| 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 | 73.4 | Confident | 86.4 | Confident | 190 Ų | 190 | 121.5 Ų | 121.5 | 94% | 0.936 | 59% | 0.586 | S | S | * | * | 0 | -23.4 | 0 | -69.9 | -58.3 | -97.7 | 0 | 0 | 113.5 | |||||
| 2 | E | 82.4 | Confident | 86.8 | Confident | 154 Ų | 154 | 112.4 Ų | 112.4 | 72% | 0.72 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -70.9 | -44.1 | -176.3 | -160.3 | 155 | -157.6 | 0 | 0 | 113.8 | L4 R5 D6 | E2-L4 PolarHBondContact O-N 3.38Å; E2-L4 VanDerWaalsContact O-N 3.11Å; E2-R5 WeakPolarHBondContact O-CB 3.04Å; E2-R5 PolarHBondContact O-N 3.49Å; E2-D6 PolarHBondContact O-N 3.41Å |
| 3 | A | 85.8 | Confident | 86.9 | Confident | 80 Ų | 80 | 106.2 Ų | 106.2 | 66% | 0.661 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -56.2 | -31.6 | 175.8 | 0 | 0 | 0 | 0 | 0 | 113.9 | A7 | A3-A7 WeakPolarHBondContact O-CB 3.32Å; A3-A7 PolarHBondContact O-N 3.09Å |
| 4 | L | 89.8 | Confident | 87 | Confident | 108 Ų | 108 | 100.8 Ų | 100.8 | 57% | 0.565 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -71.5 | -38.1 | 176.3 | 178.7 | 62.7 | 0 | 0 | 0 | 112 | E2 D6 A7 T8 | E2-L4 PolarHBondContact O-N 3.38Å; E2-L4 VanDerWaalsContact O-N 3.11Å; L4-D6 VanDerWaalsContact C-N 3.34Å; L4-A7 PolarHBondContact O-N 3.13Å; L4-T8 WeakPolarHBondContact O-CB 3.5Å; L4-T8 PolarHBondContact O-N 2.62Å; L4-T8 PolarHBondContact O-OG1 3.28Å |
| 5 | R | 86.8 | Confident | 87.3 | Confident | 184 Ų | 184 | 99.5 Ų | 99.5 | 69% | 0.694 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -64.5 | -43.6 | 175.6 | -69.7 | -179.2 | 172.6 | -178.5 | -3.5 | 110.1 | E2 T8 R9 | E2-R5 WeakPolarHBondContact O-CB 3.04Å; E2-R5 PolarHBondContact O-N 3.49Å; R5-T8 PolarHBondContact O-N 2.97Å; R5-R9 WeakPolarHBondContact O-CB 3.47Å; R5-R9 PolarHBondContact O-N 2.81Å |
| 6 | D | 86.4 | Confident | 87.6 | Confident | 61 Ų | 61 | 93.6 Ų | 93.6 | 33% | 0.326 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -64.2 | -42.9 | 176.5 | -72.8 | -18.1 | 0 | 0 | 0 | 112.5 | E2 L4 T8 R9 R10 | E2-D6 PolarHBondContact O-N 3.41Å; L4-D6 VanDerWaalsContact C-N 3.34Å; D6-T8 VanDerWaalsContact C-N 3.34Å; D6-T8 PolarHBondContact O-N 3.26Å; D6-R9 PolarHBondContact O-N 2.92Å; D6-R10 WeakPolarHBondContact O-CG 3.41Å; D6-R10 PolarHBondContact O-N 3.12Å |
| 7 | A | 87.8 | Confident | 87.6 | Confident | 55 Ų | 55 | 88.5 Ų | 88.5 | 46% | 0.455 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -61.2 | -43.9 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | A3 L4 R11 | A3-A7 WeakPolarHBondContact O-CB 3.32Å; A3-A7 PolarHBondContact O-N 3.09Å; L4-A7 PolarHBondContact O-N 3.13Å; A7-R11 WeakPolarHBondContact O-CB 3.23Å; A7-R11 PolarHBondContact O-N 3.17Å |
| 8 | T | 90.9 | Very high | 87.6 | Confident | 79 Ų | 79 | 88.5 Ų | 88.5 | 49% | 0.485 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -63.4 | -43.7 | 176.7 | -55.5 | 0 | 0 | 0 | 0 | 111.3 | L4 R5 D6 R11 A12 | L4-T8 WeakPolarHBondContact O-CB 3.5Å; L4-T8 PolarHBondContact O-N 2.62Å; L4-T8 PolarHBondContact O-OG1 3.28Å; R5-T8 PolarHBondContact O-N 2.97Å; D6-T8 VanDerWaalsContact C-N 3.34Å; D6-T8 PolarHBondContact O-N 3.26Å; T8-R11 WeakPolarHBondContact O-CB 3.41Å; T8-R11 PolarHBondContact O-N 3.38Å; T8-A12 PolarHBondContact O-N 2.88Å |
| 9 | R | 89.6 | Confident | 87.7 | Confident | 93 Ų | 93 | 87.9 Ų | 87.9 | 35% | 0.351 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -61.4 | -48.2 | 178.3 | -172.3 | -177.7 | -62.2 | 167.2 | 4.6 | 112 | R5 D6 R11 A12 F13 V32 | R5-R9 WeakPolarHBondContact O-CB 3.47Å; R5-R9 PolarHBondContact O-N 2.81Å; D6-R9 PolarHBondContact O-N 2.92Å; R9-R11 VanDerWaalsContact C-N 3.27Å; R9-R11 PolarHBondContact O-N 3.04Å; R9-A12 PolarHBondContact O-N 2.77Å; R9-F13 PolarHBondContact O-N 2.8Å; R9-V32 HydrophobicContact CG-CB 4.1Å; R9-V32 HydrophobicContact CG-CG1 4.46Å |
| 10 | R | 87.8 | Confident | 87.8 | Confident | 186 Ų | 186 | 88.9 Ų | 88.9 | 70% | 0.702 | 45% | 0.446 | S | S | * | . | H | α-helix | trans | -60.5 | -39.1 | 176.8 | -70.3 | 175.7 | -168.1 | 172.8 | 5.5 | 111.5 | D6 F13 A14 | D6-R10 WeakPolarHBondContact O-CG 3.41Å; D6-R10 PolarHBondContact O-N 3.12Å; R10-F13 PolarHBondContact O-N 3.37Å; R10-A14 PolarHBondContact O-N 3.17Å |
| 11 | R | 89.5 | Confident | 87.8 | Confident | 146 Ų | 146 | 90.8 Ų | 90.8 | 55% | 0.551 | 46% | 0.463 | S | S | * | . | H | α-helix | trans | -65.6 | -46 | 176.7 | -172.5 | 179 | -179.4 | -149.7 | 1.2 | 111.9 | A7 T8 R9 F13 A14 L15 | A7-R11 WeakPolarHBondContact O-CB 3.23Å; A7-R11 PolarHBondContact O-N 3.17Å; T8-R11 WeakPolarHBondContact O-CB 3.41Å; T8-R11 PolarHBondContact O-N 3.38Å; R9-R11 VanDerWaalsContact C-N 3.27Å; R9-R11 PolarHBondContact O-N 3.04Å; R11-F13 VanDerWaalsContact C-N 3.3Å; R11-F13 PolarHBondContact O-N 3.43Å; R11-A14 PolarHBondContact O-N 2.89Å; R11-L15 HydrophobicContact CG-CD1 4.14Å; R11-L15 WeakPolarHBondContact O-CG 3.39Å; R11-L15 PolarHBondContact O-N 3.16Å |
| 12 | A | 90.9 | Very high | 88.8 | Confident | 13 Ų | 13 | 83.9 Ų | 83.9 | 11% | 0.107 | 43% | 0.433 | C | S | . | . | H | α-helix | trans | -58.1 | -45.1 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111 | T8 R9 A14 L15 V16 F31 V32 | T8-A12 PolarHBondContact O-N 2.88Å; R9-A12 PolarHBondContact O-N 2.77Å; A12-A14 PolarHBondContact O-N 3.48Å; A12-L15 PolarHBondContact O-N 2.76Å; A12-V16 VanDerWaalsContact O-CG2 3.32Å; A12-V16 WeakPolarHBondContact O-CG2 3.35Å; A12-V16 PolarHBondContact O-N 2.94Å; A12-F31 HydrophobicContact CB-CB 4.37Å; A12-F31 WeakPolarHBondContact CB-O 3.41Å; A12-V32 HydrophobicContact CB-CG1 4.32Å |
| 13 | F | 89.1 | Confident | 89.4 | Confident | 32 Ų | 32 | 76.9 Ų | 76.9 | 14% | 0.14 | 40% | 0.401 | C | S | . | . | H | α-helix | trans | -58.7 | -48.8 | 176.6 | -168.1 | -89.2 | 0 | 0 | 0 | 112.7 | R9 R10 R11 L15 V16 S17 F28 V43 Q46 W48 | R9-F13 PolarHBondContact O-N 2.8Å; R10-F13 PolarHBondContact O-N 3.37Å; R11-F13 VanDerWaalsContact C-N 3.3Å; R11-F13 PolarHBondContact O-N 3.43Å; F13-L15 VanDerWaalsContact C-N 3.35Å; F13-L15 PolarHBondContact O-N 3.12Å; F13-V16 PolarHBondContact O-N 3.49Å; F13-S17 WeakPolarHBondContact O-CB 3.31Å; F13-S17 PolarHBondContact O-N 3.19Å; F13-F28 HydrophobicContact CD2-CE2 4.27Å; F13-F28 AromaticContact CD2-CZ 3.95Å; F13-F28 HydrophobicContact CD2-CZ 3.95Å; F13-F28 HydrophobicContact CE2-CZ 4.22Å; F13-V43 HydrophobicContact CE2-CG1 4.04Å; F13-Q46 VanDerWaalsContact CE1-NE2 3.32Å; F13-Q46 HydrophobicContact CZ-CB 3.81Å; F13-Q46 HydrophobicContact CZ-CG 4Å; F13-Q46 VanDerWaalsContact CZ-OE1 3.24Å; F13-W48 HydrophobicContact CD1-CH2 4.25Å; F13-W48 AromaticContact CD1-CZ2 3.96Å; F13-W48 HydrophobicContact CD1-CZ2 3.96Å; F13-W48 AromaticContact CD2-CH2 3.9Å; F13-W48 HydrophobicContact CD2-CH2 3.9Å; F13-W48 HydrophobicContact CD2-CZ2 4.24Å; F13-W48 HydrophobicContact CD2-CZ3 4.4Å; F13-W48 AromaticContact CE1-CE2 3.82Å; F13-W48 AromaticContact CE1-CH2 3.89Å; F13-W48 HydrophobicContact CE1-CH2 3.89Å; F13-W48 AromaticContact CE1-CZ2 3.25Å; F13-W48 HydrophobicContact CE1-CZ2 3.25Å; F13-W48 HydrophobicContact CE2-CD2 4.28Å; F13-W48 AromaticContact CE2-CE2 3.97Å; F13-W48 HydrophobicContact CE2-CE3 4.22Å; F13-W48 AromaticContact CE2-CH2 3.51Å; F13-W48 HydrophobicContact CE2-CH2 3.51Å; F13-W48 AromaticContact CE2-CZ2 3.59Å; F13-W48 HydrophobicContact CE2-CZ2 3.59Å; F13-W48 AromaticContact CE2-CZ3 3.86Å; F13-W48 HydrophobicContact CE2-CZ3 3.86Å; F13-W48 HydrophobicContact CG-CH2 4.23Å; F13-W48 HydrophobicContact CG-CZ2 4.39Å; F13-W48 AromaticContact CZ-CD2 3.93Å; F13-W48 HydrophobicContact CZ-CD2 3.93Å; F13-W48 AromaticContact CZ-CE2 3.26Å; F13-W48 HydrophobicContact CZ-CE3 4.3Å; F13-W48 AromaticContact CZ-CH2 3.49Å; F13-W48 HydrophobicContact CZ-CH2 3.49Å; F13-W48 VanDerWaalsContact CZ-CH2 3.49Å; F13-W48 AromaticContact CZ-CZ2 3.01Å; F13-W48 HydrophobicContact CZ-CZ2 3.01Å; F13-W48 HydrophobicContact CZ-CZ3 4.12Å; F13-W48 AromaticContact CZ-NE1 3.74Å |
| 14 | A | 88.3 | Confident | 89.8 | Confident | 30 Ų | 30 | 76.9 Ų | 76.9 | 25% | 0.248 | 39% | 0.388 | C | S | . | . | H | α-helix | trans | -61.6 | -42.2 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112 | R10 R11 A12 S17 Q18 | R10-A14 PolarHBondContact O-N 3.17Å; R11-A14 PolarHBondContact O-N 2.89Å; A12-A14 PolarHBondContact O-N 3.48Å; A14-S17 PolarHBondContact O-N 2.94Å; A14-S17 PolarHBondContact O-OG 2.87Å; A14-Q18 VanDerWaalsContact O-CG 3.32Å; A14-Q18 WeakPolarHBondContact O-CG 3.28Å; A14-Q18 PolarHBondContact O-N 3.11Å |
| 15 | L | 90.6 | Very high | 90.1 | Very high | 81 Ų | 81 | 72 Ų | 72 | 42% | 0.424 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -62.7 | -47 | 177.2 | -73.3 | 168.9 | 0 | 0 | 0 | 111.8 | R11 A12 F13 S17 Q18 A19 | R11-L15 HydrophobicContact CG-CD1 4.14Å; R11-L15 WeakPolarHBondContact O-CG 3.39Å; R11-L15 PolarHBondContact O-N 3.16Å; A12-L15 PolarHBondContact O-N 2.76Å; F13-L15 VanDerWaalsContact C-N 3.35Å; F13-L15 PolarHBondContact O-N 3.12Å; L15-S17 VanDerWaalsContact C-N 3.29Å; L15-S17 PolarHBondContact O-N 3.32Å; L15-Q18 PolarHBondContact O-N 3.43Å; L15-Q18 VanDerWaalsContact O-N 3.12Å; L15-A19 WeakPolarHBondContact O-CB 3.49Å; L15-A19 PolarHBondContact O-N 3.41Å |
| 16 | V | 92.1 | Very high | 90.4 | Very high | 5 Ų | 5 | 68.2 Ų | 68.2 | 3% | 0.03 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -61.6 | -40.9 | -179.9 | 172.7 | 0 | 0 | 0 | 0 | 111.1 | A12 F13 Q18 Y20 I23 F28 W48 P59 | A12-V16 VanDerWaalsContact O-CG2 3.32Å; A12-V16 WeakPolarHBondContact O-CG2 3.35Å; A12-V16 PolarHBondContact O-N 2.94Å; F13-V16 PolarHBondContact O-N 3.49Å; V16-Q18 PolarHBondContact O-N 3.07Å; V16-Q18 VanDerWaalsContact O-N 3.17Å; V16-Y20 HydrophobicContact CG1-CD2 4.39Å; V16-Y20 PolarHBondContact O-N 3.49Å; V16-Y20 VanDerWaalsContact O-N 3.13Å; V16-I23 HydrophobicContact CG1-CD1 4.27Å; V16-I23 HydrophobicContact CG1-CG2 4Å; V16-I23 HydrophobicContact CG2-CD1 4.34Å; V16-F28 HydrophobicContact CB-CD2 4.32Å; V16-F28 HydrophobicContact CB-CE2 4.36Å; V16-F28 HydrophobicContact CG1-CD2 3.91Å; V16-F28 HydrophobicContact CG1-CE2 4.2Å; V16-F28 HydrophobicContact CG2-CD2 4.1Å; V16-F28 HydrophobicContact CG2-CE2 4.39Å; V16-W48 HydrophobicContact CB-CH2 4.27Å; V16-W48 HydrophobicContact CG1-CH2 4.03Å; V16-W48 HydrophobicContact CG1-CZ3 3.92Å; V16-P59 HydrophobicContact CG1-CB 4.47Å; V16-P59 HydrophobicContact CG1-CG 3.71Å |
| 17 | S | 88.6 | Confident | 90.8 | Very high | 7 Ų | 7 | 69 Ų | 69 | 5% | 0.049 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -62.1 | -22 | 177.8 | 83.1 | 0 | 0 | 0 | 0 | 114.9 | F13 A14 L15 W48 | F13-S17 WeakPolarHBondContact O-CB 3.31Å; F13-S17 PolarHBondContact O-N 3.19Å; A14-S17 PolarHBondContact O-N 2.94Å; A14-S17 PolarHBondContact O-OG 2.87Å; L15-S17 VanDerWaalsContact C-N 3.29Å; L15-S17 PolarHBondContact O-N 3.32Å; S17-W48 VanDerWaalsContact CB-CZ2 3.41Å |
| 18 | Q | 86.7 | Confident | 91.1 | Very high | 89 Ų | 89 | 66.6 Ų | 66.6 | 42% | 0.416 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -103.8 | -37.3 | -175.3 | -68.2 | 173.8 | 28.1 | 0 | 0 | 112.4 | A14 L15 V16 | A14-Q18 VanDerWaalsContact O-CG 3.32Å; A14-Q18 WeakPolarHBondContact O-CG 3.28Å; A14-Q18 PolarHBondContact O-N 3.11Å; L15-Q18 PolarHBondContact O-N 3.43Å; L15-Q18 VanDerWaalsContact O-N 3.12Å; V16-Q18 PolarHBondContact O-N 3.07Å; V16-Q18 VanDerWaalsContact O-N 3.17Å |
| 19 | A | 88.9 | Confident | 91.3 | Very high | 78 Ų | 78 | 63.1 Ų | 63.1 | 65% | 0.645 | 32% | 0.32 | S | S | * | . | H | α-helix | trans | -93.5 | -25 | -171.8 | 0 | 0 | 0 | 0 | 0 | 113.6 | L15 | L15-A19 WeakPolarHBondContact O-CB 3.49Å; L15-A19 PolarHBondContact O-N 3.41Å |
| 20 | Y | 89.9 | Confident | 91.5 | Very high | 106 Ų | 106 | 62.5 Ų | 62.5 | 42% | 0.416 | 34% | 0.335 | S | S | . | . | trans | -115.7 | 132.5 | -175.4 | -66.1 | -90.5 | 0 | 0 | 0 | 111.4 | V16 I23 | V16-Y20 HydrophobicContact CG1-CD2 4.39Å; V16-Y20 PolarHBondContact O-N 3.49Å; V16-Y20 VanDerWaalsContact O-N 3.13Å; Y20-I23 HydrophobicContact CD1-CB 4.19Å; Y20-I23 HydrophobicContact CD1-CD1 4.35Å; Y20-I23 HydrophobicContact CD1-CG1 4.36Å; Y20-I23 HydrophobicContact CD2-CD1 4.24Å; Y20-I23 HydrophobicContact CE1-CD1 4.39Å; Y20-I23 HydrophobicContact CE2-CD1 4.26Å; Y20-I23 HydrophobicContact CG-CB 4.23Å; Y20-I23 HydrophobicContact CG-CD1 4.27Å | ||
| 21 | T | 89.5 | Confident | 91.7 | Very high | 130 Ų | 130 | 59 Ų | 59 | 80% | 0.798 | 33% | 0.325 | S | S | * | . | S | Bend | trans | -86.5 | -24.5 | 165.4 | 50.8 | 0 | 0 | 0 | 0 | 111.7 | ||
| 22 | S | 93.1 | Very high | 91.8 | Very high | 45 Ų | 45 | 52.5 Ų | 52.5 | 32% | 0.315 | 30% | 0.302 | S | S | . | . | S | Bend | trans | -156.1 | 139.1 | 175.3 | -169.2 | 0 | 0 | 0 | 0 | 108.8 | M56 V57 | S22-M56 WeakPolarHBondContact OG-CE 3.46Å; S22-V57 CarbonylContact C-O 3.6Å; S22-V57 WeakPolarHBondContact CA-O 3.49Å |
| 23 | I | 94.7 | Very high | 91.8 | Very high | 7 Ų | 7 | 54.9 Ų | 54.9 | 4% | 0.036 | 33% | 0.327 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -142.7 | 148.2 | 179.8 | -171.6 | 170.3 | 0 | 0 | 0 | 109.9 | V16 Y20 D27 F28 F31 M56 V57 P59 | V16-I23 HydrophobicContact CG1-CD1 4.27Å; V16-I23 HydrophobicContact CG1-CG2 4Å; V16-I23 HydrophobicContact CG2-CD1 4.34Å; Y20-I23 HydrophobicContact CD1-CB 4.19Å; Y20-I23 HydrophobicContact CD1-CD1 4.35Å; Y20-I23 HydrophobicContact CD1-CG1 4.36Å; Y20-I23 HydrophobicContact CD2-CD1 4.24Å; Y20-I23 HydrophobicContact CE1-CD1 4.39Å; Y20-I23 HydrophobicContact CE2-CD1 4.26Å; Y20-I23 HydrophobicContact CG-CB 4.23Å; Y20-I23 HydrophobicContact CG-CD1 4.27Å; I23-D27 HydrophobicContact CD1-CB 4.44Å; I23-D27 HydrophobicContact CG1-CB 4.29Å; I23-F28 HydrophobicContact CD1-CB 4.39Å; I23-F28 HydrophobicContact CG2-CB 4.18Å; I23-F31 HydrophobicContact CD1-CD2 4.06Å; I23-F31 HydrophobicContact CD1-CE2 4Å; I23-M56 CarbonylContact O-C 3.59Å; I23-M56 WeakPolarHBondContact O-CA 3.43Å; I23-V57 HydrophobicContact CG2-CB 4.03Å; I23-V57 HydrophobicContact CG2-CG1 4.5Å; I23-V57 PolarHBondContact N-O 3.49Å; I23-V57 PolarHBondContact O-N 3Å; I23-P59 HydrophobicContact CG2-CG 4.28Å |
| 24 | I | 95.8 | Very high | 91.9 | Very high | 79 Ų | 79 | 55.3 Ų | 55.3 | 41% | 0.405 | 33% | 0.331 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -66.3 | 136.1 | 175.1 | -56.8 | 173.7 | 0 | 0 | 0 | 108.7 | D26 D27 F28 M56 | I24-D26 HydrophobicContact CG2-CB 4.07Å; I24-D26 PolarHBondContact O-N 3.31Å; I24-D27 HydrophobicContact CB-CB 4.35Å; I24-D27 PolarHBondContact O-N 2.95Å; I24-F28 PolarHBondContact O-N 3.22Å; I24-M56 HydrophobicContact CB-SD 4.38Å; I24-M56 HydrophobicContact CG1-CE 4.3Å; I24-M56 HydrophobicContact CG1-SD 3.75Å |
| 25 | A | 94.3 | Very high | 92.2 | Very high | 6 Ų | 6 | 56.7 Ų | 56.7 | 5% | 0.05 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -59.4 | -35 | -178.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | F28 A29 V36 V40 R55 V57 | A25-F28 PolarHBondContact O-N 2.99Å; A25-A29 VanDerWaalsContact O-CB 3.31Å; A25-A29 WeakPolarHBondContact O-CB 3.16Å; A25-A29 PolarHBondContact O-N 3.02Å; A25-V36 HydrophobicContact CB-CG1 3.98Å; A25-V40 HydrophobicContact CB-CG2 4.03Å; A25-R55 VanDerWaalsContact CB-O 3.28Å; A25-R55 WeakPolarHBondContact CB-O 3.38Å; A25-R55 PolarHBondContact N-O 3.29Å; A25-V57 HydrophobicContact CB-CG2 3.95Å |
| 26 | D | 94.7 | Very high | 92.3 | Very high | 104 Ų | 104 | 54.8 Ų | 54.8 | 56% | 0.556 | 33% | 0.329 | S | S | * | . | H | α-helix | trans | -65.4 | -48.6 | 177.1 | -150.7 | -92.8 | 0 | 0 | 0 | 111.8 | I24 F28 A29 A30 | I24-D26 HydrophobicContact CG2-CB 4.07Å; I24-D26 PolarHBondContact O-N 3.31Å; D26-F28 VanDerWaalsContact C-N 3.32Å; D26-F28 PolarHBondContact O-N 3.44Å; D26-A29 WeakPolarHBondContact O-CB 3.38Å; D26-A29 PolarHBondContact O-N 3.48Å; D26-A30 PolarHBondContact O-N 2.87Å |
| 27 | D | 94.9 | Very high | 92.3 | Very high | 78 Ų | 78 | 61.4 Ų | 61.4 | 42% | 0.417 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -62.1 | -41.4 | 175.6 | -71.2 | -23.6 | 0 | 0 | 0 | 111.4 | I23 I24 A29 A30 F31 | I23-D27 HydrophobicContact CD1-CB 4.44Å; I23-D27 HydrophobicContact CG1-CB 4.29Å; I24-D27 HydrophobicContact CB-CB 4.35Å; I24-D27 PolarHBondContact O-N 2.95Å; D27-A29 PolarHBondContact O-N 3.44Å; D27-A30 WeakPolarHBondContact O-CB 3.07Å; D27-A30 PolarHBondContact O-N 3.35Å; D27-F31 WeakPolarHBondContact O-CD2 3.4Å; D27-F31 PolarHBondContact O-N 2.97Å |
| 28 | F | 94.2 | Very high | 92.5 | Very high | 4 Ų | 4 | 66.4 Ų | 66.4 | 2% | 0.018 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -60 | -46.3 | 175.2 | 175.3 | -106.4 | 0 | 0 | 0 | 111.6 | F13 V16 I23 I24 A25 D26 A30 F31 V32 A39 V43 W48 | F13-F28 HydrophobicContact CD2-CE2 4.27Å; F13-F28 AromaticContact CD2-CZ 3.95Å; F13-F28 HydrophobicContact CD2-CZ 3.95Å; F13-F28 HydrophobicContact CE2-CZ 4.22Å; V16-F28 HydrophobicContact CB-CD2 4.32Å; V16-F28 HydrophobicContact CB-CE2 4.36Å; V16-F28 HydrophobicContact CG1-CD2 3.91Å; V16-F28 HydrophobicContact CG1-CE2 4.2Å; V16-F28 HydrophobicContact CG2-CD2 4.1Å; V16-F28 HydrophobicContact CG2-CE2 4.39Å; I23-F28 HydrophobicContact CD1-CB 4.39Å; I23-F28 HydrophobicContact CG2-CB 4.18Å; I24-F28 PolarHBondContact O-N 3.22Å; A25-F28 PolarHBondContact O-N 2.99Å; D26-F28 VanDerWaalsContact C-N 3.32Å; D26-F28 PolarHBondContact O-N 3.44Å; F28-A30 VanDerWaalsContact C-N 3.31Å; F28-A30 PolarHBondContact O-N 3.32Å; F28-F31 WeakPolarHBondContact O-CB 3.48Å; F28-F31 PolarHBondContact O-N 2.7Å; F28-F31 VanDerWaalsContact O-N 3.11Å; F28-V32 HydrophobicContact CD2-CG1 4.37Å; F28-V32 HydrophobicContact CE1-CG1 4.25Å; F28-V32 HydrophobicContact CE1-CG2 4.24Å; F28-V32 HydrophobicContact CE2-CG1 3.72Å; F28-V32 HydrophobicContact CZ-CG1 3.65Å; F28-V32 HydrophobicContact CZ-CG2 4.46Å; F28-V32 WeakPolarHBondContact O-CG2 3.31Å; F28-V32 PolarHBondContact O-N 3.31Å; F28-V32 VanDerWaalsContact O-N 3.07Å; F28-A39 HydrophobicContact CD1-CB 3.81Å; F28-A39 HydrophobicContact CE1-CB 3.77Å; F28-V43 HydrophobicContact CD1-CG1 4.03Å; F28-V43 HydrophobicContact CE1-CG1 3.2Å; F28-V43 HydrophobicContact CE2-CG1 4.23Å; F28-V43 HydrophobicContact CZ-CG1 3.31Å; F28-W48 HydrophobicContact CE2-CH2 4.4Å; F28-W48 AromaticContact CE2-CZ3 3.91Å; F28-W48 HydrophobicContact CE2-CZ3 3.91Å; F28-W48 HydrophobicContact CZ-CZ3 4.22Å |
| 29 | A | 94.4 | Very high | 92.7 | Very high | 6 Ų | 6 | 62.3 Ų | 62.3 | 5% | 0.05 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -59.1 | -42.1 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | A25 D26 D27 F31 V32 G33 L34 V36 A39 | A25-A29 VanDerWaalsContact O-CB 3.31Å; A25-A29 WeakPolarHBondContact O-CB 3.16Å; A25-A29 PolarHBondContact O-N 3.02Å; D26-A29 WeakPolarHBondContact O-CB 3.38Å; D26-A29 PolarHBondContact O-N 3.48Å; D27-A29 PolarHBondContact O-N 3.44Å; A29-F31 VanDerWaalsContact C-N 3.35Å; A29-F31 PolarHBondContact O-N 3.45Å; A29-V32 WeakPolarHBondContact O-CG2 3.24Å; A29-V32 PolarHBondContact O-N 2.76Å; A29-G33 PolarHBondContact O-N 2.86Å; A29-L34 CarbonylContact C-O 3.6Å; A29-L34 WeakPolarHBondContact CB-O 3.31Å; A29-L34 PolarHBondContact O-N 2.53Å; A29-V36 HydrophobicContact CB-CB 4.29Å; A29-V36 HydrophobicContact CB-CG2 3.72Å; A29-A39 HydrophobicContact CB-CB 3.92Å |
| 30 | A | 93.8 | Very high | 92.8 | Very high | 80 Ų | 80 | 60.2 Ų | 60.2 | 66% | 0.661 | 34% | 0.342 | S | S | * | . | H | α-helix | trans | -61.3 | -39.7 | 173.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | D26 D27 F28 | D26-A30 PolarHBondContact O-N 2.87Å; D27-A30 WeakPolarHBondContact O-CB 3.07Å; D27-A30 PolarHBondContact O-N 3.35Å; F28-A30 VanDerWaalsContact C-N 3.31Å; F28-A30 PolarHBondContact O-N 3.32Å |
| 31 | F | 91.4 | Very high | 92.9 | Very high | 112 Ų | 112 | 61.3 Ų | 61.3 | 49% | 0.491 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -67.1 | -38.6 | 176.7 | -76.8 | -57.4 | 0 | 0 | 0 | 113.6 | A12 I23 D27 F28 A29 | A12-F31 HydrophobicContact CB-CB 4.37Å; A12-F31 WeakPolarHBondContact CB-O 3.41Å; I23-F31 HydrophobicContact CD1-CD2 4.06Å; I23-F31 HydrophobicContact CD1-CE2 4Å; D27-F31 WeakPolarHBondContact O-CD2 3.4Å; D27-F31 PolarHBondContact O-N 2.97Å; F28-F31 WeakPolarHBondContact O-CB 3.48Å; F28-F31 PolarHBondContact O-N 2.7Å; F28-F31 VanDerWaalsContact O-N 3.11Å; A29-F31 VanDerWaalsContact C-N 3.35Å; A29-F31 PolarHBondContact O-N 3.45Å |
| 32 | V | 91.2 | Very high | 93 | Very high | 11 Ų | 11 | 56.2 Ų | 56.2 | 7% | 0.067 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -87.4 | -11.4 | -178.9 | -62.6 | 0 | 0 | 0 | 0 | 113.5 | R9 A12 F28 A29 L34 A39 | R9-V32 HydrophobicContact CG-CB 4.1Å; R9-V32 HydrophobicContact CG-CG1 4.46Å; A12-V32 HydrophobicContact CB-CG1 4.32Å; F28-V32 HydrophobicContact CD2-CG1 4.37Å; F28-V32 HydrophobicContact CE1-CG1 4.25Å; F28-V32 HydrophobicContact CE1-CG2 4.24Å; F28-V32 HydrophobicContact CE2-CG1 3.72Å; F28-V32 HydrophobicContact CZ-CG1 3.65Å; F28-V32 HydrophobicContact CZ-CG2 4.46Å; F28-V32 WeakPolarHBondContact O-CG2 3.31Å; F28-V32 PolarHBondContact O-N 3.31Å; F28-V32 VanDerWaalsContact O-N 3.07Å; A29-V32 WeakPolarHBondContact O-CG2 3.24Å; A29-V32 PolarHBondContact O-N 2.76Å; V32-L34 HydrophobicContact CG2-CB 3.9Å; V32-L34 HydrophobicContact CG2-CD1 4.18Å; V32-L34 HydrophobicContact CG2-CG 4.15Å; V32-A39 HydrophobicContact CG2-CB 3.93Å |
| 33 | G | 91.4 | Very high | 92.9 | Very high | 62 Ų | 62 | 54.1 Ų | 54.1 | 64% | 0.639 | 31% | 0.308 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 67.4 | 35.2 | -179.2 | 0 | 0 | 0 | 0 | 0 | 113 | A29 | A29-G33 PolarHBondContact O-N 2.86Š|
| 34 | L | 91.8 | Very high | 92.7 | Very high | 41 Ų | 41 | 58.3 Ų | 58.3 | 22% | 0.215 | 33% | 0.33 | C | S | . | . | S | Bend | trans | -121.1 | 157 | 177.7 | -69 | 176.2 | 0 | 0 | 0 | 109.3 | A29 V32 E38 A39 | A29-L34 CarbonylContact C-O 3.6Å; A29-L34 WeakPolarHBondContact CB-O 3.31Å; A29-L34 PolarHBondContact O-N 2.53Å; V32-L34 HydrophobicContact CG2-CB 3.9Å; V32-L34 HydrophobicContact CG2-CD1 4.18Å; V32-L34 HydrophobicContact CG2-CG 4.15Å; L34-E38 HydrophobicContact CB-CB 4.29Å; L34-A39 HydrophobicContact CB-CB 4.33Å |
| 35 | P | 94 | Very high | 92.4 | Very high | 60 Ų | 60 | 61.5 Ų | 61.5 | 39% | 0.39 | 34% | 0.343 | S | S | . | . | trans | -62.9 | 154.8 | 166.8 | 28.6 | -33.6 | 0 | 0 | 0 | 110.2 | E37 E38 A39 | P35-E37 PolarHBondContact O-N 3.33Å; P35-E38 HydrophobicContact CG-CB 3.89Å; P35-E38 VanDerWaalsContact CG-CD 3.48Å; P35-E38 HydrophobicContact CG-CG 3.69Å; P35-E38 VanDerWaalsContact CG-OE1 3.23Å; P35-E38 WeakPolarHBondContact CG-OE1 3.35Å; P35-E38 PolarHBondContact O-N 3.07Å; P35-E38 VanDerWaalsContact O-N 3.13Å; P35-A39 WeakPolarHBondContact O-CB 3.32Å; P35-A39 PolarHBondContact O-N 3.44Å | ||
| 36 | V | 92.8 | Very high | 91.9 | Very high | 41 Ų | 41 | 66.7 Ų | 66.7 | 25% | 0.248 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -57.6 | -38.8 | -173.5 | -179.1 | 0 | 0 | 0 | 0 | 111.2 | A25 A29 E38 A39 V40 | A25-V36 HydrophobicContact CB-CG1 3.98Å; A29-V36 HydrophobicContact CB-CB 4.29Å; A29-V36 HydrophobicContact CB-CG2 3.72Å; V36-E38 PolarHBondContact O-N 3.38Å; V36-A39 PolarHBondContact O-N 3.16Å; V36-V40 HydrophobicContact CG1-CG2 4.03Å; V36-V40 VanDerWaalsContact O-CB 3.31Å; V36-V40 WeakPolarHBondContact O-CB 3.32Å; V36-V40 WeakPolarHBondContact O-CG2 3.19Å; V36-V40 PolarHBondContact O-N 3.37Å |
| 37 | E | 92.3 | Very high | 91.6 | Very high | 144 Ų | 144 | 63.7 Ų | 63.7 | 67% | 0.673 | 36% | 0.36 | S | S | * | . | H | α-helix | trans | -62.6 | -44.5 | -180 | -61.4 | 74.8 | -163.3 | 0 | 0 | 111.9 | P35 K41 | P35-E37 PolarHBondContact O-N 3.33Å; E37-K41 WeakPolarHBondContact O-CB 3.31Å; E37-K41 PolarHBondContact O-N 3.46Å |
| 38 | E | 92.2 | Very high | 91.5 | Very high | 111 Ų | 111 | 60.6 Ų | 60.6 | 52% | 0.519 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -71.7 | -38.8 | 178.4 | -71 | 179.7 | -139.4 | 0 | 0 | 111.6 | L34 P35 V36 K41 G42 | L34-E38 HydrophobicContact CB-CB 4.29Å; P35-E38 HydrophobicContact CG-CB 3.89Å; P35-E38 VanDerWaalsContact CG-CD 3.48Å; P35-E38 HydrophobicContact CG-CG 3.69Å; P35-E38 VanDerWaalsContact CG-OE1 3.23Å; P35-E38 WeakPolarHBondContact CG-OE1 3.35Å; P35-E38 PolarHBondContact O-N 3.07Å; P35-E38 VanDerWaalsContact O-N 3.13Å; V36-E38 PolarHBondContact O-N 3.38Å; E38-K41 PolarHBondContact O-N 3Å; E38-G42 PolarHBondContact O-N 3.34Å |
| 39 | A | 91.4 | Very high | 91.4 | Very high | 3 Ų | 3 | 65.3 Ų | 65.3 | 3% | 0.025 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -63.2 | -47.3 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111 | F28 A29 V32 L34 P35 V36 K41 G42 V43 | F28-A39 HydrophobicContact CD1-CB 3.81Å; F28-A39 HydrophobicContact CE1-CB 3.77Å; A29-A39 HydrophobicContact CB-CB 3.92Å; V32-A39 HydrophobicContact CG2-CB 3.93Å; L34-A39 HydrophobicContact CB-CB 4.33Å; P35-A39 WeakPolarHBondContact O-CB 3.32Å; P35-A39 PolarHBondContact O-N 3.44Å; V36-A39 PolarHBondContact O-N 3.16Å; A39-K41 PolarHBondContact O-N 3.19Å; A39-G42 PolarHBondContact O-N 3.06Å; A39-V43 WeakPolarHBondContact O-CG1 3.48Å; A39-V43 PolarHBondContact O-N 3.17Å |
| 40 | V | 91.6 | Very high | 91.3 | Very high | 34 Ų | 34 | 66.8 Ų | 66.8 | 21% | 0.206 | 38% | 0.377 | C | S | . | . | H | α-helix | trans | -63.6 | -40.2 | 177.1 | 172.6 | 0 | 0 | 0 | 0 | 111.1 | A25 V36 V43 L44 A50 V57 | A25-V40 HydrophobicContact CB-CG2 4.03Å; V36-V40 HydrophobicContact CG1-CG2 4.03Å; V36-V40 VanDerWaalsContact O-CB 3.31Å; V36-V40 WeakPolarHBondContact O-CB 3.32Å; V36-V40 WeakPolarHBondContact O-CG2 3.19Å; V36-V40 PolarHBondContact O-N 3.37Å; V40-V43 WeakPolarHBondContact O-CG2 3.04Å; V40-V43 PolarHBondContact O-N 3.34Å; V40-L44 HydrophobicContact CG1-CD1 4.17Å; V40-L44 WeakPolarHBondContact O-CG 3.47Å; V40-L44 PolarHBondContact O-N 3.27Å; V40-L44 VanDerWaalsContact O-N 3.16Å; V40-A50 HydrophobicContact CG1-CB 3.83Å; V40-V57 HydrophobicContact CG2-CG2 4.48Å |
| 41 | K | 92.5 | Very high | 91.2 | Very high | 130 Ų | 130 | 65.8 Ų | 65.8 | 57% | 0.565 | 36% | 0.36 | S | S | * | . | H | α-helix | trans | -60.2 | -47.4 | 173.7 | -175.1 | -175.9 | 175 | -171.1 | 0 | 111.6 | E37 E38 A39 V43 L44 E45 | E37-K41 WeakPolarHBondContact O-CB 3.31Å; E37-K41 PolarHBondContact O-N 3.46Å; E38-K41 PolarHBondContact O-N 3Å; A39-K41 PolarHBondContact O-N 3.19Å; K41-V43 VanDerWaalsContact C-N 3.32Å; K41-V43 PolarHBondContact O-N 2.9Å; K41-L44 PolarHBondContact O-N 3.45Å; K41-E45 WeakPolarHBondContact CE-OE1 3.33Å; K41-E45 PolarHBondContact O-N 3.22Å |
| 42 | G | 89.8 | Confident | 90.8 | Very high | 23 Ų | 23 | 65.7 Ų | 65.7 | 24% | 0.237 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -64.7 | -32.3 | -178.8 | 0 | 0 | 0 | 0 | 0 | 114 | E38 A39 Q46 | E38-G42 PolarHBondContact O-N 3.34Å; A39-G42 PolarHBondContact O-N 3.06Å; G42-Q46 WeakPolarHBondContact O-CG 3.16Å; G42-Q46 PolarHBondContact O-N 3.26Å |
| 43 | V | 90.9 | Very high | 90.7 | Very high | 0 Ų | 0 | 71.2 Ų | 71.2 | 0% | 0 | 41% | 0.407 | C | S | . | . | H | α-helix | trans | -73.6 | -38 | 175.4 | -62.2 | 0 | 0 | 0 | 0 | 111.7 | F13 F28 A39 V40 K41 Q46 G47 W48 V57 | F13-V43 HydrophobicContact CE2-CG1 4.04Å; F28-V43 HydrophobicContact CD1-CG1 4.03Å; F28-V43 HydrophobicContact CE1-CG1 3.2Å; F28-V43 HydrophobicContact CE2-CG1 4.23Å; F28-V43 HydrophobicContact CZ-CG1 3.31Å; A39-V43 WeakPolarHBondContact O-CG1 3.48Å; A39-V43 PolarHBondContact O-N 3.17Å; V40-V43 WeakPolarHBondContact O-CG2 3.04Å; V40-V43 PolarHBondContact O-N 3.34Å; K41-V43 VanDerWaalsContact C-N 3.32Å; K41-V43 PolarHBondContact O-N 2.9Å; V43-Q46 CarbonylContact O-C 3.52Å; V43-Q46 PolarHBondContact O-N 2.88Å; V43-G47 PolarHBondContact O-N 3.25Å; V43-W48 HydrophobicContact CB-CB 3.91Å; V43-W48 HydrophobicContact CB-CD2 4.1Å; V43-W48 HydrophobicContact CB-CE3 3.7Å; V43-W48 HydrophobicContact CB-CG 4.24Å; V43-W48 HydrophobicContact CG1-CD2 4.19Å; V43-W48 HydrophobicContact CG1-CE3 3.41Å; V43-W48 VanDerWaalsContact CG1-CE3 3.41Å; V43-W48 HydrophobicContact CG1-CZ3 3.79Å; V43-W48 VanDerWaalsContact O-CB 3.31Å; V43-W48 WeakPolarHBondContact O-CB 3.49Å; V43-W48 PolarHBondContact O-N 3.46Å; V43-V57 HydrophobicContact CB-CG1 4.2Å; V43-V57 HydrophobicContact CG1-CG1 4.15Å; V43-V57 HydrophobicContact CG2-CG1 3.97Å; V43-V57 HydrophobicContact CG2-CG2 4.34Å |
| 44 | L | 90.8 | Very high | 90.6 | Very high | 96 Ų | 96 | 72 Ų | 72 | 50% | 0.503 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -63.7 | -41.7 | 175.5 | -70.5 | 171.2 | 0 | 0 | 0 | 111.6 | V40 K41 Q46 G47 A50 | V40-L44 HydrophobicContact CG1-CD1 4.17Å; V40-L44 WeakPolarHBondContact O-CG 3.47Å; V40-L44 PolarHBondContact O-N 3.27Å; V40-L44 VanDerWaalsContact O-N 3.16Å; K41-L44 PolarHBondContact O-N 3.45Å; L44-Q46 PolarHBondContact O-N 3.28Å; L44-G47 PolarHBondContact O-N 3.03Å; L44-A50 HydrophobicContact CD2-CB 4.17Å; L44-A50 HydrophobicContact CG-CB 4.46Å |
| 45 | E | 89.1 | Confident | 90.6 | Very high | 146 Ų | 146 | 79 Ų | 79 | 68% | 0.682 | 42% | 0.424 | S | S | * | . | H | α-helix | trans | -62.2 | -30.9 | 174.7 | -73.1 | 179.2 | 160.6 | 0 | 0 | 112.6 | K41 G47 | K41-E45 WeakPolarHBondContact CE-OE1 3.33Å; K41-E45 PolarHBondContact O-N 3.22Å; E45-G47 VanDerWaalsContact C-N 3.26Å; E45-G47 PolarHBondContact O-N 3.38Å |
| 46 | Q | 84 | Confident | 90.7 | Very high | 115 Ų | 115 | 78.3 Ų | 78.3 | 54% | 0.537 | 42% | 0.416 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -85.5 | 7.6 | 174.4 | -69.6 | -163.4 | 73.1 | 0 | 0 | 113.9 | F13 G42 V43 L44 W48 | F13-Q46 VanDerWaalsContact CE1-NE2 3.32Å; F13-Q46 HydrophobicContact CZ-CB 3.81Å; F13-Q46 HydrophobicContact CZ-CG 4Å; F13-Q46 VanDerWaalsContact CZ-OE1 3.24Å; G42-Q46 WeakPolarHBondContact O-CG 3.16Å; G42-Q46 PolarHBondContact O-N 3.26Å; V43-Q46 CarbonylContact O-C 3.52Å; V43-Q46 PolarHBondContact O-N 2.88Å; L44-Q46 PolarHBondContact O-N 3.28Å; Q46-W48 VanDerWaalsContact C-N 3.34Å |
| 47 | G | 88.8 | Confident | 90.7 | Very high | 41 Ų | 41 | 76.3 Ų | 76.3 | 42% | 0.423 | 40% | 0.404 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 77.1 | 17.2 | 175.5 | 0 | 0 | 0 | 0 | 0 | 114.4 | V43 L44 E45 R60 | V43-G47 PolarHBondContact O-N 3.25Å; L44-G47 PolarHBondContact O-N 3.03Å; E45-G47 VanDerWaalsContact C-N 3.26Å; E45-G47 PolarHBondContact O-N 3.38Å; G47-R60 VanDerWaalsContact O-CD 3.24Å; G47-R60 WeakPolarHBondContact O-CD 3.34Å |
| 48 | W | 92.1 | Very high | 90.8 | Very high | 13 Ų | 13 | 72.6 Ų | 72.6 | 5% | 0.049 | 39% | 0.388 | C | S | . | . | trans | -77.9 | 164.7 | 169.7 | -63.6 | 10.5 | 0 | 0 | 0 | 110.1 | F13 V16 S17 F28 V43 Q46 V57 P59 R60 | F13-W48 HydrophobicContact CD1-CH2 4.25Å; F13-W48 AromaticContact CD1-CZ2 3.96Å; F13-W48 HydrophobicContact CD1-CZ2 3.96Å; F13-W48 AromaticContact CD2-CH2 3.9Å; F13-W48 HydrophobicContact CD2-CH2 3.9Å; F13-W48 HydrophobicContact CD2-CZ2 4.24Å; F13-W48 HydrophobicContact CD2-CZ3 4.4Å; F13-W48 AromaticContact CE1-CE2 3.82Å; F13-W48 AromaticContact CE1-CH2 3.89Å; F13-W48 HydrophobicContact CE1-CH2 3.89Å; F13-W48 AromaticContact CE1-CZ2 3.25Å; F13-W48 HydrophobicContact CE1-CZ2 3.25Å; F13-W48 HydrophobicContact CE2-CD2 4.28Å; F13-W48 AromaticContact CE2-CE2 3.97Å; F13-W48 HydrophobicContact CE2-CE3 4.22Å; F13-W48 AromaticContact CE2-CH2 3.51Å; F13-W48 HydrophobicContact CE2-CH2 3.51Å; F13-W48 AromaticContact CE2-CZ2 3.59Å; F13-W48 HydrophobicContact CE2-CZ2 3.59Å; F13-W48 AromaticContact CE2-CZ3 3.86Å; F13-W48 HydrophobicContact CE2-CZ3 3.86Å; F13-W48 HydrophobicContact CG-CH2 4.23Å; F13-W48 HydrophobicContact CG-CZ2 4.39Å; F13-W48 AromaticContact CZ-CD2 3.93Å; F13-W48 HydrophobicContact CZ-CD2 3.93Å; F13-W48 AromaticContact CZ-CE2 3.26Å; F13-W48 HydrophobicContact CZ-CE3 4.3Å; F13-W48 AromaticContact CZ-CH2 3.49Å; F13-W48 HydrophobicContact CZ-CH2 3.49Å; F13-W48 VanDerWaalsContact CZ-CH2 3.49Å; F13-W48 AromaticContact CZ-CZ2 3.01Å; F13-W48 HydrophobicContact CZ-CZ2 3.01Å; F13-W48 HydrophobicContact CZ-CZ3 4.12Å; F13-W48 AromaticContact CZ-NE1 3.74Å; V16-W48 HydrophobicContact CB-CH2 4.27Å; V16-W48 HydrophobicContact CG1-CH2 4.03Å; V16-W48 HydrophobicContact CG1-CZ3 3.92Å; S17-W48 VanDerWaalsContact CB-CZ2 3.41Å; F28-W48 HydrophobicContact CE2-CH2 4.4Å; F28-W48 AromaticContact CE2-CZ3 3.91Å; F28-W48 HydrophobicContact CE2-CZ3 3.91Å; F28-W48 HydrophobicContact CZ-CZ3 4.22Å; V43-W48 HydrophobicContact CB-CB 3.91Å; V43-W48 HydrophobicContact CB-CD2 4.1Å; V43-W48 HydrophobicContact CB-CE3 3.7Å; V43-W48 HydrophobicContact CB-CG 4.24Å; V43-W48 HydrophobicContact CG1-CD2 4.19Å; V43-W48 HydrophobicContact CG1-CE3 3.41Å; V43-W48 VanDerWaalsContact CG1-CE3 3.41Å; V43-W48 HydrophobicContact CG1-CZ3 3.79Å; V43-W48 VanDerWaalsContact O-CB 3.31Å; V43-W48 WeakPolarHBondContact O-CB 3.49Å; V43-W48 PolarHBondContact O-N 3.46Å; Q46-W48 VanDerWaalsContact C-N 3.34Å; W48-V57 HydrophobicContact CE3-CG1 3.75Å; W48-V57 HydrophobicContact CZ3-CG1 4.36Å; W48-P59 VanDerWaalsContact CD2-CA 3.48Å; W48-P59 HydrophobicContact CD2-CB 3.93Å; W48-P59 HydrophobicContact CE3-CB 3.75Å; W48-P59 HydrophobicContact CE3-CG 4.02Å; W48-P59 HydrophobicContact CH2-CB 3.81Å; W48-P59 HydrophobicContact CH2-CG 4.29Å; W48-P59 HydrophobicContact CZ2-CB 3.95Å; W48-P59 HydrophobicContact CZ3-CB 3.69Å; W48-P59 HydrophobicContact CZ3-CG 3.82Å; W48-R60 VanDerWaalsContact CD1-N 3.31Å; W48-R60 PolarHBondContact NE1-O 2.95Å | ||
| 49 | Q | 92.7 | Very high | 90.8 | Very high | 103 Ų | 103 | 68 Ų | 68 | 48% | 0.481 | 37% | 0.368 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -99.9 | 142.5 | 173.5 | -81.8 | 169.1 | 30.8 | 0 | 0 | 110 | V57 L58 | Q49-V57 CarbonylContact O-C 3.58Å; Q49-V57 WeakPolarHBondContact O-CA 3.42Å; Q49-L58 HydrophobicContact CB-CB 4.08Å; Q49-L58 PolarHBondContact N-O 2.99Å; Q49-L58 VanDerWaalsContact N-O 3.16Å; Q49-L58 PolarHBondContact O-N 3.41Å |
| 50 | A | 92.7 | Very high | 90.6 | Very high | 36 Ų | 36 | 75 Ų | 75 | 30% | 0.298 | 39% | 0.393 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -129.2 | 128.9 | 170.5 | 0 | 0 | 0 | 0 | 0 | 108.3 | V40 L44 M56 V57 | V40-A50 HydrophobicContact CG1-CB 3.83Å; L44-A50 HydrophobicContact CD2-CB 4.17Å; L44-A50 HydrophobicContact CG-CB 4.46Å; A50-M56 CarbonylContact C-O 3.58Å; A50-M56 WeakPolarHBondContact CA-O 3.48Å; A50-V57 HydrophobicContact CB-CG2 4.42Å |
| 51 | D | 92 | Very high | 89.8 | Confident | 59 Ų | 59 | 80.9 Ų | 80.9 | 32% | 0.316 | 42% | 0.416 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -102.1 | 113.1 | 173.4 | 178.2 | 10.5 | 0 | 0 | 0 | 109 | T53 T54 R55 M56 | D51-T53 VanDerWaalsContact C-N 3.29Å; D51-T53 PolarHBondContact O-N 2.97Å; D51-T53 VanDerWaalsContact OD1-CB 3.31Å; D51-T53 WeakPolarHBondContact OD1-CB 3.09Å; D51-T53 PolarHBondContact OD1-N 2.83Å; D51-T53 PolarHBondContact OD1-OG1 3.37Å; D51-T54 WeakPolarHBondContact CB-OG1 3.38Å; D51-T54 WeakPolarHBondContact OD2-CB 3.47Å; D51-T54 VanDerWaalsContact OD2-CG2 3.23Å; D51-T54 WeakPolarHBondContact OD2-CG2 3.49Å; D51-T54 PolarHBondContact OD2-N 2.93Å; D51-T54 PolarHBondContact OD2-OG1 3.13Å; D51-R55 CarbonylContact O-C 3.56Å; D51-R55 WeakPolarHBondContact O-CA 3.48Å; D51-R55 PolarHBondContact O-N 3.21Å; D51-M56 PolarHBondContact N-O 2.95Å; D51-M56 PolarHBondContact O-N 3.25Å; D51-M56 VanDerWaalsContact O-N 3.17Å |
| 52 | S | 83.4 | Confident | 88.5 | Confident | 110 Ų | 110 | 77.7 Ų | 77.7 | 77% | 0.769 | 41% | 0.409 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -71.8 | -22.4 | 178.4 | 52.4 | 0 | 0 | 0 | 0 | 113.1 | ||
| 53 | T | 88.3 | Confident | 86.9 | Confident | 127 Ų | 127 | 81.3 Ų | 81.3 | 78% | 0.779 | 44% | 0.437 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -74.2 | -46.4 | -179.3 | -52.2 | 0 | 0 | 0 | 0 | 110.7 | D51 | D51-T53 VanDerWaalsContact C-N 3.29Å; D51-T53 PolarHBondContact O-N 2.97Å; D51-T53 VanDerWaalsContact OD1-CB 3.31Å; D51-T53 WeakPolarHBondContact OD1-CB 3.09Å; D51-T53 PolarHBondContact OD1-N 2.83Å; D51-T53 PolarHBondContact OD1-OG1 3.37Å |
| 54 | T | 90.3 | Very high | 85.5 | Confident | 80 Ų | 80 | 87.5 Ų | 87.5 | 49% | 0.491 | 48% | 0.48 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -93.9 | -8.2 | 179.6 | 60.6 | 0 | 0 | 0 | 0 | 113.2 | D51 M56 | D51-T54 WeakPolarHBondContact CB-OG1 3.38Å; D51-T54 WeakPolarHBondContact OD2-CB 3.47Å; D51-T54 VanDerWaalsContact OD2-CG2 3.23Å; D51-T54 WeakPolarHBondContact OD2-CG2 3.49Å; D51-T54 PolarHBondContact OD2-N 2.93Å; D51-T54 PolarHBondContact OD2-OG1 3.13Å; T54-M56 PolarHBondContact O-N 3.48Å; T54-M56 WeakPolarHBondContact OG1-CB 3.44Å; T54-M56 WeakPolarHBondContact OG1-CG 3.35Å |
| 55 | R | 91.9 | Very high | 83.6 | Confident | 187 Ų | 187 | 86 Ų | 86 | 71% | 0.706 | 49% | 0.488 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 56.5 | 33.7 | -171.5 | -58.5 | -178 | 178.3 | 167.6 | -1.6 | 112.8 | A25 D51 | A25-R55 VanDerWaalsContact CB-O 3.28Å; A25-R55 WeakPolarHBondContact CB-O 3.38Å; A25-R55 PolarHBondContact N-O 3.29Å; D51-R55 CarbonylContact O-C 3.56Å; D51-R55 WeakPolarHBondContact O-CA 3.48Å; D51-R55 PolarHBondContact O-N 3.21Å |
| 56 | M | 94.5 | Very high | 81.6 | Confident | 45 Ų | 45 | 85.4 Ų | 85.4 | 22% | 0.222 | 49% | 0.494 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -99.9 | 140.7 | 178.5 | -62 | -60.4 | -69.3 | 0 | 0 | 110.5 | S22 I23 I24 A50 D51 T54 L58 | S22-M56 WeakPolarHBondContact OG-CE 3.46Å; I23-M56 CarbonylContact O-C 3.59Å; I23-M56 WeakPolarHBondContact O-CA 3.43Å; I24-M56 HydrophobicContact CB-SD 4.38Å; I24-M56 HydrophobicContact CG1-CE 4.3Å; I24-M56 HydrophobicContact CG1-SD 3.75Å; A50-M56 CarbonylContact C-O 3.58Å; A50-M56 WeakPolarHBondContact CA-O 3.48Å; D51-M56 PolarHBondContact N-O 2.95Å; D51-M56 PolarHBondContact O-N 3.25Å; D51-M56 VanDerWaalsContact O-N 3.17Å; T54-M56 PolarHBondContact O-N 3.48Å; T54-M56 WeakPolarHBondContact OG1-CB 3.44Å; T54-M56 WeakPolarHBondContact OG1-CG 3.35Å; M56-L58 HydrophobicContact CB-CD1 4.44Å |
| 57 | V | 94.4 | Very high | 80.1 | Confident | 0 Ų | 0 | 84.8 Ų | 84.8 | 0% | 0 | 49% | 0.494 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -104.5 | 132.8 | 166.6 | 176.2 | 0 | 0 | 0 | 0 | 107.3 | S22 I23 A25 V40 V43 W48 Q49 A50 P59 | S22-V57 CarbonylContact C-O 3.6Å; S22-V57 WeakPolarHBondContact CA-O 3.49Å; I23-V57 HydrophobicContact CG2-CB 4.03Å; I23-V57 HydrophobicContact CG2-CG1 4.5Å; I23-V57 PolarHBondContact N-O 3.49Å; I23-V57 PolarHBondContact O-N 3Å; A25-V57 HydrophobicContact CB-CG2 3.95Å; V40-V57 HydrophobicContact CG2-CG2 4.48Å; V43-V57 HydrophobicContact CB-CG1 4.2Å; V43-V57 HydrophobicContact CG1-CG1 4.15Å; V43-V57 HydrophobicContact CG2-CG1 3.97Å; V43-V57 HydrophobicContact CG2-CG2 4.34Å; W48-V57 HydrophobicContact CE3-CG1 3.75Å; W48-V57 HydrophobicContact CZ3-CG1 4.36Å; Q49-V57 CarbonylContact O-C 3.58Å; Q49-V57 WeakPolarHBondContact O-CA 3.42Å; A50-V57 HydrophobicContact CB-CG2 4.42Å; V57-P59 WeakPolarHBondContact O-CD 3.37Å |
| 58 | L | 93.6 | Very high | 78.3 | Confident | 65 Ų | 65 | 89 Ų | 89 | 34% | 0.34 | 51% | 0.507 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -109.3 | 97.7 | 175.9 | -70.8 | 87.5 | 0 | 0 | 0 | 108.2 | Q49 M56 | Q49-L58 HydrophobicContact CB-CB 4.08Å; Q49-L58 PolarHBondContact N-O 2.99Å; Q49-L58 VanDerWaalsContact N-O 3.16Å; Q49-L58 PolarHBondContact O-N 3.41Å; M56-L58 HydrophobicContact CB-CD1 4.44Å |
| 59 | P | 92.1 | Very high | 76.5 | Confident | 15 Ų | 15 | 92.7 Ų | 92.7 | 10% | 0.097 | 53% | 0.531 | C | S | . | . | P | Polyproline II helix | trans | -62.5 | 138.7 | 179.1 | -21.7 | 34.5 | 0 | 0 | 0 | 111.5 | V16 I23 W48 V57 | V16-P59 HydrophobicContact CG1-CB 4.47Å; V16-P59 HydrophobicContact CG1-CG 3.71Å; I23-P59 HydrophobicContact CG2-CG 4.28Å; W48-P59 VanDerWaalsContact CD2-CA 3.48Å; W48-P59 HydrophobicContact CD2-CB 3.93Å; W48-P59 HydrophobicContact CE3-CB 3.75Å; W48-P59 HydrophobicContact CE3-CG 4.02Å; W48-P59 HydrophobicContact CH2-CB 3.81Å; W48-P59 HydrophobicContact CH2-CG 4.29Å; W48-P59 HydrophobicContact CZ2-CB 3.95Å; W48-P59 HydrophobicContact CZ3-CB 3.69Å; W48-P59 HydrophobicContact CZ3-CG 3.82Å; V57-P59 WeakPolarHBondContact O-CD 3.37Å |
| 60 | R | 86.6 | Confident | 74.5 | Confident | 149 Ų | 149 | 91.1 Ų | 91.1 | 56% | 0.562 | 53% | 0.531 | S | S | * | . | P | Polyproline II helix | trans | -93.8 | 121.1 | 167.2 | -73.8 | -157.8 | 175.6 | -163.9 | -3.4 | 109.6 | G47 W48 | G47-R60 VanDerWaalsContact O-CD 3.24Å; G47-R60 WeakPolarHBondContact O-CD 3.34Å; W48-R60 VanDerWaalsContact CD1-N 3.31Å; W48-R60 PolarHBondContact NE1-O 2.95Å |
| 61 | K | 75.1 | Confident | 72.7 | Confident | 158 Ų | 158 | 94 Ų | 94 | 69% | 0.687 | 54% | 0.541 | S | S | * | . | P | Polyproline II helix | trans | -58.9 | 125.1 | 171.2 | -169.8 | 168.9 | -177 | 168.9 | 0 | 108.3 | A63 | K61-A63 PolarHBondContact O-N 2.85Š|
| 62 | P | 65.7 | Low | 70.8 | Confident | 63 Ų | 63 | 98.6 Ų | 98.6 | 41% | 0.409 | 57% | 0.566 | S | S | . | * | P | Polyproline II helix | trans | -57.7 | 133.3 | 173.1 | 22.3 | -30.5 | 0 | 0 | 0 | 108.4 | S64 L67 | P62-S64 PolarHBondContact O-N 3.25Å; P62-S64 VanDerWaalsContact O-N 3.09Å; P62-L67 HydrophobicContact CG-CD1 4.26Å |
| 63 | A | 56.2 | Low | 69.5 | Low | 99 Ų | 99 | 102.6 Ų | 102.6 | 82% | 0.818 | 56% | 0.564 | S | S | * | * | P | Polyproline II helix | trans | -50.9 | 121.9 | -179.7 | 0 | 0 | 0 | 0 | 0 | 108.7 | K61 G65 | K61-A63 PolarHBondContact O-N 2.85Å; A63-G65 PolarHBondContact O-N 3.07Å; A63-G65 VanDerWaalsContact O-N 3.12Å |
| 64 | S | 60.5 | Low | 68.1 | Low | 131 Ų | 131 | 105.8 Ų | 105.8 | 92% | 0.916 | 57% | 0.568 | S | S | * | * | S | Bend | trans | -42.2 | 117.4 | -175.3 | -178.6 | 0 | 0 | 0 | 0 | 111.2 | P62 | P62-S64 PolarHBondContact O-N 3.25Å; P62-S64 VanDerWaalsContact O-N 3.09Å |
| 65 | G | 51.8 | Low | 66.6 | Low | 65 Ų | 65 | 108.4 Ų | 108.4 | 67% | 0.67 | 58% | 0.577 | S | S | * | * | S | Bend | trans | -178 | -44.5 | 175.4 | 0 | 0 | 0 | 0 | 0 | 118.2 | A63 | A63-G65 PolarHBondContact O-N 3.07Å; A63-G65 VanDerWaalsContact O-N 3.12Å |
| 66 | T | 47.8 | Very low | 64.7 | Low | 132 Ų | 132 | 104 Ų | 104 | 81% | 0.81 | 57% | 0.572 | S | S | * | * | trans | -150 | 23.8 | -161.3 | 55.2 | 0 | 0 | 0 | 0 | 116.8 | D68 | T66-D68 VanDerWaalsContact C-N 3.32Å; T66-D68 PolarHBondContact O-N 2.8Å | ||
| 67 | L | 52.5 | Low | 62.8 | Low | 102 Ų | 102 | 109.1 Ų | 109.1 | 53% | 0.534 | 60% | 0.6 | S | S | . | * | trans | -95.3 | 79.5 | 158.9 | -63.6 | -179.1 | 0 | 0 | 0 | 107.1 | P62 V69 | P62-L67 HydrophobicContact CG-CD1 4.26Å; L67-V69 WeakPolarHBondContact O-CG2 3.23Å; L67-V69 PolarHBondContact O-N 3.32Å | ||
| 68 | D | 49.3 | Very low | 60.9 | Low | 130 Ų | 130 | 114.6 Ų | 114.6 | 70% | 0.695 | 64% | 0.638 | S | S | * | * | trans | -48.8 | 101.8 | 153.3 | -179.1 | -104.9 | 0 | 0 | 0 | 105.8 | T66 S70 | T66-D68 VanDerWaalsContact C-N 3.32Å; T66-D68 PolarHBondContact O-N 2.8Å; D68-S70 PolarHBondContact O-N 2.88Å; D68-S70 WeakPolarHBondContact OD1-CB 3.39Å; D68-S70 PolarHBondContact OD1-N 2.95Å; D68-S70 PolarHBondContact OD1-OG 3.45Å | ||
| 69 | V | 54.3 | Low | 58.8 | Low | 90 Ų | 90 | 118.9 Ų | 118.9 | 55% | 0.545 | 66% | 0.657 | S | S | . | * | trans | -73 | 63.6 | 174.1 | -174.3 | 0 | 0 | 0 | 0 | 105.9 | L67 L71 | L67-V69 WeakPolarHBondContact O-CG2 3.23Å; L67-V69 PolarHBondContact O-N 3.32Å; V69-L71 HydrophobicContact CG1-CB 3.38Å; V69-L71 HydrophobicContact CG1-CD2 4.18Å; V69-L71 HydrophobicContact CG1-CG 4.33Å; V69-L71 PolarHBondContact O-N 3.48Å | ||
| 70 | S | 51 | Low | 57.3 | Low | 71 Ų | 71 | 127.5 Ų | 127.5 | 50% | 0.497 | 71% | 0.713 | S | S | . | * | trans | -67.8 | 37 | 155.4 | -85.1 | 0 | 0 | 0 | 0 | 110.2 | D68 N72 | D68-S70 PolarHBondContact O-N 2.88Å; D68-S70 WeakPolarHBondContact OD1-CB 3.39Å; D68-S70 PolarHBondContact OD1-N 2.95Å; D68-S70 PolarHBondContact OD1-OG 3.45Å; S70-N72 PolarHBondContact O-N 3.33Å | ||
| 71 | L | 55.1 | Low | 55.9 | Low | 95 Ų | 95 | 126.5 Ų | 126.5 | 50% | 0.497 | 72% | 0.72 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -74.3 | -1.5 | 178.2 | -155.1 | 81.3 | 0 | 0 | 0 | 111.6 | V69 | V69-L71 HydrophobicContact CG1-CB 3.38Å; V69-L71 HydrophobicContact CG1-CD2 4.18Å; V69-L71 HydrophobicContact CG1-CG 4.33Å; V69-L71 PolarHBondContact O-N 3.48Å |
| 72 | N | 51.9 | Low | 54.9 | Low | 156 Ų | 156 | 124.8 Ų | 124.8 | 83% | 0.834 | 72% | 0.722 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -116.5 | 11.2 | -176.1 | -115.6 | 36.3 | 0 | 0 | 0 | 115.9 | S70 F74 | S70-N72 PolarHBondContact O-N 3.33Å; N72-F74 PolarHBondContact O-N 2.98Å; N72-F74 VanDerWaalsContact O-N 3.17Å |
| 73 | R | 56 | Low | 54.2 | Low | 194 Ų | 194 | 128.2 Ų | 128.2 | 73% | 0.732 | 74% | 0.739 | S | S | * | * | trans | -90.7 | 58.9 | 172 | -149.1 | -166.2 | -64.6 | -125.8 | -1 | 111.6 | I75 | R73-I75 VanDerWaalsContact C-N 3.3Å; R73-I75 HydrophobicContact CG-CG1 4.11Å; R73-I75 PolarHBondContact O-N 3.23Å; R73-I75 VanDerWaalsContact O-N 3.07Å | ||
| 74 | F | 59.1 | Low | 54.1 | Low | 195 Ų | 195 | 129.9 Ų | 129.9 | 86% | 0.855 | 74% | 0.735 | S | S | * | * | trans | -67.7 | 101.2 | 154.2 | -142 | -90.5 | 0 | 0 | 0 | 105 | N72 P76 | N72-F74 PolarHBondContact O-N 2.98Å; N72-F74 VanDerWaalsContact O-N 3.17Å; F74-P76 WeakPolarHBondContact O-CD 3.4Å | ||
| 75 | I | 58.8 | Low | 53.7 | Low | 135 Ų | 135 | 129.9 Ų | 129.9 | 69% | 0.692 | 72% | 0.723 | S | S | * | * | trans | -81.6 | 105 | 170.8 | -14.4 | 175.1 | 0 | 0 | 0 | 104.3 | R73 L77 | R73-I75 VanDerWaalsContact C-N 3.3Å; R73-I75 HydrophobicContact CG-CG1 4.11Å; R73-I75 PolarHBondContact O-N 3.23Å; R73-I75 VanDerWaalsContact O-N 3.07Å; I75-L77 PolarHBondContact O-N 2.95Å | ||
| 76 | P | 52.8 | Low | 53.9 | Low | 93 Ų | 93 | 134.2 Ų | 134.2 | 60% | 0.604 | 73% | 0.727 | S | S | * | * | trans | -59.1 | 129.2 | 167.8 | 26 | -31.5 | 0 | 0 | 0 | 106.8 | F74 S78 | F74-P76 WeakPolarHBondContact O-CD 3.4Å; P76-S78 VanDerWaalsContact C-N 3.26Å; P76-S78 PolarHBondContact O-N 3.06Å | ||
| 77 | L | 55 | Low | 54.3 | Low | 153 Ų | 153 | 134.4 Ų | 134.4 | 80% | 0.801 | 72% | 0.721 | S | S | * | * | trans | -62.2 | 94.6 | 170.7 | -165.6 | 83.1 | 0 | 0 | 0 | 106.5 | I75 E79 | I75-L77 PolarHBondContact O-N 2.95Å; L77-E79 PolarHBondContact O-N 3.11Å | ||
| 78 | S | 53.4 | Low | 54.4 | Low | 115 Ų | 115 | 136.8 Ų | 136.8 | 80% | 0.804 | 74% | 0.735 | S | S | * | * | trans | -73.1 | 105.1 | 166.7 | -68.9 | 0 | 0 | 0 | 0 | 107.5 | P76 | P76-S78 VanDerWaalsContact C-N 3.26Å; P76-S78 PolarHBondContact O-N 3.06Å | ||
| 79 | E | 49.5 | Very low | 54.9 | Low | 156 Ų | 156 | 137.4 Ų | 137.4 | 73% | 0.729 | 74% | 0.739 | S | S | * | * | trans | -113.3 | 149.7 | 150.5 | -94.4 | 170.7 | 78.2 | 0 | 0 | 106.8 | L77 | L77-E79 PolarHBondContact O-N 3.11Š| ||
| 80 | P | 61.5 | Low | 54.9 | Low | 196 Ų | 196 | 141.7 Ų | 141.7 | 100% | 1.273 | 76% | 0.756 | S | S | * | * | cis | -115 | 0 | 23.4 | 40.1 | -28.7 | 0 | 0 | 0 | 115.7 |
Retrieved 80 of 80 residues in 163.9 ms
(Link to these results)