% | 0.754 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.9 | -26.8 | -178.2 | -154.1 | 75.5 | 0 | 0 | 0 | 112.7 | L18 L78 S79 | L18-L75 HydrophobicContact CD1-CD1 4.38Å; L75-L78 PolarHBondContact O-N 3.22Å; L75-S79 PolarHBondContact O-OG 3.46Å |
| 76 | V | 41.9 | Very low | 40.5 | Very low | 104 Ų | 104 | 126.4 Ų | 126.4 | 63% | 0.63 | 77% | 0.768 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.3 | -35.7 | 178.9 | -177.6 | 0 | 0 | 0 | 0 | 111.1 | G72 L78 S79 | G72-V76 VanDerWaalsContact O-CG2 3.31Å; G72-V76 WeakPolarHBondContact O-CG2 3.33Å; V76-L78 VanDerWaalsContact C-N 3.28Å; V76-L78 PolarHBondContact O-N 3.32Å; V76-S79 PolarHBondContact O-N 3.01Å |
| 77 | L | 40.3 | Very low | 40.8 | Very low | 134 Ų | 134 | 118.1 Ų | 118.1 | 70% | 0.702 | 76% | 0.756 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.7 | -22.9 | 178 | -97.7 | 151.8 | 0 | 0 | 0 | 114.1 | ||
| 78 | L | 39.5 | Very low | 40.9 | Very low | 132 Ų | 132 | 120.9 Ų | 120.9 | 69% | 0.691 | 75% | 0.751 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.3 | -7.1 | 178.8 | -143.8 | 79.7 | 0 | 0 | 0 | 113.3 | L75 V76 | L75-L78 PolarHBondContact O-N 3.22Å; V76-L78 VanDerWaalsContact C-N 3.28Å; V76-L78 PolarHBondContact O-N 3.32Å |
| 79 | S | 37.5 | Very low | 40.9 | Very low | 102 Ų | 102 | 123.8 Ų | 123.8 | 71% | 0.713 | 74% | 0.743 | S | S | * | * | S | Bend | trans | -91.8 | -8.8 | 179.4 | -57.3 | 0 | 0 | 0 | 0 | 113.3 | L75 V76 | L75-S79 PolarHBondContact O-OG 3.46Å; V76-S79 PolarHBondContact O-N 3.01Å |
| 80 | D | 41.3 | Very low | 41 | Very low | 155 Ų | 155 | 125.3 Ų | 125.3 | 83% | 0.829 | 73% | 0.732 | S | S | * | * | trans | -108.3 | 10.6 | -175.1 | -137.9 | -97.5 | 0 | 0 | 0 | 113.5 | ||||
| 81 | L | 45.3 | Very low | 41 | Very low | 218 Ų | 218 | 128.5 Ų | 128.5 | 100% | 1.141 | 73% | 0.73 | S | S | * | * | trans | -116.6 | 0 | 177 | -158.7 | 81.7 | 0 | 0 | 0 | 112.7 |
Retrieved 81 of 81 residues in 22.7 ms
(Link to these results)