| 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 | 68.3 | Low | 89 | Confident | 177 Ų | 177 | 66.3 Ų | 66.3 | 87% | 0.872 | 32% | 0.324 | S | S | * | . | 0 | 135.9 | 0 | -68.9 | -163.9 | -155.8 | 0 | 0 | 109.4 | E5 L6 | M1-E5 WeakPolarHBondContact CA-OE2 3.49Å; M1-L6 HydrophobicContact CB-CD2 4.22Å; M1-L6 HydrophobicContact CB-CG 4.01Å; M1-L6 HydrophobicContact SD-CD2 3.61Å; M1-L6 HydrophobicContact SD-CG 4.29Å | |||
| 2 | S | 87 | Confident | 89.3 | Confident | 47 Ų | 47 | 61 Ų | 61 | 33% | 0.329 | 30% | 0.299 | S | S | . | . | trans | -71.3 | 156.1 | 172.8 | 60.2 | 0 | 0 | 0 | 0 | 111 | S4 E5 L6 | S2-S4 WeakPolarHBondContact CB-OG 3.42Å; S2-S4 PolarHBondContact O-N 3.24Å; S2-S4 PolarHBondContact OG-OG 2.89Å; S2-E5 PolarHBondContact N-OE2 3.34Å; S2-E5 PolarHBondContact O-N 3.38Å; S2-E5 WeakPolarHBondContact OG-CB 2.99Å; S2-E5 WeakPolarHBondContact OG-CG 3.44Å; S2-E5 PolarHBondContact OG-N 3.41Å; S2-E5 PolarHBondContact OG-OE2 3.46Å; S2-L6 PolarHBondContact O-N 3.24Å | ||
| 3 | K | 88.2 | Confident | 89.5 | Confident | 166 Ų | 166 | 60.8 Ų | 60.8 | 72% | 0.722 | 30% | 0.3 | S | S | * | . | H | α-helix | trans | -60.6 | -29.7 | 176.4 | -68.2 | -178 | -177.7 | 174.1 | 0 | 111.9 | A7 F38 | K3-A7 WeakPolarHBondContact O-CB 3.44Å; K3-A7 PolarHBondContact O-N 2.84Å; K3-F38 HydrophobicContact CB-CE2 3.77Å |
| 4 | S | 89.6 | Confident | 89.7 | Confident | 14 Ų | 14 | 65 Ų | 65 | 10% | 0.098 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -67.9 | -45.7 | 175.6 | 30.9 | 0 | 0 | 0 | 0 | 112.7 | S2 A7 C8 F38 | S2-S4 WeakPolarHBondContact CB-OG 3.42Å; S2-S4 PolarHBondContact O-N 3.24Å; S2-S4 PolarHBondContact OG-OG 2.89Å; S4-A7 PolarHBondContact O-N 3.28Å; S4-C8 PolarHBondContact O-N 3.23Å; S4-C8 VanDerWaalsContact O-N 3.11Å; S4-F38 WeakPolarHBondContact CB-O 3.37Å |
| 5 | E | 90.3 | Very high | 90 | Very high | 64 Ų | 64 | 61.4 Ų | 61.4 | 30% | 0.299 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -60.6 | -48.3 | 173 | -76.7 | 168.6 | 144.9 | 0 | 0 | 111.4 | M1 S2 A7 C8 V9 L43 | M1-E5 WeakPolarHBondContact CA-OE2 3.49Å; S2-E5 PolarHBondContact N-OE2 3.34Å; S2-E5 PolarHBondContact O-N 3.38Å; S2-E5 WeakPolarHBondContact OG-CB 2.99Å; S2-E5 WeakPolarHBondContact OG-CG 3.44Å; S2-E5 PolarHBondContact OG-N 3.41Å; S2-E5 PolarHBondContact OG-OE2 3.46Å; E5-A7 VanDerWaalsContact C-N 3.27Å; E5-A7 PolarHBondContact O-N 3.36Å; E5-C8 PolarHBondContact O-N 3.49Å; E5-C8 VanDerWaalsContact O-N 3.11Å; E5-V9 WeakPolarHBondContact O-CG2 3.28Å; E5-V9 PolarHBondContact O-N 2.88Å; E5-L43 HydrophobicContact CB-CD1 4.47Å; E5-L43 HydrophobicContact CG-CD1 3.8Å; E5-L43 HydrophobicContact CG-CD2 4.16Å |
| 6 | L | 91.6 | Very high | 90 | Very high | 59 Ų | 59 | 58.9 Ų | 58.9 | 31% | 0.309 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -58.7 | -41.3 | 178.4 | -74.2 | 174.6 | 0 | 0 | 0 | 111.7 | M1 S2 C8 V9 Y10 | M1-L6 HydrophobicContact CB-CD2 4.22Å; M1-L6 HydrophobicContact CB-CG 4.01Å; M1-L6 HydrophobicContact SD-CD2 3.61Å; M1-L6 HydrophobicContact SD-CG 4.29Å; S2-L6 PolarHBondContact O-N 3.24Å; L6-C8 VanDerWaalsContact C-N 3.34Å; L6-C8 PolarHBondContact O-N 3.06Å; L6-V9 PolarHBondContact O-N 2.93Å; L6-Y10 HydrophobicContact CB-CD2 4.35Å; L6-Y10 HydrophobicContact CB-CE2 4.05Å; L6-Y10 HydrophobicContact CD2-CE2 4.43Å; L6-Y10 WeakPolarHBondContact O-CD2 3.43Å; L6-Y10 PolarHBondContact O-N 3.44Å |
| 7 | A | 92.5 | Very high | 90.1 | Very high | 10 Ų | 10 | 61.3 Ų | 61.3 | 8% | 0.083 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -60.6 | -42.6 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | K3 S4 E5 A11 L31 I36 V39 | K3-A7 WeakPolarHBondContact O-CB 3.44Å; K3-A7 PolarHBondContact O-N 2.84Å; S4-A7 PolarHBondContact O-N 3.28Å; E5-A7 VanDerWaalsContact C-N 3.27Å; E5-A7 PolarHBondContact O-N 3.36Å; A7-A11 VanDerWaalsContact O-CB 3.29Å; A7-A11 WeakPolarHBondContact O-CB 3.49Å; A7-A11 PolarHBondContact O-N 3.5Å; A7-L31 HydrophobicContact CB-CD2 3.57Å; A7-I36 HydrophobicContact CB-CD1 3.57Å; A7-I36 HydrophobicContact CB-CG2 4.04Å; A7-V39 HydrophobicContact CB-CG2 4.23Å |
| 8 | C | 92.7 | Very high | 90.2 | Very high | 0 Ų | 0 | 64.2 Ų | 64.2 | 0% | 0 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -66 | -40.7 | 174.4 | -82.4 | 0 | 0 | 0 | 0 | 112.8 | S4 E5 L6 A11 A12 V39 F47 | S4-C8 PolarHBondContact O-N 3.23Å; S4-C8 VanDerWaalsContact O-N 3.11Å; E5-C8 PolarHBondContact O-N 3.49Å; E5-C8 VanDerWaalsContact O-N 3.11Å; L6-C8 VanDerWaalsContact C-N 3.34Å; L6-C8 PolarHBondContact O-N 3.06Å; C8-A11 PolarHBondContact O-N 3.39Å; C8-A12 WeakPolarHBondContact O-CB 3.25Å; C8-A12 PolarHBondContact O-N 3.47Å; C8-V39 WeakPolarHBondContact SG-CG1 3.35Å; C8-F47 HydrophobicContact CB-CD2 3.41Å; C8-F47 VanDerWaalsContact CB-CD2 3.41Å; C8-F47 HydrophobicContact CB-CE2 3.47Å; C8-F47 VanDerWaalsContact CB-CE2 3.47Å; C8-F47 HydrophobicContact CB-CG 4.28Å; C8-F47 HydrophobicContact CB-CZ 4.37Å |
| 9 | V | 92.8 | Very high | 90.1 | Very high | 41 Ų | 41 | 68.1 Ų | 68.1 | 25% | 0.248 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -61.8 | -48.6 | 176.9 | 173.6 | 0 | 0 | 0 | 0 | 110.4 | E5 L6 A11 A12 L13 F47 | E5-V9 WeakPolarHBondContact O-CG2 3.28Å; E5-V9 PolarHBondContact O-N 2.88Å; L6-V9 PolarHBondContact O-N 2.93Å; V9-A11 PolarHBondContact O-N 2.95Å; V9-A12 PolarHBondContact O-N 3.23Å; V9-L13 HydrophobicContact CG1-CD1 3.96Å; V9-L13 HydrophobicContact CG1-CG 4.43Å; V9-L13 WeakPolarHBondContact O-CG 3.47Å; V9-L13 PolarHBondContact O-N 3.41Å; V9-F47 HydrophobicContact CG2-CE1 3.57Å; V9-F47 HydrophobicContact CG2-CE2 4.45Å; V9-F47 HydrophobicContact CG2-CZ 3.48Å; V9-F47 VanDerWaalsContact CG2-CZ 3.48Å |
| 10 | Y | 93.6 | Very high | 90 | Very high | 149 Ų | 149 | 68.2 Ų | 68.2 | 58% | 0.584 | 35% | 0.347 | S | S | * | . | H | α-helix | trans | -64.1 | -40.1 | 177.7 | -68.3 | -52.7 | 0 | 0 | 0 | 112.2 | L6 A12 L13 M14 | L6-Y10 HydrophobicContact CB-CD2 4.35Å; L6-Y10 HydrophobicContact CB-CE2 4.05Å; L6-Y10 HydrophobicContact CD2-CE2 4.43Å; L6-Y10 WeakPolarHBondContact O-CD2 3.43Å; L6-Y10 PolarHBondContact O-N 3.44Å; Y10-A12 VanDerWaalsContact C-N 3.35Å; Y10-A12 PolarHBondContact O-N 3.45Å; Y10-L13 PolarHBondContact O-N 3.37Å; Y10-M14 WeakPolarHBondContact O-CB 2.96Å; Y10-M14 PolarHBondContact O-N 3.41Å |
| 11 | A | 93 | Very high | 90 | Very high | 2 Ų | 2 | 70.6 Ų | 70.6 | 2% | 0.017 | 36% | 0.361 | C | S | . | . | H | α-helix | trans | -62.5 | -41.8 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112 | A7 C8 V9 M14 L15 I27 V30 | A7-A11 VanDerWaalsContact O-CB 3.29Å; A7-A11 WeakPolarHBondContact O-CB 3.49Å; A7-A11 PolarHBondContact O-N 3.5Å; C8-A11 PolarHBondContact O-N 3.39Å; V9-A11 PolarHBondContact O-N 2.95Å; A11-M14 PolarHBondContact O-N 3.08Å; A11-L15 VanDerWaalsContact O-CG 3.28Å; A11-L15 WeakPolarHBondContact O-CG 3.18Å; A11-L15 PolarHBondContact O-N 3.23Å; A11-L15 VanDerWaalsContact O-N 3.08Å; A11-I27 HydrophobicContact CB-CG2 4.05Å; A11-V30 HydrophobicContact CB-CB 3.95Å; A11-V30 HydrophobicContact CB-CG1 3.71Å |
| 12 | A | 92.1 | Very high | 91.2 | Very high | 3 Ų | 3 | 63.2 Ų | 63.2 | 3% | 0.025 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -66.2 | -40.3 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | C8 V9 Y10 A16 V22 L51 | C8-A12 WeakPolarHBondContact O-CB 3.25Å; C8-A12 PolarHBondContact O-N 3.47Å; V9-A12 PolarHBondContact O-N 3.23Å; Y10-A12 VanDerWaalsContact C-N 3.35Å; Y10-A12 PolarHBondContact O-N 3.45Å; A12-A16 WeakPolarHBondContact O-CB 3.22Å; A12-A16 PolarHBondContact O-N 2.87Å; A12-V22 HydrophobicContact CB-CG1 3.86Å; A12-L51 HydrophobicContact CB-CD1 3.62Å |
| 13 | L | 92.1 | Very high | 91.5 | Very high | 59 Ų | 59 | 63.3 Ų | 63.3 | 31% | 0.309 | 33% | 0.325 | S | S | . | . | H | α-helix | trans | -65.4 | -42.3 | 174.8 | -71.6 | 171.6 | 0 | 0 | 0 | 111.9 | V9 Y10 L15 A16 D17 V56 | V9-L13 HydrophobicContact CG1-CD1 3.96Å; V9-L13 HydrophobicContact CG1-CG 4.43Å; V9-L13 WeakPolarHBondContact O-CG 3.47Å; V9-L13 PolarHBondContact O-N 3.41Å; Y10-L13 PolarHBondContact O-N 3.37Å; L13-L15 PolarHBondContact O-N 3.47Å; L13-A16 PolarHBondContact O-N 3.13Å; L13-D17 WeakPolarHBondContact O-CB 3.4Å; L13-D17 PolarHBondContact O-N 2.98Å; L13-V56 HydrophobicContact CD2-CG1 3.71Å |
| 14 | M | 92.7 | Very high | 91.7 | Very high | 119 Ų | 119 | 56.2 Ų | 56.2 | 59% | 0.586 | 30% | 0.297 | S | S | * | . | H | α-helix | trans | -58.2 | -48.8 | 175.5 | -115.4 | 178.7 | 168 | 0 | 0 | 111.6 | Y10 A11 A16 D17 D18 V30 | Y10-M14 WeakPolarHBondContact O-CB 2.96Å; Y10-M14 PolarHBondContact O-N 3.41Å; A11-M14 PolarHBondContact O-N 3.08Å; M14-A16 VanDerWaalsContact C-N 3.29Å; M14-A16 PolarHBondContact O-N 3.33Å; M14-D17 PolarHBondContact O-N 3.41Å; M14-D18 PolarHBondContact O-N 3.05Å; M14-D18 VanDerWaalsContact O-N 3.13Å; M14-V30 HydrophobicContact SD-CG1 4.43Å |
| 15 | L | 93.1 | Very high | 91.9 | Very high | 11 Ų | 11 | 61.6 Ų | 61.6 | 6% | 0.058 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -61.8 | -40 | 178 | -68.8 | 169.4 | 0 | 0 | 0 | 111.5 | A11 L13 D18 D19 I20 V22 K26 I27 V30 | A11-L15 VanDerWaalsContact O-CG 3.28Å; A11-L15 WeakPolarHBondContact O-CG 3.18Å; A11-L15 PolarHBondContact O-N 3.23Å; A11-L15 VanDerWaalsContact O-N 3.08Å; L13-L15 PolarHBondContact O-N 3.47Å; L15-D18 PolarHBondContact O-N 2.91Å; L15-D19 PolarHBondContact O-N 2.76Å; L15-I20 CarbonylContact C-O 3.49Å; L15-I20 HydrophobicContact CD2-CB 4.24Å; L15-I20 HydrophobicContact CD2-CG2 3.99Å; L15-I20 WeakPolarHBondContact O-CA 3.41Å; L15-I20 PolarHBondContact O-N 3.38Å; L15-V22 HydrophobicContact CB-CG2 4.14Å; L15-K26 HydrophobicContact CD1-CB 3.64Å; L15-K26 HydrophobicContact CD2-CB 3.96Å; L15-K26 HydrophobicContact CG-CB 4.48Å; L15-I27 HydrophobicContact CD1-CG1 3.86Å; L15-V30 HydrophobicContact CD2-CG2 4.18Å; L15-V30 HydrophobicContact CG-CG2 4.32Å |
| 16 | A | 90.8 | Very high | 92 | Very high | 21 Ų | 21 | 61.4 Ų | 61.4 | 17% | 0.174 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -70.6 | -32.4 | 178.1 | 0 | 0 | 0 | 0 | 0 | 113.6 | A12 L13 M14 D19 V22 V56 | A12-A16 WeakPolarHBondContact O-CB 3.22Å; A12-A16 PolarHBondContact O-N 2.87Å; L13-A16 PolarHBondContact O-N 3.13Å; M14-A16 VanDerWaalsContact C-N 3.29Å; M14-A16 PolarHBondContact O-N 3.33Å; A16-D19 PolarHBondContact O-N 2.91Å; A16-V22 HydrophobicContact CB-CG2 4.31Å; A16-V56 HydrophobicContact CB-CB 3.66Å; A16-V56 HydrophobicContact CB-CG1 4.14Å; A16-V56 HydrophobicContact CB-CG2 3.49Å; A16-V56 VanDerWaalsContact CB-CG2 3.49Å |
| 17 | D | 91.2 | Very high | 92.1 | Very high | 100 Ų | 100 | 58.6 Ų | 58.6 | 54% | 0.535 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -70 | -33.2 | 175.4 | -93.5 | -16.6 | 0 | 0 | 0 | 112.2 | L13 M14 D19 R57 | L13-D17 WeakPolarHBondContact O-CB 3.4Å; L13-D17 PolarHBondContact O-N 2.98Å; M14-D17 PolarHBondContact O-N 3.41Å; D17-D19 PolarHBondContact O-N 3.19Å; D17-R57 IonicContact OD1-NH2 3.54Å |
| 18 | D | 91.9 | Very high | 92.1 | Very high | 114 Ų | 114 | 60.8 Ų | 60.8 | 61% | 0.61 | 32% | 0.319 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -82.7 | 6.6 | 175.3 | -71.5 | -26.1 | 0 | 0 | 0 | 113.3 | M14 L15 I20 | M14-D18 PolarHBondContact O-N 3.05Å; M14-D18 VanDerWaalsContact O-N 3.13Å; L15-D18 PolarHBondContact O-N 2.91Å; D18-I20 HydrophobicContact CB-CD1 3.86Å; D18-I20 HydrophobicContact CB-CG1 3.91Å; D18-I20 PolarHBondContact O-N 3.19Å |
| 19 | D | 87.7 | Confident | 92.2 | Very high | 137 Ų | 137 | 64.9 Ų | 64.9 | 73% | 0.733 | 34% | 0.344 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 54.5 | 32.6 | -174.7 | -65 | -50.6 | 0 | 0 | 0 | 113.4 | L15 A16 D17 | L15-D19 PolarHBondContact O-N 2.76Å; A16-D19 PolarHBondContact O-N 2.91Å; D17-D19 PolarHBondContact O-N 3.19Å |
| 20 | I | 89.5 | Confident | 92.2 | Very high | 70 Ų | 70 | 64.7 Ų | 64.7 | 36% | 0.359 | 34% | 0.343 | S | S | . | . | trans | -99.3 | 133.4 | 177.1 | -59.4 | 177.3 | 0 | 0 | 0 | 109.3 | L15 D18 V22 K26 | L15-I20 CarbonylContact C-O 3.49Å; L15-I20 HydrophobicContact CD2-CB 4.24Å; L15-I20 HydrophobicContact CD2-CG2 3.99Å; L15-I20 WeakPolarHBondContact O-CA 3.41Å; L15-I20 PolarHBondContact O-N 3.38Å; D18-I20 HydrophobicContact CB-CD1 3.86Å; D18-I20 HydrophobicContact CB-CG1 3.91Å; D18-I20 PolarHBondContact O-N 3.19Å; I20-V22 PolarHBondContact O-N 2.97Å; I20-K26 HydrophobicContact CG2-CD 3.59Å | ||
| 21 | D | 90.2 | Very high | 92.2 | Very high | 119 Ų | 119 | 58 Ų | 58 | 64% | 0.636 | 32% | 0.317 | S | S | * | . | trans | -54.7 | 132.4 | 178.3 | -51.1 | -62.6 | 0 | 0 | 0 | 112.2 | T23 K26 | D21-T23 HydrophobicContact CB-CG2 4.19Å; D21-T23 PolarHBondContact O-N 3.43Å; D21-K26 WeakPolarHBondContact O-CD 3.35Å; D21-K26 PolarHBondContact O-NZ 2.98Å; D21-K26 VanDerWaalsContact O-NZ 3.13Å; D21-K26 IonicContact OD2-NZ 3.6Å | ||
| 22 | V | 91.7 | Very high | 92.1 | Very high | 22 Ų | 22 | 65.2 Ų | 65.2 | 13% | 0.133 | 35% | 0.348 | C | S | . | . | trans | -79.2 | 91.6 | 178.4 | -175.7 | 0 | 0 | 0 | 0 | 109.7 | A12 L15 A16 I20 I27 L51 | A12-V22 HydrophobicContact CB-CG1 3.86Å; L15-V22 HydrophobicContact CB-CG2 4.14Å; A16-V22 HydrophobicContact CB-CG2 4.31Å; I20-V22 PolarHBondContact O-N 2.97Å; V22-I27 HydrophobicContact CG1-CD1 3.76Å; V22-I27 HydrophobicContact CG1-CG1 4.19Å; V22-L51 HydrophobicContact CB-CB 4.47Å; V22-L51 HydrophobicContact CG1-CB 4.41Å; V22-L51 HydrophobicContact CG1-CD1 3.99Å | ||
| 23 | T | 93.7 | Very high | 92.2 | Very high | 49 Ų | 49 | 69 Ų | 69 | 30% | 0.301 | 38% | 0.379 | S | S | . | . | trans | -112.1 | 158.3 | 175.6 | 72.1 | 0 | 0 | 0 | 0 | 111.9 | D21 D25 K26 I27 | D21-T23 HydrophobicContact CB-CG2 4.19Å; D21-T23 PolarHBondContact O-N 3.43Å; T23-D25 VanDerWaalsContact C-N 3.26Å; T23-D25 PolarHBondContact O-N 2.98Å; T23-K26 HydrophobicContact CG2-CD 4.5Å; T23-K26 PolarHBondContact O-N 3.38Å; T23-K26 WeakPolarHBondContact OG1-CD 3.33Å; T23-K26 WeakPolarHBondContact OG1-CG 3.34Å; T23-K26 PolarHBondContact OG1-N 3.24Å; T23-I27 WeakPolarHBondContact O-CG1 3.37Å; T23-I27 PolarHBondContact O-N 2.9Å | ||
| 24 | A | 92.7 | Very high | 92.2 | Very high | 18 Ų | 18 | 68.9 Ų | 68.9 | 15% | 0.149 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -59 | -38.1 | -179.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | N28 P44 A48 | A24-N28 WeakPolarHBondContact O-CB 3.42Å; A24-N28 PolarHBondContact O-N 3.45Å; A24-N28 PolarHBondContact O-ND2 3.48Å; A24-P44 HydrophobicContact CB-CB 4.22Å; A24-A48 HydrophobicContact CB-CB 4.29Å |
| 25 | D | 93.2 | Very high | 92 | Very high | 126 Ų | 126 | 69.4 Ų | 69.4 | 67% | 0.674 | 39% | 0.392 | S | S | * | . | H | α-helix | trans | -66.1 | -40.6 | 178.6 | -63 | -49.4 | 0 | 0 | 0 | 112.4 | T23 N28 T29 | T23-D25 VanDerWaalsContact C-N 3.26Å; T23-D25 PolarHBondContact O-N 2.98Å; D25-N28 PolarHBondContact O-N 3.07Å; D25-T29 PolarHBondContact O-N 3.24Å; D25-T29 PolarHBondContact O-OG1 2.89Å |
| 26 | K | 93.7 | Very high | 91.7 | Very high | 60 Ų | 60 | 71.1 Ų | 71.1 | 26% | 0.261 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -70.1 | -42 | 178.5 | -71.6 | 171 | 176.9 | 179.6 | 0 | 111.6 | L15 I20 D21 T23 N28 T29 V30 | L15-K26 HydrophobicContact CD1-CB 3.64Å; L15-K26 HydrophobicContact CD2-CB 3.96Å; L15-K26 HydrophobicContact CG-CB 4.48Å; I20-K26 HydrophobicContact CG2-CD 3.59Å; D21-K26 WeakPolarHBondContact O-CD 3.35Å; D21-K26 PolarHBondContact O-NZ 2.98Å; D21-K26 VanDerWaalsContact O-NZ 3.13Å; D21-K26 IonicContact OD2-NZ 3.6Å; T23-K26 HydrophobicContact CG2-CD 4.5Å; T23-K26 PolarHBondContact O-N 3.38Å; T23-K26 WeakPolarHBondContact OG1-CD 3.33Å; T23-K26 WeakPolarHBondContact OG1-CG 3.34Å; T23-K26 PolarHBondContact OG1-N 3.24Å; K26-N28 VanDerWaalsContact C-N 3.32Å; K26-N28 PolarHBondContact O-N 3.18Å; K26-T29 WeakPolarHBondContact CA-OG1 3.49Å; K26-T29 PolarHBondContact O-N 3.25Å; K26-T29 PolarHBondContact O-OG1 3.01Å; K26-V30 WeakPolarHBondContact O-CG2 3.49Å; K26-V30 PolarHBondContact O-N 3.26Å |
| 27 | I | 93.6 | Very high | 91.2 | Very high | 0 Ų | 0 | 79.1 Ų | 79.1 | 0% | 0 | 43% | 0.431 | C | S | . | . | H | α-helix | trans | -59.3 | -46.8 | 172.7 | -66.7 | 165.9 | 0 | 0 | 0 | 109.8 | A11 L15 V22 T23 T29 V30 L31 P44 F47 | A11-I27 HydrophobicContact CB-CG2 4.05Å; L15-I27 HydrophobicContact CD1-CG1 3.86Å; V22-I27 HydrophobicContact CG1-CD1 3.76Å; V22-I27 HydrophobicContact CG1-CG1 4.19Å; T23-I27 WeakPolarHBondContact O-CG1 3.37Å; T23-I27 PolarHBondContact O-N 2.9Å; I27-T29 VanDerWaalsContact C-N 3.29Å; I27-T29 PolarHBondContact O-N 3.45Å; I27-V30 PolarHBondContact O-N 2.88Å; I27-L31 HydrophobicContact CG2-CD1 3.82Å; I27-L31 HydrophobicContact CG2-CG 4.24Å; I27-L31 VanDerWaalsContact O-CG 3.25Å; I27-L31 WeakPolarHBondContact O-CG 3.29Å; I27-L31 PolarHBondContact O-N 3.26Å; I27-P44 HydrophobicContact CB-CB 4.17Å; I27-P44 WeakPolarHBondContact CD1-O 3.32Å; I27-P44 HydrophobicContact CG2-CB 3.9Å; I27-P44 HydrophobicContact CG2-CG 4.2Å; I27-F47 HydrophobicContact CD1-CB 3.95Å |
| 28 | N | 92.7 | Very high | 90.8 | Very high | 56 Ų | 56 | 80.2 Ų | 80.2 | 30% | 0.299 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -62.2 | -34 | 178 | -81.4 | -46.3 | 0 | 0 | 0 | 113.2 | A24 D25 K26 K32 P44 | A24-N28 WeakPolarHBondContact O-CB 3.42Å; A24-N28 PolarHBondContact O-N 3.45Å; A24-N28 PolarHBondContact O-ND2 3.48Å; D25-N28 PolarHBondContact O-N 3.07Å; K26-N28 VanDerWaalsContact C-N 3.32Å; K26-N28 PolarHBondContact O-N 3.18Å; N28-K32 WeakPolarHBondContact O-CB 3.38Å; N28-K32 WeakPolarHBondContact O-CG 3.46Å; N28-K32 PolarHBondContact O-N 3.11Å; N28-P44 WeakPolarHBondContact OD1-CG 3.46Å |
| 29 | T | 93.8 | Very high | 90.4 | Very high | 86 Ų | 86 | 76.2 Ų | 76.2 | 53% | 0.528 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -69 | -41.7 | 175.8 | 18.3 | 0 | 0 | 0 | 0 | 111.5 | D25 K26 I27 K32 A33 | D25-T29 PolarHBondContact O-N 3.24Å; D25-T29 PolarHBondContact O-OG1 2.89Å; K26-T29 WeakPolarHBondContact CA-OG1 3.49Å; K26-T29 PolarHBondContact O-N 3.25Å; K26-T29 PolarHBondContact O-OG1 3.01Å; I27-T29 VanDerWaalsContact C-N 3.29Å; I27-T29 PolarHBondContact O-N 3.45Å; T29-K32 PolarHBondContact O-N 3.34Å; T29-A33 WeakPolarHBondContact O-CB 3.36Å; T29-A33 PolarHBondContact O-N 3.33Å |
| 30 | V | 93.8 | Very high | 90.4 | Very high | 38 Ų | 38 | 74.2 Ų | 74.2 | 23% | 0.23 | 40% | 0.397 | C | S | . | . | H | α-helix | trans | -62.3 | -45 | 173.7 | 177 | 0 | 0 | 0 | 0 | 111 | A11 M14 L15 K26 I27 K32 A33 A34 | A11-V30 HydrophobicContact CB-CB 3.95Å; A11-V30 HydrophobicContact CB-CG1 3.71Å; M14-V30 HydrophobicContact SD-CG1 4.43Å; L15-V30 HydrophobicContact CD2-CG2 4.18Å; L15-V30 HydrophobicContact CG-CG2 4.32Å; K26-V30 WeakPolarHBondContact O-CG2 3.49Å; K26-V30 PolarHBondContact O-N 3.26Å; I27-V30 PolarHBondContact O-N 2.88Å; V30-K32 VanDerWaalsContact C-N 3.34Å; V30-K32 PolarHBondContact O-N 2.87Å; V30-A33 PolarHBondContact O-N 2.89Å; V30-A34 WeakPolarHBondContact O-CB 3.27Å; V30-A34 PolarHBondContact O-N 3.02Å |
| 31 | L | 92.7 | Very high | 90.3 | Very high | 7 Ų | 7 | 76.1 Ų | 76.1 | 4% | 0.037 | 42% | 0.417 | C | S | . | . | H | α-helix | trans | -62 | -40.2 | 178.2 | -69 | 172.6 | 0 | 0 | 0 | 112.7 | A7 I27 A34 N35 I36 V39 P44 | A7-L31 HydrophobicContact CB-CD2 3.57Å; I27-L31 HydrophobicContact CG2-CD1 3.82Å; I27-L31 HydrophobicContact CG2-CG 4.24Å; I27-L31 VanDerWaalsContact O-CG 3.25Å; I27-L31 WeakPolarHBondContact O-CG 3.29Å; I27-L31 PolarHBondContact O-N 3.26Å; L31-A34 PolarHBondContact O-N 3.26Å; L31-N35 PolarHBondContact O-N 3.46Å; L31-I36 HydrophobicContact CD2-CB 4.36Å; L31-I36 HydrophobicContact CD2-CD1 4.31Å; L31-I36 PolarHBondContact O-N 3.11Å; L31-V39 HydrophobicContact CD1-CB 3.95Å; L31-V39 HydrophobicContact CD1-CG1 3.8Å; L31-V39 HydrophobicContact CD1-CG2 3.76Å; L31-V39 HydrophobicContact CD2-CG2 3.84Å; L31-V39 HydrophobicContact CG-CG2 4.35Å; L31-P44 HydrophobicContact CD1-CG 4.28Å |
| 32 | K | 91.6 | Very high | 90.3 | Very high | 155 Ų | 155 | 76.4 Ų | 76.4 | 67% | 0.674 | 41% | 0.41 | S | S | * | . | H | α-helix | trans | -64.5 | -43.8 | 173.7 | -75.6 | 171.3 | -174.9 | 174.8 | 0 | 111.5 | N28 T29 V30 A34 N35 | N28-K32 WeakPolarHBondContact O-CB 3.38Å; N28-K32 WeakPolarHBondContact O-CG 3.46Å; N28-K32 PolarHBondContact O-N 3.11Å; T29-K32 PolarHBondContact O-N 3.34Å; V30-K32 VanDerWaalsContact C-N 3.34Å; V30-K32 PolarHBondContact O-N 2.87Å; K32-A34 VanDerWaalsContact C-N 3.27Å; K32-A34 PolarHBondContact O-N 3.13Å; K32-N35 PolarHBondContact O-N 2.96Å |
| 33 | A | 93.6 | Very high | 90.3 | Very high | 81 Ų | 81 | 75.5 Ų | 75.5 | 67% | 0.669 | 40% | 0.404 | S | S | * | . | H | α-helix | trans | -62 | -36.5 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | T29 V30 N35 | T29-A33 WeakPolarHBondContact O-CB 3.36Å; T29-A33 PolarHBondContact O-N 3.33Å; V30-A33 PolarHBondContact O-N 2.89Å; A33-N35 PolarHBondContact O-N 3.35Å |
| 34 | A | 91.5 | Very high | 90.2 | Very high | 57 Ų | 57 | 73.2 Ų | 73.2 | 47% | 0.471 | 39% | 0.39 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -78 | 0.8 | 175.5 | 0 | 0 | 0 | 0 | 0 | 114.1 | V30 L31 K32 I36 | V30-A34 WeakPolarHBondContact O-CB 3.27Å; V30-A34 PolarHBondContact O-N 3.02Å; L31-A34 PolarHBondContact O-N 3.26Å; K32-A34 VanDerWaalsContact C-N 3.27Å; K32-A34 PolarHBondContact O-N 3.13Å; A34-I36 HydrophobicContact CB-CD1 3.83Å; A34-I36 HydrophobicContact CB-CG1 3.82Å; A34-I36 PolarHBondContact O-N 3.07Å |
| 35 | N | 90 | Very high | 90.2 | Very high | 130 Ų | 130 | 77 Ų | 77 | 70% | 0.695 | 41% | 0.408 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 56.4 | 28.3 | -175.1 | -71.2 | -68.7 | 0 | 0 | 0 | 114.5 | L31 K32 A33 K37 | L31-N35 PolarHBondContact O-N 3.46Å; K32-N35 PolarHBondContact O-N 2.96Å; A33-N35 PolarHBondContact O-N 3.35Å; N35-K37 PolarHBondContact O-N 3.19Å |
| 36 | I | 85.8 | Confident | 90.2 | Very high | 48 Ų | 48 | 75.5 Ų | 75.5 | 25% | 0.246 | 40% | 0.399 | C | S | . | . | trans | -90.4 | 107.6 | 179.4 | -54.6 | 177.7 | 0 | 0 | 0 | 108.4 | A7 L31 A34 F38 V39 | A7-I36 HydrophobicContact CB-CD1 3.57Å; A7-I36 HydrophobicContact CB-CG2 4.04Å; L31-I36 HydrophobicContact CD2-CB 4.36Å; L31-I36 HydrophobicContact CD2-CD1 4.31Å; L31-I36 PolarHBondContact O-N 3.11Å; A34-I36 HydrophobicContact CB-CD1 3.83Å; A34-I36 HydrophobicContact CB-CG1 3.82Å; A34-I36 PolarHBondContact O-N 3.07Å; I36-F38 HydrophobicContact CG2-CD2 4.09Å; I36-F38 HydrophobicContact CG2-CE1 4.27Å; I36-F38 HydrophobicContact CG2-CE2 3.72Å; I36-F38 HydrophobicContact CG2-CZ 3.83Å; I36-V39 HydrophobicContact CG2-CG2 3.79Å | ||
| 37 | K | 80.7 | Confident | 90.1 | Very high | 188 Ų | 188 | 74.5 Ų | 74.5 | 82% | 0.817 | 40% | 0.395 | S | S | * | . | trans | -98.9 | -12.1 | -174.5 | -64.9 | 179.9 | -178.7 | 169.4 | 0 | 114.5 | N35 | N35-K37 PolarHBondContact O-N 3.19Š| ||
| 38 | F | 82.7 | Confident | 90 | Very high | 124 Ų | 124 | 75 Ų | 75 | 54% | 0.544 | 40% | 0.4 | S | S | . | . | trans | -99.6 | 26.8 | -171.4 | 44.9 | -97.3 | 0 | 0 | 0 | 113.4 | K3 S4 I36 | K3-F38 HydrophobicContact CB-CE2 3.77Å; S4-F38 WeakPolarHBondContact CB-O 3.37Å; I36-F38 HydrophobicContact CG2-CD2 4.09Å; I36-F38 HydrophobicContact CG2-CE1 4.27Å; I36-F38 HydrophobicContact CG2-CE2 3.72Å; I36-F38 HydrophobicContact CG2-CZ 3.83Å | ||
| 39 | V | 83.9 | Confident | 90 | Very high | 29 Ų | 29 | 77 Ų | 77 | 18% | 0.176 | 41% | 0.414 | C | S | . | . | trans | -88.3 | 129.8 | 174.7 | -179.3 | 0 | 0 | 0 | 0 | 110.2 | A7 C8 L31 I36 L43 P44 | A7-V39 HydrophobicContact CB-CG2 4.23Å; C8-V39 WeakPolarHBondContact SG-CG1 3.35Å; L31-V39 HydrophobicContact CD1-CB 3.95Å; L31-V39 HydrophobicContact CD1-CG1 3.8Å; L31-V39 HydrophobicContact CD1-CG2 3.76Å; L31-V39 HydrophobicContact CD2-CG2 3.84Å; L31-V39 HydrophobicContact CG-CG2 4.35Å; I36-V39 HydrophobicContact CG2-CG2 3.79Å; V39-L43 HydrophobicContact CG1-CB 4.19Å; V39-L43 HydrophobicContact CG1-CD1 4.42Å; V39-P44 HydrophobicContact CG1-CG 4.21Å | ||
| 40 | E | 87.2 | Confident | 89.9 | Confident | 95 Ų | 95 | 75 Ų | 75 | 44% | 0.444 | 41% | 0.406 | S | S | . | . | trans | -68.8 | 133 | 175.9 | -60.9 | 176.4 | 142.6 | 0 | 0 | 109.9 | Y42 L43 P44 | E40-Y42 HydrophobicContact CB-CD1 3.7Å; E40-Y42 HydrophobicContact CB-CE1 3.48Å; E40-Y42 VanDerWaalsContact CB-CE1 3.48Å; E40-Y42 HydrophobicContact CG-CE1 4.1Å; E40-Y42 PolarHBondContact O-N 3.29Å; E40-Y42 WeakPolarHBondContact OE2-CE1 3.34Å; E40-Y42 PolarHBondContact OE2-OH 2.97Å; E40-L43 HydrophobicContact CB-CG 4.43Å; E40-L43 PolarHBondContact O-N 2.96Å; E40-P44 VanDerWaalsContact O-CD 3.24Å; E40-P44 WeakPolarHBondContact O-CD 3.44Å | ||
| 41 | S | 86.5 | Confident | 89.7 | Confident | 110 Ų | 110 | 74.7 Ų | 74.7 | 77% | 0.769 | 40% | 0.403 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -55.7 | -27.4 | -173.6 | -177.4 | 0 | 0 | 0 | 0 | 114 | ||
| 42 | Y | 91.9 | Very high | 89.4 | Confident | 126 Ų | 126 | 80.7 Ų | 80.7 | 49% | 0.494 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -75.5 | -24.5 | 179.1 | 77.3 | -91.5 | 0 | 0 | 0 | 113.1 | E40 N45 L46 | E40-Y42 HydrophobicContact CB-CD1 3.7Å; E40-Y42 HydrophobicContact CB-CE1 3.48Å; E40-Y42 VanDerWaalsContact CB-CE1 3.48Å; E40-Y42 HydrophobicContact CG-CE1 4.1Å; E40-Y42 PolarHBondContact O-N 3.29Å; E40-Y42 WeakPolarHBondContact OE2-CE1 3.34Å; E40-Y42 PolarHBondContact OE2-OH 2.97Å; Y42-N45 PolarHBondContact O-N 3.42Å; Y42-L46 WeakPolarHBondContact O-CB 3.22Å; Y42-L46 PolarHBondContact O-N 3.45Å |
| 43 | L | 91.8 | Very high | 89 | Confident | 2 Ų | 2 | 77.3 Ų | 77.3 | 1% | 0.01 | 44% | 0.444 | C | S | . | . | H | α-helix | trans | -65.5 | -49.8 | -175.1 | -75.3 | -178.3 | 0 | 0 | 0 | 113.3 | E5 V39 E40 N45 L46 F47 | E5-L43 HydrophobicContact CB-CD1 4.47Å; E5-L43 HydrophobicContact CG-CD1 3.8Å; E5-L43 HydrophobicContact CG-CD2 4.16Å; V39-L43 HydrophobicContact CG1-CB 4.19Å; V39-L43 HydrophobicContact CG1-CD1 4.42Å; E40-L43 HydrophobicContact CB-CG 4.43Å; E40-L43 PolarHBondContact O-N 2.96Å; L43-N45 PolarHBondContact O-N 3.12Å; L43-N45 VanDerWaalsContact O-N 3.13Å; L43-L46 HydrophobicContact CD2-CD2 4.26Å; L43-L46 WeakPolarHBondContact O-CB 3.46Å; L43-L46 PolarHBondContact O-N 3.26Å; L43-L46 VanDerWaalsContact O-N 3.1Å; L43-F47 HydrophobicContact CB-CD2 4.41Å; L43-F47 HydrophobicContact CB-CE2 4.46Å; L43-F47 HydrophobicContact CD2-CE2 4.15Å; L43-F47 WeakPolarHBondContact O-CD2 3.36Å; L43-F47 PolarHBondContact O-N 3.34Å |
| 44 | P | 91.2 | Very high | 88.7 | Confident | 1 Ų | 1 | 78.8 Ų | 78.8 | 1% | 0.006 | 44% | 0.435 | C | S | . | . | H | α-helix | trans | -53.5 | -37.4 | 175.5 | -26.2 | 33.7 | 0 | 0 | 0 | 112.6 | A24 I27 N28 L31 V39 E40 A48 | A24-P44 HydrophobicContact CB-CB 4.22Å; I27-P44 HydrophobicContact CB-CB 4.17Å; I27-P44 WeakPolarHBondContact CD1-O 3.32Å; I27-P44 HydrophobicContact CG2-CB 3.9Å; I27-P44 HydrophobicContact CG2-CG 4.2Å; N28-P44 WeakPolarHBondContact OD1-CG 3.46Å; L31-P44 HydrophobicContact CD1-CG 4.28Å; V39-P44 HydrophobicContact CG1-CG 4.21Å; E40-P44 VanDerWaalsContact O-CD 3.24Å; E40-P44 WeakPolarHBondContact O-CD 3.44Å; P44-A48 VanDerWaalsContact O-CB 3.25Å; P44-A48 WeakPolarHBondContact O-CB 3.22Å; P44-A48 PolarHBondContact O-N 2.83Å |
| 45 | N | 93.1 | Very high | 88.4 | Confident | 98 Ų | 98 | 81.8 Ų | 81.8 | 52% | 0.524 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -74.6 | -39.6 | 179.8 | -130.7 | -7.5 | 0 | 0 | 0 | 112.4 | Y42 L43 T49 | Y42-N45 PolarHBondContact O-N 3.42Å; L43-N45 PolarHBondContact O-N 3.12Å; L43-N45 VanDerWaalsContact O-N 3.13Å; N45-T49 WeakPolarHBondContact O-CG2 3.25Å; N45-T49 PolarHBondContact O-N 3.22Å; N45-T49 PolarHBondContact O-OG1 3.45Å |
| 46 | L | 93.1 | Very high | 88.2 | Confident | 94 Ų | 94 | 76.8 Ų | 76.8 | 49% | 0.492 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -60.5 | -46.8 | 173.2 | -170.1 | 87.9 | 0 | 0 | 0 | 111.1 | Y42 L43 T49 A50 | Y42-L46 WeakPolarHBondContact O-CB 3.22Å; Y42-L46 PolarHBondContact O-N 3.45Å; L43-L46 HydrophobicContact CD2-CD2 4.26Å; L43-L46 WeakPolarHBondContact O-CB 3.46Å; L43-L46 PolarHBondContact O-N 3.26Å; L43-L46 VanDerWaalsContact O-N 3.1Å; L46-T49 PolarHBondContact O-N 3.01Å; L46-T49 PolarHBondContact O-OG1 3.03Å; L46-A50 WeakPolarHBondContact O-CB 3.47Å; L46-A50 PolarHBondContact O-N 2.84Å |
| 47 | F | 91 | Very high | 88.1 | Confident | 39 Ų | 39 | 81.1 Ų | 81.1 | 17% | 0.171 | 43% | 0.431 | C | S | . | . | H | α-helix | trans | -68.7 | -40.8 | 179.3 | -79.8 | -75 | 0 | 0 | 0 | 112.4 | C8 V9 I27 L43 T49 A50 L51 | C8-F47 HydrophobicContact CB-CD2 3.41Å; C8-F47 VanDerWaalsContact CB-CD2 3.41Å; C8-F47 HydrophobicContact CB-CE2 3.47Å; C8-F47 VanDerWaalsContact CB-CE2 3.47Å; C8-F47 HydrophobicContact CB-CG 4.28Å; C8-F47 HydrophobicContact CB-CZ 4.37Å; V9-F47 HydrophobicContact CG2-CE1 3.57Å; V9-F47 HydrophobicContact CG2-CE2 4.45Å; V9-F47 HydrophobicContact CG2-CZ 3.48Å; V9-F47 VanDerWaalsContact CG2-CZ 3.48Å; I27-F47 HydrophobicContact CD1-CB 3.95Å; L43-F47 HydrophobicContact CB-CD2 4.41Å; L43-F47 HydrophobicContact CB-CE2 4.46Å; L43-F47 HydrophobicContact CD2-CE2 4.15Å; L43-F47 WeakPolarHBondContact O-CD2 3.36Å; L43-F47 PolarHBondContact O-N 3.34Å; F47-T49 VanDerWaalsContact C-N 3.34Å; F47-T49 PolarHBondContact O-N 3.25Å; F47-A50 PolarHBondContact O-N 2.97Å; F47-L51 WeakPolarHBondContact O-CB 3.24Å; F47-L51 WeakPolarHBondContact O-CG 3.45Å; F47-L51 PolarHBondContact O-N 2.97Å |
| 48 | A | 92.4 | Very high | 88.4 | Confident | 12 Ų | 12 | 77.2 Ų | 77.2 | 10% | 0.099 | 42% | 0.419 | C | S | . | . | H | α-helix | trans | -58.7 | -45.7 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | A24 P44 N52 | A24-A48 HydrophobicContact CB-CB 4.29Å; P44-A48 VanDerWaalsContact O-CB 3.25Å; P44-A48 WeakPolarHBondContact O-CB 3.22Å; P44-A48 PolarHBondContact O-N 2.83Å; A48-N52 WeakPolarHBondContact O-CB 3.37Å; A48-N52 PolarHBondContact O-N 3.24Å; A48-N52 VanDerWaalsContact O-N 3.08Å |
| 49 | T | 92.1 | Very high | 88.5 | Confident | 97 Ų | 97 | 74 Ų | 74 | 60% | 0.595 | 41% | 0.407 | S | S | * | . | H | α-helix | trans | -70.8 | -38 | 177.8 | 50.8 | 0 | 0 | 0 | 0 | 112.7 | N45 L46 F47 L51 | N45-T49 WeakPolarHBondContact O-CG2 3.25Å; N45-T49 PolarHBondContact O-N 3.22Å; N45-T49 PolarHBondContact O-OG1 3.45Å; L46-T49 PolarHBondContact O-N 3.01Å; L46-T49 PolarHBondContact O-OG1 3.03Å; F47-T49 VanDerWaalsContact C-N 3.34Å; F47-T49 PolarHBondContact O-N 3.25Å; T49-L51 VanDerWaalsContact C-N 3.34Å; T49-L51 PolarHBondContact O-N 3.04Å |
| 50 | A | 90.9 | Very high | 88.6 | Confident | 44 Ų | 44 | 78 Ų | 78 | 36% | 0.364 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -68.8 | -31.6 | -179.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | L46 F47 K54 | L46-A50 WeakPolarHBondContact O-CB 3.47Å; L46-A50 PolarHBondContact O-N 2.84Å; F47-A50 PolarHBondContact O-N 2.97Å; A50-K54 VanDerWaalsContact O-CD 3.25Å; A50-K54 WeakPolarHBondContact O-CD 3.12Å; A50-K54 WeakPolarHBondContact O-CE 3.25Å; A50-K54 PolarHBondContact O-NZ 3.27Å |
| 51 | L | 89 | Confident | 88.5 | Confident | 32 Ų | 32 | 80.1 Ų | 80.1 | 17% | 0.168 | 44% | 0.438 | C | S | . | . | H | α-helix | trans | -99.8 | -5.5 | -178 | -63.5 | 172.1 | 0 | 0 | 0 | 113.2 | A12 V22 F47 T49 G53 K54 V56 L59 | A12-L51 HydrophobicContact CB-CD1 3.62Å; V22-L51 HydrophobicContact CB-CB 4.47Å; V22-L51 HydrophobicContact CG1-CB 4.41Å; V22-L51 HydrophobicContact CG1-CD1 3.99Å; F47-L51 WeakPolarHBondContact O-CB 3.24Å; F47-L51 WeakPolarHBondContact O-CG 3.45Å; F47-L51 PolarHBondContact O-N 2.97Å; T49-L51 VanDerWaalsContact C-N 3.34Å; T49-L51 PolarHBondContact O-N 3.04Å; L51-G53 PolarHBondContact O-N 3.29Å; L51-K54 PolarHBondContact O-N 3.23Å; L51-V56 HydrophobicContact CD2-CG2 4.34Å; L51-L59 HydrophobicContact CD2-CD1 4.2Å |
| 52 | N | 87.6 | Confident | 88.1 | Confident | 133 Ų | 133 | 78.2 Ų | 78.2 | 71% | 0.711 | 43% | 0.425 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.2 | 127.3 | 177.1 | -164.5 | 1.4 | 0 | 0 | 0 | 111 | A48 K54 | A48-N52 WeakPolarHBondContact O-CB 3.37Å; A48-N52 PolarHBondContact O-N 3.24Å; A48-N52 VanDerWaalsContact O-N 3.08Å; N52-K54 PolarHBondContact O-N 3.07Å |
| 53 | G | 83.9 | Confident | 87.2 | Confident | 83 Ų | 83 | 79.1 Ų | 79.1 | 86% | 0.856 | 44% | 0.436 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 68.7 | 8.1 | -178.7 | 0 | 0 | 0 | 0 | 0 | 115.2 | L51 | L51-G53 PolarHBondContact O-N 3.29Š|
| 54 | K | 85.6 | Confident | 85.9 | Confident | 113 Ų | 113 | 82.3 Ų | 82.3 | 49% | 0.491 | 47% | 0.469 | S | S | . | . | trans | -105.5 | 134.9 | 176.8 | -59.5 | -173.4 | -171.8 | 161.4 | 0 | 110.9 | A50 L51 N52 V56 L59 | A50-K54 VanDerWaalsContact O-CD 3.25Å; A50-K54 WeakPolarHBondContact O-CD 3.12Å; A50-K54 WeakPolarHBondContact O-CE 3.25Å; A50-K54 PolarHBondContact O-NZ 3.27Å; L51-K54 PolarHBondContact O-N 3.23Å; N52-K54 PolarHBondContact O-N 3.07Å; K54-V56 PolarHBondContact O-N 3.08Å; K54-L59 HydrophobicContact CB-CD1 3.79Å; K54-L59 HydrophobicContact CD-CD1 3.91Å; K54-L59 HydrophobicContact CG-CD1 4.47Å | ||
| 55 | N | 85.8 | Confident | 84.2 | Confident | 120 Ų | 120 | 86.2 Ų | 86.2 | 64% | 0.642 | 50% | 0.496 | S | S | * | . | trans | -76.8 | 109.3 | 169 | -88.1 | -48.3 | 0 | 0 | 0 | 109.8 | R57 D58 L59 | N55-R57 VanDerWaalsContact C-N 3.26Å; N55-R57 PolarHBondContact O-N 3.34Å; N55-D58 HydrophobicContact CB-CB 4.04Å; N55-D58 PolarHBondContact O-N 3.1Å; N55-L59 PolarHBondContact O-N 2.95Å | ||
| 56 | V | 85.7 | Confident | 82.3 | Confident | 24 Ų | 24 | 86 Ų | 86 | 15% | 0.145 | 51% | 0.508 | C | S | . | . | H | α-helix | trans | -64.5 | -32.8 | -177 | -164.5 | 0 | 0 | 0 | 0 | 111.4 | L13 A16 L51 K54 L59 L60 | L13-V56 HydrophobicContact CD2-CG1 3.71Å; A16-V56 HydrophobicContact CB-CB 3.66Å; A16-V56 HydrophobicContact CB-CG1 4.14Å; A16-V56 HydrophobicContact CB-CG2 3.49Å; A16-V56 VanDerWaalsContact CB-CG2 3.49Å; L51-V56 HydrophobicContact CD2-CG2 4.34Å; K54-V56 PolarHBondContact O-N 3.08Å; V56-L59 PolarHBondContact O-N 3Å; V56-L60 WeakPolarHBondContact O-CB 3.16Å; V56-L60 PolarHBondContact O-N 2.97Å |
| 57 | R | 84.1 | Confident | 80.3 | Confident | 140 Ų | 140 | 84.5 Ų | 84.5 | 53% | 0.528 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -62.6 | -47.9 | 172.4 | -86.1 | -156.2 | -179.9 | 101.2 | 11.9 | 113.3 | D17 N55 L59 L60 M61 | D17-R57 IonicContact OD1-NH2 3.54Å; N55-R57 VanDerWaalsContact C-N 3.26Å; N55-R57 PolarHBondContact O-N 3.34Å; R57-L59 VanDerWaalsContact C-N 3.32Å; R57-L59 PolarHBondContact O-N 3.45Å; R57-L60 PolarHBondContact O-N 2.89Å; R57-M61 WeakPolarHBondContact O-CG 2.93Å; R57-M61 PolarHBondContact O-N 3.01Å |
| 58 | D | 86.3 | Confident | 78.2 | Confident | 106 Ų | 106 | 88.1 Ų | 88.1 | 57% | 0.567 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -65.1 | -37.9 | 177.8 | -88.9 | -16 | 0 | 0 | 0 | 111.5 | N55 L60 M61 S62 | N55-D58 HydrophobicContact CB-CB 4.04Å; N55-D58 PolarHBondContact O-N 3.1Å; D58-L60 VanDerWaalsContact C-N 3.31Å; D58-L60 PolarHBondContact O-N 3.13Å; D58-M61 PolarHBondContact O-N 2.65Å; D58-S62 VanDerWaalsContact O-CB 3.27Å; D58-S62 WeakPolarHBondContact O-CB 3.39Å; D58-S62 PolarHBondContact O-N 2.79Å; D58-S62 PolarHBondContact O-OG 2.78Å |
| 59 | L | 86 | Confident | 76.1 | Confident | 56 Ų | 56 | 93.7 Ų | 93.7 | 29% | 0.293 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -59 | -44.5 | 172.5 | -76.9 | 172.3 | 0 | 0 | 0 | 111.1 | L51 K54 N55 V56 R57 S62 M63 | L51-L59 HydrophobicContact CD2-CD1 4.2Å; K54-L59 HydrophobicContact CB-CD1 3.79Å; K54-L59 HydrophobicContact CD-CD1 3.91Å; K54-L59 HydrophobicContact CG-CD1 4.47Å; N55-L59 PolarHBondContact O-N 2.95Å; V56-L59 PolarHBondContact O-N 3Å; R57-L59 VanDerWaalsContact C-N 3.32Å; R57-L59 PolarHBondContact O-N 3.45Å; L59-S62 PolarHBondContact O-OG 2.65Å; L59-M63 HydrophobicContact CB-CE 4.48Å; L59-M63 WeakPolarHBondContact O-CG 3.41Å; L59-M63 PolarHBondContact O-N 3.47Å |
| 60 | L | 84.4 | Confident | 73.9 | Confident | 113 Ų | 113 | 92.9 Ų | 92.9 | 59% | 0.592 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -68.1 | -40.1 | 179.5 | -162.9 | 68.1 | 0 | 0 | 0 | 112.2 | V56 R57 D58 | V56-L60 WeakPolarHBondContact O-CB 3.16Å; V56-L60 PolarHBondContact O-N 2.97Å; R57-L60 PolarHBondContact O-N 2.89Å; D58-L60 VanDerWaalsContact C-N 3.31Å; D58-L60 PolarHBondContact O-N 3.13Å |
| 61 | M | 85.3 | Confident | 71.4 | Confident | 139 Ų | 139 | 97 Ų | 97 | 69% | 0.685 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -70.6 | -35.7 | 177.9 | -68.2 | -150.8 | 173.4 | 0 | 0 | 112.8 | R57 D58 G64 S65 | R57-M61 WeakPolarHBondContact O-CG 2.93Å; R57-M61 PolarHBondContact O-N 3.01Å; D58-M61 PolarHBondContact O-N 2.65Å; M61-G64 PolarHBondContact O-N 2.86Å; M61-S65 PolarHBondContact O-N 3Å |
| 62 | S | 79.7 | Confident | 69.1 | Low | 71 Ų | 71 | 100.2 Ų | 100.2 | 50% | 0.497 | 63% | 0.63 | S | S | . | * | H | α-helix | trans | -69.5 | -30.5 | 177.4 | 63.5 | 0 | 0 | 0 | 0 | 113.1 | D58 L59 G64 S65 | D58-S62 VanDerWaalsContact O-CB 3.27Å; D58-S62 WeakPolarHBondContact O-CB 3.39Å; D58-S62 PolarHBondContact O-N 2.79Å; D58-S62 PolarHBondContact O-OG 2.78Å; L59-S62 PolarHBondContact O-OG 2.65Å; S62-G64 PolarHBondContact O-N 2.88Å; S62-S65 PolarHBondContact O-N 3.45Å; S62-S65 VanDerWaalsContact O-N 3.12Å |
| 63 | M | 72.5 | Confident | 66.8 | Low | 144 Ų | 144 | 97.3 Ų | 97.3 | 71% | 0.709 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -62.6 | -30.8 | 172.7 | -72.7 | -177.2 | -141 | 0 | 0 | 112.6 | L59 | L59-M63 HydrophobicContact CB-CE 4.48Å; L59-M63 WeakPolarHBondContact O-CG 3.41Å; L59-M63 PolarHBondContact O-N 3.47Å |
| 64 | G | 63.8 | Low | 65.1 | Low | 70 Ų | 70 | 98.4 Ų | 98.4 | 72% | 0.722 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -82.3 | -18.8 | 174.7 | 0 | 0 | 0 | 0 | 0 | 114 | M61 S62 A66 | M61-G64 PolarHBondContact O-N 2.86Å; S62-G64 PolarHBondContact O-N 2.88Å; G64-A66 PolarHBondContact O-N 2.96Å |
| 65 | S | 55.8 | Low | 62.8 | Low | 82 Ų | 82 | 99.7 Ų | 99.7 | 57% | 0.573 | 63% | 0.634 | S | S | * | * | trans | -97.2 | 29.9 | -174.8 | -164.2 | 0 | 0 | 0 | 0 | 113.9 | M61 S62 A67 | M61-S65 PolarHBondContact O-N 3Å; S62-S65 PolarHBondContact O-N 3.45Å; S62-S65 VanDerWaalsContact O-N 3.12Å; S65-A67 PolarHBondContact O-N 2.85Å | ||
| 66 | A | 52.7 | Low | 60.5 | Low | 93 Ų | 93 | 98.6 Ų | 98.6 | 77% | 0.769 | 64% | 0.635 | S | S | * | * | trans | -67.7 | 44.8 | 153.7 | 0 | 0 | 0 | 0 | 0 | 111 | G64 | G64-A66 PolarHBondContact O-N 2.96Š| ||
| 67 | A | 52 | Low | 58.1 | Low | 63 Ų | 63 | 102.1 Ų | 102.1 | 52% | 0.521 | 67% | 0.667 | S | S | . | * | trans | -69.5 | 132.5 | 152.9 | 0 | 0 | 0 | 0 | 0 | 105.7 | S65 S69 | S65-A67 PolarHBondContact O-N 2.85Å; A67-S69 PolarHBondContact O-N 3.39Å | ||
| 68 | P | 47.4 | Very low | 56.2 | Low | 116 Ų | 116 | 101.1 Ų | 101.1 | 75% | 0.753 | 68% | 0.679 | S | S | * | * | trans | -54.4 | 125.2 | 169.5 | 25 | -30.5 | 0 | 0 | 0 | 105.7 | A70 | P68-A70 PolarHBondContact O-N 3.28Š| ||
| 69 | S | 48 | Very low | 53.6 | Low | 128 Ų | 128 | 102.7 Ų | 102.7 | 90% | 0.895 | 69% | 0.692 | S | S | * | * | trans | -59.7 | 84.6 | 158.9 | -85 | 0 | 0 | 0 | 0 | 106.1 | A67 V71 | A67-S69 PolarHBondContact O-N 3.39Å; S69-V71 PolarHBondContact O-N 3.45Å | ||
| 70 | A | 44.9 | Very low | 51.4 | Low | 80 Ų | 80 | 104.9 Ų | 104.9 | 66% | 0.661 | 72% | 0.718 | S | S | * | * | trans | -62.8 | 97.3 | 164.2 | 0 | 0 | 0 | 0 | 0 | 104.8 | P68 A72 | P68-A70 PolarHBondContact O-N 3.28Å; A70-A72 PolarHBondContact O-N 3.07Å | ||
| 71 | V | 39.3 | Very low | 48.9 | Very low | 132 Ų | 132 | 104.2 Ų | 104.2 | 80% | 0.8 | 73% | 0.729 | S | S | * | * | trans | 26.2 | 81.2 | 138.6 | -171.4 | 0 | 0 | 0 | 0 | 112.7 | S69 A73 | S69-V71 PolarHBondContact O-N 3.45Å; V71-A73 VanDerWaalsContact C-N 3.31Å; V71-A73 HydrophobicContact CG1-CB 4.22Å; V71-A73 PolarHBondContact O-N 2.92Å | ||
| 72 | A | 41.1 | Very low | 46.6 | Very low | 98 Ų | 98 | 102 Ų | 102 | 81% | 0.81 | 73% | 0.732 | S | S | * | * | trans | -93.1 | 78.4 | 154.7 | 0 | 0 | 0 | 0 | 0 | 107.1 | A70 P74 | A70-A72 PolarHBondContact O-N 3.07Å; A72-P74 WeakPolarHBondContact O-CD 3.16Å | ||
| 73 | A | 39.3 | Very low | 44.4 | Very low | 73 Ų | 73 | 103.8 Ų | 103.8 | 60% | 0.603 | 75% | 0.752 | S | S | * | * | trans | -84.1 | 108.6 | 155.5 | 0 | 0 | 0 | 0 | 0 | 107.4 | V71 T75 | V71-A73 VanDerWaalsContact C-N 3.31Å; V71-A73 HydrophobicContact CG1-CB 4.22Å; V71-A73 PolarHBondContact O-N 2.92Å; A73-T75 PolarHBondContact O-N 3.03Å | ||
| 74 | P | 46.8 | Very low | 42.5 | Very low | 106 Ų | 106 | 100.8 Ų | 100.8 | 69% | 0.688 | 76% | 0.758 | S | S | * | * | trans | -83.6 | 100.4 | 153.6 | 30.7 | -27 | 0 | 0 | 0 | 107.3 | A72 S76 | A72-P74 WeakPolarHBondContact O-CD 3.16Å; P74-S76 VanDerWaalsContact C-N 3.33Å; P74-S76 PolarHBondContact O-N 2.99Å | ||
| 75 | T | 37.1 | Very low | 41 | Very low | 139 Ų | 139 | 101.7 Ų | 101.7 | 85% | 0.853 | 77% | 0.767 | S | S | * | * | trans | -52.2 | 99.3 | 151.2 | 49 | 0 | 0 | 0 | 0 | 108.6 | A73 | A73-T75 PolarHBondContact O-N 3.03Š| ||
| 76 | S | 37.3 | Very low | 39.9 | Very low | 97 Ų | 97 | 101.5 Ų | 101.5 | 68% | 0.678 | 78% | 0.778 | S | S | * | * | trans | -151.7 | 80.6 | 162.2 | 63.2 | 0 | 0 | 0 | 0 | 110.3 | P74 | P74-S76 VanDerWaalsContact C-N 3.33Å; P74-S76 PolarHBondContact O-N 2.99Å | ||
| 77 | A | 37.3 | Very low | 38.9 | Very low | 99 Ų | 99 | 102 Ų | 102 | 82% | 0.818 | 78% | 0.782 | S | S | * | * | trans | -77.3 | 136.5 | 142.4 | 0 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 78 | P | 42.3 | Very low | 38.2 | Very low | 118 Ų | 118 | 108.3 Ų | 108.3 | 77% | 0.766 | 80% | 0.801 | S | S | * | * | -131.4 | 130.8 | 113.3 | 32.1 | -20.4 | 0 | 0 | 0 | 112.6 | |||||
| 79 | V | 33.2 | Very low | 37.5 | Very low | 139 Ų | 139 | 113 Ų | 113 | 84% | 0.842 | 81% | 0.81 | S | S | * | * | trans | 9.5 | 114.6 | 144 | -171.8 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 80 | A | 39.7 | Very low | 37 | Very low | 103 Ų | 103 | 110.8 Ų | 110.8 | 85% | 0.851 | 81% | 0.807 | S | S | * | * | trans | -134.7 | 113.2 | 146.3 | 0 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 81 | A | 32.3 | Very low | 36.5 | Very low | 98 Ų | 98 | 116.4 Ų | 116.4 | 81% | 0.81 | 82% | 0.816 | S | S | * | * | trans | -79.2 | 128.4 | 172.8 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 82 | A | 36.9 | Very low | 36.4 | Very low | 92 Ų | 92 | 118.3 Ų | 118.3 | 76% | 0.76 | 82% | 0.816 | S | S | * | * | trans | -172 | 98.5 | 151 | 0 | 0 | 0 | 0 | 0 | 106.6 | ||||
| 83 | A | 32.3 | Very low | 36.5 | Very low | 109 Ų | 109 | 119.9 Ų | 119.9 | 90% | 0.901 | 82% | 0.819 | S | S | * | * | 65.5 | 107 | 94.4 | 0 | 0 | 0 | 0 | 0 | 113.4 | |||||
| 84 | G | 32.5 | Very low | 36.5 | Very low | 82 Ų | 82 | 121 Ų | 121 | 85% | 0.845 | 83% | 0.827 | S | S | * | * | trans | 129.9 | 96.5 | 150.6 | 0 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 85 | G | 32.5 | Very low | 36.2 | Very low | 89 Ų | 89 | 124.4 Ų | 124.4 | 92% | 0.918 | 83% | 0.832 | S | S | * | * | trans | 93.3 | 130.6 | 134.8 | 0 | 0 | 0 | 0 | 0 | 118 | ||||
| 86 | G | 33 | Very low | 36.1 | Very low | 78 Ų | 78 | 124.9 Ų | 124.9 | 80% | 0.804 | 82% | 0.824 | S | S | * | * | trans | 116 | 73.8 | 156.5 | 0 | 0 | 0 | 0 | 0 | 114.8 | E88 | G86-E88 PolarHBondContact O-N 3.44Š| ||
| 87 | A | 31.4 | Very low | 36 | Very low | 103 Ų | 103 | 129.9 Ų | 129.9 | 85% | 0.851 | 84% | 0.837 | S | S | * | * | trans | -64.4 | 121.7 | 155.2 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 88 | E | 37.5 | Very low | 36 | Very low | 195 Ų | 195 | 134 Ų | 134 | 91% | 0.911 | 84% | 0.836 | S | S | * | * | -157.6 | 131.9 | 129.3 | -115.7 | -169.2 | 131 | 0 | 0 | 111.4 | G86 | G86-E88 PolarHBondContact O-N 3.44Š| |||
| 89 | K | 33 | Very low | 35.9 | Very low | 215 Ų | 215 | 136.9 Ų | 136.9 | 94% | 0.935 | 84% | 0.837 | S | S | * | * | trans | -102.3 | 93.2 | -168.2 | -172.6 | -175.6 | -173.2 | -176.7 | 0 | 105.6 | ||||
| 90 | G | 37 | Very low | 36.4 | Very low | 81 Ų | 81 | 136.6 Ų | 136.6 | 84% | 0.835 | 84% | 0.838 | S | S | * | * | trans | -125.7 | 82.1 | 174 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 91 | K | 35.1 | Very low | 36 | Very low | 199 Ų | 199 | 137.4 Ų | 137.4 | 87% | 0.865 | 83% | 0.832 | S | S | * | * | trans | -84.5 | 149.3 | 171.6 | -106.2 | -177.3 | 173.8 | -174.4 | 0 | 109.3 | ||||
| 92 | E | 35.8 | Very low | 36.3 | Very low | 171 Ų | 171 | 138.2 Ų | 138.2 | 80% | 0.799 | 83% | 0.832 | S | S | * | * | trans | 97.1 | 112.3 | 157.7 | -133.4 | 164.6 | 143.2 | 0 | 0 | 115.8 | ||||
| 93 | P | 44.3 | Very low | 36.5 | Very low | 132 Ų | 132 | 141.5 Ų | 141.5 | 86% | 0.857 | 84% | 0.836 | S | S | * | * | -134.4 | 116.2 | 92.9 | 33.8 | -20.1 | 0 | 0 | 0 | 112.3 | |||||
| 94 | A | 39.4 | Very low | 36.7 | Very low | 95 Ų | 95 | 142 Ų | 142 | 79% | 0.785 | 82% | 0.824 | S | S | * | * | trans | -102.7 | 92.4 | 165.5 | 0 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 95 | K | 39.6 | Very low | 36.9 | Very low | 179 Ų | 179 | 148.1 Ų | 148.1 | 78% | 0.778 | 83% | 0.83 | S | S | * | * | trans | -83.4 | 141 | 167.1 | -158.9 | -174.2 | 177.8 | -173.8 | 0 | 107.6 | ||||
| 96 | E | 35.7 | Very low | 37.7 | Very low | 148 Ų | 148 | 147.6 Ų | 147.6 | 69% | 0.692 | 81% | 0.813 | S | S | * | * | trans | 80.2 | 104 | 147.6 | -131.4 | 157.2 | -177.8 | 0 | 0 | 118.4 | ||||
| 97 | E | 36 | Very low | 38.7 | Very low | 202 Ų | 202 | 150.4 Ų | 150.4 | 94% | 0.944 | 81% | 0.809 | S | S | * | * | trans | -138.2 | 100.4 | 142.3 | -121.5 | -179.5 | 159.3 | 0 | 0 | 109.6 | ||||
| 98 | K | 37.2 | Very low | 40 | Very low | 186 Ų | 186 | 152.9 Ų | 152.9 | 81% | 0.809 | 81% | 0.808 | S | S | * | * | trans | -101.2 | 121.1 | 165.4 | -108.8 | 178.5 | 179.7 | 170.1 | 0 | 106.8 | ||||
| 99 | K | 39.3 | Very low | 41 | Very low | 179 Ų | 179 | 149.3 Ų | 149.3 | 78% | 0.778 | 81% | 0.805 | S | S | * | * | trans | 64 | 137.6 | 160.6 | -69.5 | -179.4 | 173 | -178.5 | 0 | 117.3 | V101 | K99-V101 HydrophobicContact CD-CG2 4.3Š| ||
| 100 | P | 43.5 | Very low | 42.6 | Very low | 133 Ų | 133 | 147.9 Ų | 147.9 | 86% | 0.864 | 80% | 0.804 | S | S | * | * | -121.7 | 125.6 | 111.2 | 33 | -29.1 | 0 | 0 | 0 | 112.1 | |||||
| 101 | V | 32.6 | Very low | 44 | Very low | 120 Ų | 120 | 147.3 Ų | 147.3 | 73% | 0.727 | 80% | 0.798 | S | S | * | * | trans | -75.5 | 124.2 | 149.5 | 169.2 | 0 | 0 | 0 | 0 | 105.5 | K99 | K99-V101 HydrophobicContact CD-CG2 4.3Š| ||
| 102 | S | 37.9 | Very low | 45.5 | Very low | 115 Ų | 115 | 147.5 Ų | 147.5 | 80% | 0.804 | 80% | 0.799 | S | S | * | * | trans | 160.7 | 95.5 | 138.5 | -171.1 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 103 | D | 40.4 | Very low | 47 | Very low | 160 Ų | 160 | 146.5 Ų | 146.5 | 86% | 0.856 | 80% | 0.799 | S | S | * | * | trans | -142.5 | 154.2 | 144 | -142.2 | -28.2 | 0 | 0 | 0 | 106.5 | ||||
| 104 | D | 37.4 | Very low | 48.4 | Very low | 121 Ų | 121 | 147.2 Ų | 147.2 | 65% | 0.647 | 80% | 0.795 | S | S | * | * | trans | 87.8 | 68.7 | -178.4 | -112.5 | -98.7 | 0 | 0 | 0 | 117.7 | S106 | D104-S106 PolarHBondContact O-N 3.06Å; D104-S106 WeakPolarHBondContact OD1-CB 3.36Å; D104-S106 PolarHBondContact OD1-OG 3Å | ||
| 105 | E | 37 | Very low | 49.9 | Very low | 209 Ų | 209 | 152.4 Ų | 152.4 | 98% | 0.977 | 80% | 0.8 | S | S | * | * | trans | -68.4 | 77 | 144.3 | -150.1 | -171.2 | 164.5 | 0 | 0 | 108.3 | D107 | E105-D107 PolarHBondContact O-N 3.44Š| ||
| 106 | S | 49.2 | Very low | 50.6 | Low | 78 Ų | 78 | 150.4 Ų | 150.4 | 55% | 0.545 | 83% | 0.83 | S | S | . | * | trans | -79.1 | 107.6 | 170.8 | -100.5 | 0 | 0 | 0 | 0 | 110.6 | D104 D108 | D104-S106 PolarHBondContact O-N 3.06Å; D104-S106 WeakPolarHBondContact OD1-CB 3.36Å; D104-S106 PolarHBondContact OD1-OG 3Å; S106-D108 PolarHBondContact O-N 2.52Å | ||
| 107 | D | 53.6 | Low | 51.4 | Low | 137 Ų | 137 | 150.5 Ų | 150.5 | 73% | 0.733 | 84% | 0.837 | S | S | * | * | S | Bend | 49.1 | 38.6 | 116.4 | -148.9 | 14.3 | 0 | 0 | 0 | 119.6 | E105 | E105-D107 PolarHBondContact O-N 3.44Š| |
| 108 | D | 58.8 | Low | 52.2 | Low | 155 Ų | 155 | 147.8 Ų | 147.8 | 83% | 0.829 | 83% | 0.831 | S | S | * | * | trans | -123.6 | 20.9 | 177.9 | -120.3 | -26.1 | 0 | 0 | 0 | 114.5 | S106 | S106-D108 PolarHBondContact O-N 2.52Š| ||
| 109 | S | 58.8 | Low | 53 | Low | 121 Ų | 121 | 145.7 Ų | 145.7 | 85% | 0.846 | 83% | 0.833 | S | S | * | * | S | Bend | trans | -136.3 | 12.9 | 175.3 | -73.4 | 0 | 0 | 0 | 0 | 115.3 | ||
| 110 | M | 65.7 | Low | 53.8 | Low | 185 Ų | 185 | 143.7 Ų | 143.7 | 91% | 0.911 | 84% | 0.836 | S | S | * | * | S | Bend | trans | -101.5 | 24.1 | 167.9 | -66.1 | -174.9 | -171.7 | 0 | 0 | 112.7 | ||
| 111 | G | 67 | Low | 54.5 | Low | 69 Ų | 69 | 144.4 Ų | 144.4 | 71% | 0.711 | 83% | 0.834 | S | S | * | * | S | Bend | trans | -137.9 | -3.2 | -164.9 | 0 | 0 | 0 | 0 | 0 | 120.4 | ||
| 112 | F | 66.6 | Low | 55.9 | Low | 203 Ų | 203 | 146 Ų | 146 | 89% | 0.89 | 84% | 0.841 | S | S | * | * | S | Bend | trans | -122.1 | 13.7 | -173.1 | -151 | -99.6 | 0 | 0 | 0 | 117.2 | ||
| 113 | D | 66.1 | Low | 57.2 | Low | 149 Ų | 149 | 148.2 Ų | 148.2 | 80% | 0.797 | 84% | 0.844 | S | S | * | * | S | Bend | trans | -142.8 | 36.6 | 176 | -122.4 | -41.4 | 0 | 0 | 0 | 114.3 | ||
| 114 | L | 74.2 | Confident | 58.5 | Low | 148 Ų | 148 | 147.3 Ų | 147.3 | 78% | 0.775 | 84% | 0.843 | S | S | * | * | S | Bend | trans | -108 | -4.8 | 172.5 | -165.3 | 57 | 0 | 0 | 0 | 113.5 | ||
| 115 | F | 71.3 | Confident | 60.3 | Low | 204 Ų | 204 | 149.5 Ų | 149.5 | 90% | 0.895 | 86% | 0.859 | S | S | * | * | trans | -152.4 | 74.8 | 178.3 | -65.7 | -81 | 0 | 0 | 0 | 112 | ||||
| 116 | G | 54.7 | Low | 62.4 | Low | 136 Ų | 136 | 144.1 Ų | 144.1 | 100% | 1.402 | 85% | 0.849 | S | S | * | * | trans | 178.3 | 0 | 173.1 | 0 | 0 | 0 | 0 | 0 | 116.3 |
Retrieved 116 of 116 residues in 31 ms
(Link to these results)