| 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 | 75.3 | Confident | 91.2 | Very high | 128 Ų | 128 | 43.4 Ų | 43.4 | 63% | 0.631 | 25% | 0.251 | S | S | * | . | 0 | -46.3 | 0 | -176.9 | 160 | 146.6 | 0 | 0 | 111.3 | V3 G4 I5 E58 Y59 | M1-V3 PolarHBondContact O-N 2.95Å; M1-G4 PolarHBondContact O-N 3.37Å; M1-G4 VanDerWaalsContact O-N 3.09Å; M1-I5 HydrophobicContact CE-CD1 3.99Å; M1-I5 HydrophobicContact CG-CD1 3.76Å; M1-I5 PolarHBondContact O-N 3.08Å; M1-E58 WeakPolarHBondContact CE-OE2 3.36Å; M1-Y59 HydrophobicContact CE-CE2 4.21Å | |||
| 2 | D | 88.1 | Confident | 91.4 | Very high | 69 Ų | 69 | 43 Ų | 43 | 37% | 0.369 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -56.2 | -48.7 | -174.2 | -58.5 | -21.6 | 0 | 0 | 0 | 115.3 | G4 I5 G6 R191 Y198 | D2-G4 VanDerWaalsContact C-N 3.26Å; D2-G4 PolarHBondContact O-N 2.95Å; D2-I5 PolarHBondContact O-N 3.33Å; D2-G6 PolarHBondContact O-N 3.05Å; D2-R191 HydrophobicContact CB-CB 4.01Å; D2-R191 HydrophobicContact CB-CG 4.23Å; D2-R191 WeakPolarHBondContact OD1-CD 3.24Å; D2-R191 IonicContact OD1-NE 3.09Å; D2-R191 PolarHBondContact OD1-NE 3.4Å; D2-Y198 HydrophobicContact CB-CE2 4.37Å; D2-Y198 PolarHBondContact O-OH 3.3Å |
| 3 | V | 92.3 | Very high | 91.8 | Very high | 47 Ų | 47 | 39.7 Ų | 39.7 | 29% | 0.285 | 23% | 0.229 | S | C | . | . | H | α-helix | trans | -56.8 | -42.2 | 176.8 | 177.9 | 0 | 0 | 0 | 0 | 111.6 | M1 I5 G6 M7 W201 L205 | M1-V3 PolarHBondContact O-N 2.95Å; V3-I5 PolarHBondContact O-N 3.49Å; V3-G6 PolarHBondContact O-N 3.33Å; V3-M7 HydrophobicContact CG1-CE 3.55Å; V3-M7 HydrophobicContact CG1-CG 4.17Å; V3-M7 HydrophobicContact CG1-SD 3.72Å; V3-M7 WeakPolarHBondContact O-CB 3.27Å; V3-M7 WeakPolarHBondContact O-CG 3.26Å; V3-M7 PolarHBondContact O-N 3.25Å; V3-W201 HydrophobicContact CG2-CH2 3.6Å; V3-W201 HydrophobicContact CG2-CZ2 4.38Å; V3-W201 HydrophobicContact CG2-CZ3 3.89Å; V3-L205 HydrophobicContact CG1-CD1 4Å; V3-L205 HydrophobicContact CG2-CD1 4.24Å |
| 4 | G | 89.4 | Confident | 92 | Very high | 36 Ų | 36 | 38.8 Ų | 38.8 | 37% | 0.371 | 22% | 0.222 | S | C | . | . | H | α-helix | trans | -63 | -41.3 | -179.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | M1 D2 M7 I8 | M1-G4 PolarHBondContact O-N 3.37Å; M1-G4 VanDerWaalsContact O-N 3.09Å; D2-G4 VanDerWaalsContact C-N 3.26Å; D2-G4 PolarHBondContact O-N 2.95Å; G4-M7 PolarHBondContact O-N 3.26Å; G4-I8 WeakPolarHBondContact O-CD1 3.46Å; G4-I8 WeakPolarHBondContact O-CG1 3.44Å; G4-I8 PolarHBondContact O-N 3.29Å |
| 5 | I | 89.8 | Confident | 92.1 | Very high | 13 Ų | 13 | 40.7 Ų | 40.7 | 7% | 0.067 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -61.7 | -49.6 | 176.2 | -72.8 | 153.1 | 0 | 0 | 0 | 110.4 | M1 D2 V3 M7 I8 V9 Y59 F65 | M1-I5 HydrophobicContact CE-CD1 3.99Å; M1-I5 HydrophobicContact CG-CD1 3.76Å; M1-I5 PolarHBondContact O-N 3.08Å; D2-I5 PolarHBondContact O-N 3.33Å; V3-I5 PolarHBondContact O-N 3.49Å; I5-M7 PolarHBondContact O-N 2.73Å; I5-I8 PolarHBondContact O-N 2.95Å; I5-V9 WeakPolarHBondContact O-CG2 3.28Å; I5-V9 PolarHBondContact O-N 2.97Å; I5-Y59 WeakPolarHBondContact CD1-OH 3.47Å; I5-F65 HydrophobicContact CB-CD2 4.4Å; I5-F65 HydrophobicContact CB-CE2 4.29Å; I5-F65 HydrophobicContact CG1-CD2 4.05Å; I5-F65 HydrophobicContact CG1-CE2 4.29Å; I5-F65 HydrophobicContact CG2-CD2 3.73Å; I5-F65 HydrophobicContact CG2-CE2 3.66Å |
| 6 | G | 94.4 | Very high | 92.2 | Very high | 0 Ų | 0 | 38.5 Ų | 38.5 | 0% | 0 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -59.1 | -45.5 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | D2 V3 I8 V9 F10 Y198 | D2-G6 PolarHBondContact O-N 3.05Å; V3-G6 PolarHBondContact O-N 3.33Å; G6-I8 PolarHBondContact O-N 3.14Å; G6-V9 PolarHBondContact O-N 3.09Å; G6-F10 WeakPolarHBondContact O-CB 3.38Å; G6-F10 PolarHBondContact O-N 3.27Å; G6-Y198 WeakPolarHBondContact CA-OH 3.49Å; G6-Y198 PolarHBondContact N-OH 3.02Å |
| 7 | M | 94.4 | Very high | 92.2 | Very high | 64 Ų | 64 | 38 Ų | 38 | 32% | 0.315 | 22% | 0.219 | S | C | . | . | H | α-helix | trans | -66.2 | -35.4 | 177.9 | -73.4 | -178.6 | 171.3 | 0 | 0 | 112.9 | V3 G4 I5 F10 S11 L205 | V3-M7 HydrophobicContact CG1-CE 3.55Å; V3-M7 HydrophobicContact CG1-CG 4.17Å; V3-M7 HydrophobicContact CG1-SD 3.72Å; V3-M7 WeakPolarHBondContact O-CB 3.27Å; V3-M7 WeakPolarHBondContact O-CG 3.26Å; V3-M7 PolarHBondContact O-N 3.25Å; G4-M7 PolarHBondContact O-N 3.26Å; I5-M7 PolarHBondContact O-N 2.73Å; M7-F10 PolarHBondContact O-N 2.97Å; M7-S11 VanDerWaalsContact O-CB 3.26Å; M7-S11 WeakPolarHBondContact O-CB 3.35Å; M7-S11 PolarHBondContact O-N 3.39Å; M7-L205 HydrophobicContact CE-CB 3.75Å |
| 8 | I | 92.7 | Very high | 92.2 | Very high | 54 Ų | 54 | 36 Ų | 36 | 28% | 0.277 | 21% | 0.208 | S | C | . | . | H | α-helix | trans | -64.3 | -42.9 | 173.1 | -69.1 | 163.1 | 0 | 0 | 0 | 110.3 | G4 I5 G6 S11 N12 F65 L69 F258 | G4-I8 WeakPolarHBondContact O-CD1 3.46Å; G4-I8 WeakPolarHBondContact O-CG1 3.44Å; G4-I8 PolarHBondContact O-N 3.29Å; I5-I8 PolarHBondContact O-N 2.95Å; G6-I8 PolarHBondContact O-N 3.14Å; I8-S11 PolarHBondContact O-N 3.28Å; I8-N12 WeakPolarHBondContact CG2-ND2 3.49Å; I8-N12 PolarHBondContact O-N 2.96Å; I8-N12 PolarHBondContact O-ND2 3.13Å; I8-F65 HydrophobicContact CB-CZ 4.06Å; I8-F65 HydrophobicContact CD1-CE1 4.25Å; I8-F65 HydrophobicContact CD1-CZ 4.21Å; I8-F65 HydrophobicContact CG2-CE1 4.26Å; I8-F65 HydrophobicContact CG2-CZ 3.69Å; I8-L69 HydrophobicContact CG2-CD1 4.5Å; I8-L69 HydrophobicContact CG2-CD2 4.44Å; I8-F258 HydrophobicContact CD1-CD2 4.28Å; I8-F258 HydrophobicContact CD1-CE2 3.88Å |
| 9 | V | 95.9 | Very high | 92.3 | Very high | 0 Ų | 0 | 34.1 Ų | 34.1 | 0% | 0 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -62.8 | -45.4 | 176.2 | 172.7 | 0 | 0 | 0 | 0 | 110.8 | I5 G6 N12 G13 F65 L69 V72 C137 I140 F141 | I5-V9 WeakPolarHBondContact O-CG2 3.28Å; I5-V9 PolarHBondContact O-N 2.97Å; G6-V9 PolarHBondContact O-N 3.09Å; V9-N12 PolarHBondContact O-N 2.86Å; V9-G13 PolarHBondContact O-N 3.27Å; V9-G13 VanDerWaalsContact O-N 3.11Å; V9-F65 HydrophobicContact CG2-CE2 4.38Å; V9-L69 HydrophobicContact CG2-CD1 4.46Å; V9-V72 HydrophobicContact CG1-CG1 4Å; V9-C137 HydrophobicContact CG1-CB 4.21Å; V9-C137 VanDerWaalsContact CG1-O 3.27Å; V9-C137 WeakPolarHBondContact CG1-O 3.34Å; V9-C137 HydrophobicContact CG2-CB 4.41Å; V9-I140 HydrophobicContact CB-CG2 4.37Å; V9-I140 HydrophobicContact CG1-CB 4.03Å; V9-I140 HydrophobicContact CG1-CG2 4Å; V9-F141 HydrophobicContact CG1-CB 4.22Å |
| 10 | F | 97.1 | Very high | 92.2 | Very high | 5 Ų | 5 | 36.7 Ų | 36.7 | 2% | 0.022 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -58.6 | -50.3 | 175.4 | -169.7 | -82.2 | 0 | 0 | 0 | 111.1 | G6 M7 N12 G13 L14 I140 I143 A144 V147 S206 L207 V210 | G6-F10 WeakPolarHBondContact O-CB 3.38Å; G6-F10 PolarHBondContact O-N 3.27Å; M7-F10 PolarHBondContact O-N 2.97Å; F10-N12 VanDerWaalsContact C-N 3.31Å; F10-N12 PolarHBondContact O-N 2.92Å; F10-G13 PolarHBondContact O-N 3.43Å; F10-L14 HydrophobicContact CE1-CD1 4.24Å; F10-L14 PolarHBondContact O-N 2.88Å; F10-I140 HydrophobicContact CB-CG2 3.83Å; F10-I140 HydrophobicContact CD2-CG2 4.08Å; F10-I140 HydrophobicContact CG-CG2 4.47Å; F10-I143 HydrophobicContact CE2-CG2 4.39Å; F10-A144 HydrophobicContact CB-CB 4.25Å; F10-A144 HydrophobicContact CD1-CB 3.84Å; F10-A144 HydrophobicContact CD2-CB 3.56Å; F10-A144 HydrophobicContact CE1-CB 4.03Å; F10-A144 HydrophobicContact CE2-CB 3.75Å; F10-A144 HydrophobicContact CG-CB 3.6Å; F10-A144 HydrophobicContact CZ-CB 3.99Å; F10-A144 WeakPolarHBondContact O-CB 3.35Å; F10-V147 HydrophobicContact CZ-CB 4.44Å; F10-V147 HydrophobicContact CZ-CG2 4.18Å; F10-S206 WeakPolarHBondContact CG-OG 3.37Å; F10-L207 HydrophobicContact CZ-CD2 4.36Å; F10-L207 HydrophobicContact CZ-CG 4.29Å; F10-V210 HydrophobicContact CE1-CG2 4.39Å |
| 11 | S | 94 | Very high | 92.1 | Very high | 61 Ų | 61 | 39.9 Ų | 39.9 | 43% | 0.427 | 21% | 0.212 | S | C | . | . | H | α-helix | trans | -57.1 | -42.4 | 177.7 | -178.6 | 0 | 0 | 0 | 0 | 112.2 | M7 I8 G13 L14 V15 | M7-S11 VanDerWaalsContact O-CB 3.26Å; M7-S11 WeakPolarHBondContact O-CB 3.35Å; M7-S11 PolarHBondContact O-N 3.39Å; I8-S11 PolarHBondContact O-N 3.28Å; S11-G13 VanDerWaalsContact C-N 3.34Å; S11-G13 PolarHBondContact O-N 2.91Å; S11-L14 WeakPolarHBondContact O-CB 3.46Å; S11-L14 PolarHBondContact O-N 3.34Å; S11-V15 WeakPolarHBondContact O-CG2 3.49Å; S11-V15 PolarHBondContact O-N 3.45Å |
| 12 | N | 93.9 | Very high | 92.7 | Very high | 39 Ų | 39 | 39.2 Ų | 39.2 | 21% | 0.209 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -61.3 | -39.4 | 175.4 | -84.1 | -77.8 | 0 | 0 | 0 | 113 | I8 V9 F10 S16 F141 | I8-N12 WeakPolarHBondContact CG2-ND2 3.49Å; I8-N12 PolarHBondContact O-N 2.96Å; I8-N12 PolarHBondContact O-ND2 3.13Å; V9-N12 PolarHBondContact O-N 2.86Å; F10-N12 VanDerWaalsContact C-N 3.31Å; F10-N12 PolarHBondContact O-N 2.92Å; N12-S16 WeakPolarHBondContact O-CB 3.15Å; N12-S16 PolarHBondContact O-N 3.38Å; N12-S16 VanDerWaalsContact O-N 3.12Å; N12-F141 HydrophobicContact CB-CE2 4.31Å |
| 13 | G | 96.2 | Very high | 92.6 | Very high | 0 Ų | 0 | 41.2 Ų | 41.2 | 0% | 0 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -65 | -46 | 173.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | V9 F10 S11 V15 S16 T145 | V9-G13 PolarHBondContact O-N 3.27Å; V9-G13 VanDerWaalsContact O-N 3.11Å; F10-G13 PolarHBondContact O-N 3.43Å; S11-G13 VanDerWaalsContact C-N 3.34Å; S11-G13 PolarHBondContact O-N 2.91Å; G13-V15 VanDerWaalsContact C-N 3.31Å; G13-V15 PolarHBondContact O-N 3.05Å; G13-S16 WeakPolarHBondContact O-CB 3.21Å; G13-S16 PolarHBondContact O-N 3.43Å; G13-S16 PolarHBondContact O-OG 3.2Å; G13-T145 WeakPolarHBondContact O-CA 3.48Å; G13-T145 PolarHBondContact O-OG1 2.82Å |
| 14 | L | 95 | Very high | 92.4 | Very high | 27 Ų | 27 | 41 Ų | 41 | 14% | 0.141 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -56 | -41.3 | 179.9 | -166 | 77.8 | 0 | 0 | 0 | 112.7 | F10 S11 A19 A144 V147 G148 L151 V210 | F10-L14 HydrophobicContact CE1-CD1 4.24Å; F10-L14 PolarHBondContact O-N 2.88Å; S11-L14 WeakPolarHBondContact O-CB 3.46Å; S11-L14 PolarHBondContact O-N 3.34Å; L14-A19 WeakPolarHBondContact O-CB 3.36Å; L14-A144 WeakPolarHBondContact CA-O 3.34Å; L14-V147 HydrophobicContact CD1-CB 3.88Å; L14-V147 HydrophobicContact CD1-CG1 3.62Å; L14-G148 WeakPolarHBondContact O-CA 3.19Å; L14-L151 HydrophobicContact CD1-CD1 3.95Å; L14-L151 HydrophobicContact CD2-CD1 4.39Å; L14-L151 HydrophobicContact CG-CD1 4.39Å; L14-V210 HydrophobicContact CD2-CG2 4.35Å |
| 15 | V | 92.6 | Very high | 92.5 | Very high | 67 Ų | 67 | 45.5 Ų | 45.5 | 41% | 0.406 | 23% | 0.229 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -102.1 | 11.8 | -179.3 | -55.1 | 0 | 0 | 0 | 0 | 114.4 | S11 G13 R20 | S11-V15 WeakPolarHBondContact O-CG2 3.49Å; S11-V15 PolarHBondContact O-N 3.45Å; G13-V15 VanDerWaalsContact C-N 3.31Å; G13-V15 PolarHBondContact O-N 3.05Å; V15-R20 PolarHBondContact O-NE 3.31Å; V15-R20 VanDerWaalsContact O-NE 3.13Å; V15-R20 PolarHBondContact O-NH2 2.85Å |
| 16 | S | 93.5 | Very high | 92.5 | Very high | 6 Ų | 6 | 49.3 Ų | 49.3 | 4% | 0.042 | 25% | 0.249 | C | C | . | . | S | Bend | trans | -59.6 | 160.9 | -179.6 | 67.1 | 0 | 0 | 0 | 0 | 112.6 | N12 G13 A18 A19 R20 | N12-S16 WeakPolarHBondContact O-CB 3.15Å; N12-S16 PolarHBondContact O-N 3.38Å; N12-S16 VanDerWaalsContact O-N 3.12Å; G13-S16 WeakPolarHBondContact O-CB 3.21Å; G13-S16 PolarHBondContact O-N 3.43Å; G13-S16 PolarHBondContact O-OG 3.2Å; S16-A18 PolarHBondContact O-N 2.91Å; S16-A19 PolarHBondContact O-N 2.91Å; S16-A19 WeakPolarHBondContact OG-CB 3.44Å; S16-A19 PolarHBondContact OG-N 3.46Å; S16-R20 PolarHBondContact O-N 3.47Å; S16-R20 PolarHBondContact O-NE 2.83Å |
| 17 | N | 92.4 | Very high | 92.4 | Very high | 30 Ų | 30 | 53 Ų | 53 | 16% | 0.16 | 28% | 0.279 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -66.4 | -32 | 172.2 | -65.1 | -37.1 | 0 | 0 | 0 | 111.1 | A19 R20 W21 K22 E77 | N17-A19 VanDerWaalsContact C-N 3.35Å; N17-R20 CarbonylContact O-C 3.58Å; N17-R20 PolarHBondContact O-N 3.32Å; N17-R20 VanDerWaalsContact O-N 3.13Å; N17-R20 PolarHBondContact OD1-NH2 3.16Å; N17-W21 PolarHBondContact O-N 3.38Å; N17-W21 VanDerWaalsContact O-N 3.1Å; N17-K22 HydrophobicContact CB-CB 4.02Å; N17-K22 PolarHBondContact O-N 3.49Å; N17-E77 WeakPolarHBondContact CB-OE1 3.42Å; N17-E77 PolarHBondContact N-OE1 2.92Å; N17-E77 PolarHBondContact ND2-OE1 2.88Å |
| 18 | A | 92.6 | Very high | 92.3 | Very high | 2 Ų | 2 | 56.2 Ų | 56.2 | 2% | 0.017 | 29% | 0.288 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -62.5 | -38.6 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | S16 R20 W21 A80 T145 R149 | S16-A18 PolarHBondContact O-N 2.91Å; A18-R20 VanDerWaalsContact C-N 3.26Å; A18-R20 PolarHBondContact O-N 2.98Å; A18-W21 PolarHBondContact O-N 3.18Å; A18-A80 HydrophobicContact CB-CB 3.68Å; A18-T145 HydrophobicContact CB-CG2 4.11Å; A18-R149 PolarHBondContact O-NE 3.49Å |
| 19 | A | 93.4 | Very high | 92.2 | Very high | 0 Ų | 0 | 53.9 Ų | 53.9 | 0% | 0 | 28% | 0.276 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -65.2 | -32.1 | 173.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | L14 S16 N17 T145 R149 Y152 | L14-A19 WeakPolarHBondContact O-CB 3.36Å; S16-A19 PolarHBondContact O-N 2.91Å; S16-A19 WeakPolarHBondContact OG-CB 3.44Å; S16-A19 PolarHBondContact OG-N 3.46Å; N17-A19 VanDerWaalsContact C-N 3.35Å; A19-T145 HydrophobicContact CB-CG2 4.12Å; A19-R149 WeakPolarHBondContact O-CG 3.33Å; A19-Y152 HydrophobicContact CB-CD2 4.32Å; A19-Y152 HydrophobicContact CB-CE2 4.27Å; A19-Y152 WeakPolarHBondContact O-CD2 3.48Å |
| 20 | R | 91.3 | Very high | 92.1 | Very high | 85 Ų | 85 | 58.1 Ų | 58.1 | 32% | 0.321 | 30% | 0.298 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -89.9 | 1.7 | -178 | -71.6 | -177.3 | -79.5 | -177 | -4.5 | 114.8 | V15 S16 N17 A18 K22 Y152 | V15-R20 PolarHBondContact O-NE 3.31Å; V15-R20 VanDerWaalsContact O-NE 3.13Å; V15-R20 PolarHBondContact O-NH2 2.85Å; S16-R20 PolarHBondContact O-N 3.47Å; S16-R20 PolarHBondContact O-NE 2.83Å; N17-R20 CarbonylContact O-C 3.58Å; N17-R20 PolarHBondContact O-N 3.32Å; N17-R20 VanDerWaalsContact O-N 3.13Å; N17-R20 PolarHBondContact OD1-NH2 3.16Å; A18-R20 VanDerWaalsContact C-N 3.26Å; A18-R20 PolarHBondContact O-N 2.98Å; R20-K22 HydrophobicContact CB-CD 4.29Å; R20-K22 HydrophobicContact CB-CG 4.01Å; R20-K22 PolarHBondContact O-N 3.3Å; R20-Y152 WeakPolarHBondContact CD-OH 3.07Å; R20-Y152 HydrophobicContact CG-CD1 4.06Å; R20-Y152 HydrophobicContact CG-CD2 3.66Å; R20-Y152 HydrophobicContact CG-CE1 3.67Å; R20-Y152 HydrophobicContact CG-CE2 3.28Å; R20-Y152 HydrophobicContact CG-CG 4.07Å |
| 21 | W | 89.2 | Confident | 91.9 | Very high | 104 Ų | 104 | 64 Ų | 64 | 39% | 0.394 | 33% | 0.325 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 55 | 31.1 | -173.2 | -51 | 103.9 | 0 | 0 | 0 | 113.4 | N17 A18 H84 R149 | N17-W21 PolarHBondContact O-N 3.38Å; N17-W21 VanDerWaalsContact O-N 3.1Å; A18-W21 PolarHBondContact O-N 3.18Å; W21-H84 AromaticContact CE3-ND1 3.73Å; W21-H84 WeakPolarHBondContact CH2-O 3.32Å; W21-H84 HydrophobicContact CZ3-CB 4.09Å; W21-H84 AromaticContact CZ3-ND1 3.37Å; W21-H84 WeakPolarHBondContact CZ3-ND1 3.27Å; W21-R149 HydrophobicContact CH2-CG 4.41Å; W21-R149 HydrophobicContact CZ2-CB 4.21Å; W21-R149 VanDerWaalsContact CZ2-CD 3.4Å; W21-R149 HydrophobicContact CZ2-CG 3.71Å |
| 22 | K | 88.7 | Confident | 91.7 | Very high | 114 Ų | 114 | 65.2 Ų | 65.2 | 50% | 0.496 | 32% | 0.323 | S | S | . | . | P | Polyproline II helix | trans | -91.1 | 141.8 | 177.9 | -72.5 | -173.2 | 178.8 | -171.3 | 0 | 110.3 | N17 R20 I24 | N17-K22 HydrophobicContact CB-CB 4.02Å; N17-K22 PolarHBondContact O-N 3.49Å; R20-K22 HydrophobicContact CB-CD 4.29Å; R20-K22 HydrophobicContact CB-CG 4.01Å; R20-K22 PolarHBondContact O-N 3.3Å; K22-I24 PolarHBondContact O-N 2.99Å |
| 23 | P | 86.8 | Confident | 91.7 | Very high | 112 Ų | 112 | 63.6 Ų | 63.6 | 73% | 0.727 | 32% | 0.315 | S | S | * | . | P | Polyproline II helix | trans | -62.4 | 138.6 | 177.5 | 26.6 | -34.5 | 0 | 0 | 0 | 110.8 | ||
| 24 | I | 87.7 | Confident | 91.6 | Very high | 43 Ų | 43 | 65.9 Ų | 65.9 | 22% | 0.221 | 33% | 0.333 | C | S | . | . | P | Polyproline II helix | trans | -82.9 | 120.2 | 176.4 | -63.2 | -167.6 | 0 | 0 | 0 | 109.6 | K22 L29 E77 S81 | K22-I24 PolarHBondContact O-N 2.99Å; I24-L29 HydrophobicContact CG2-CB 4.46Å; I24-L29 HydrophobicContact CG2-CD2 4.11Å; I24-E77 HydrophobicContact CD1-CB 4.42Å; I24-E77 HydrophobicContact CD1-CG 3.78Å; I24-E77 WeakPolarHBondContact CD1-O 3.49Å; I24-S81 WeakPolarHBondContact CD1-OG 3.33Å |
| 25 | K | 91.1 | Very high | 91.5 | Very high | 129 Ų | 129 | 68.2 Ų | 68.2 | 56% | 0.561 | 35% | 0.349 | S | S | * | . | trans | -90.6 | 100.3 | 165.1 | -63.3 | -172 | 177.9 | -167.9 | 0 | 107.9 | A27 R28 L29 | K25-A27 VanDerWaalsContact C-N 3.28Å; K25-A27 PolarHBondContact O-N 3.4Å; K25-R28 HydrophobicContact CB-CB 4.08Å; K25-R28 WeakPolarHBondContact O-CA 3.31Å; K25-R28 WeakPolarHBondContact O-CB 2.84Å; K25-R28 PolarHBondContact O-N 2.98Å; K25-L29 PolarHBondContact O-N 2.97Å; K25-L29 VanDerWaalsContact O-N 3.08Å | ||
| 26 | L | 90.1 | Very high | 91.5 | Very high | 93 Ų | 93 | 65.8 Ų | 65.8 | 49% | 0.487 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -52.9 | -44.1 | -174.2 | -177.4 | 61.6 | 0 | 0 | 0 | 112.2 | R28 L29 I30 | L26-R28 VanDerWaalsContact C-N 3.26Å; L26-R28 PolarHBondContact O-N 3.33Å; L26-L29 WeakPolarHBondContact O-CB 2.87Å; L26-L29 PolarHBondContact O-N 2.77Å; L26-I30 HydrophobicContact CD1-CD1 4.14Å; L26-I30 HydrophobicContact CD1-CG1 4.23Å; L26-I30 HydrophobicContact CD2-CD1 4.43Å; L26-I30 HydrophobicContact CG-CD1 3.82Å; L26-I30 HydrophobicContact CG-CG1 4.34Å; L26-I30 WeakPolarHBondContact O-CG1 3.09Å; L26-I30 PolarHBondContact O-N 2.98Å |
| 27 | A | 92.8 | Very high | 91.6 | Very high | 78 Ų | 78 | 69 Ų | 69 | 65% | 0.645 | 35% | 0.35 | S | S | * | . | H | α-helix | trans | -55.5 | -39.9 | 176.2 | 0 | 0 | 0 | 0 | 0 | 113 | K25 Q31 | K25-A27 VanDerWaalsContact C-N 3.28Å; K25-A27 PolarHBondContact O-N 3.4Å; A27-Q31 WeakPolarHBondContact O-CB 3.09Å; A27-Q31 PolarHBondContact O-N 2.86Å |
| 28 | R | 91.1 | Very high | 91.8 | Very high | 131 Ų | 131 | 74.1 Ų | 74.1 | 49% | 0.494 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -73.7 | -33.5 | 178.2 | -170.3 | 179.2 | -68.2 | 170.9 | -6.7 | 112.1 | K25 L26 K32 | K25-R28 HydrophobicContact CB-CB 4.08Å; K25-R28 WeakPolarHBondContact O-CA 3.31Å; K25-R28 WeakPolarHBondContact O-CB 2.84Å; K25-R28 PolarHBondContact O-N 2.98Å; L26-R28 VanDerWaalsContact C-N 3.26Å; L26-R28 PolarHBondContact O-N 3.33Å; R28-K32 WeakPolarHBondContact O-CB 3.42Å; R28-K32 VanDerWaalsContact O-CG 3.31Å; R28-K32 WeakPolarHBondContact O-CG 3.02Å; R28-K32 PolarHBondContact O-N 2.91Å |
| 29 | L | 91.3 | Very high | 91.8 | Very high | 6 Ų | 6 | 75.5 Ų | 75.5 | 3% | 0.031 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -67.5 | -44.8 | 174.7 | -178.8 | 58.7 | 0 | 0 | 0 | 110.7 | I24 K25 L26 K32 S33 K73 L74 E77 | I24-L29 HydrophobicContact CG2-CB 4.46Å; I24-L29 HydrophobicContact CG2-CD2 4.11Å; K25-L29 PolarHBondContact O-N 2.97Å; K25-L29 VanDerWaalsContact O-N 3.08Å; L26-L29 WeakPolarHBondContact O-CB 2.87Å; L26-L29 PolarHBondContact O-N 2.77Å; L29-K32 PolarHBondContact O-N 2.82Å; L29-S33 WeakPolarHBondContact O-CB 3.39Å; L29-S33 PolarHBondContact O-N 3.19Å; L29-S33 PolarHBondContact O-OG 3.06Å; L29-K73 HydrophobicContact CD1-CG 4.19Å; L29-L74 HydrophobicContact CD2-CD1 4.03Å; L29-L74 HydrophobicContact CG-CD1 3.86Å; L29-E77 HydrophobicContact CD1-CB 4.13Å; L29-E77 HydrophobicContact CD1-CG 4.45Å; L29-E77 WeakPolarHBondContact CD1-OE2 3.04Å; L29-E77 HydrophobicContact CD2-CB 4.22Å |
| 30 | I | 93.6 | Very high | 91.8 | Very high | 89 Ų | 89 | 75.5 Ų | 75.5 | 46% | 0.456 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -60.8 | -48.2 | 174 | -66.7 | 170.4 | 0 | 0 | 0 | 110 | L26 K32 S33 A34 L74 | L26-I30 HydrophobicContact CD1-CD1 4.14Å; L26-I30 HydrophobicContact CD1-CG1 4.23Å; L26-I30 HydrophobicContact CD2-CD1 4.43Å; L26-I30 HydrophobicContact CG-CD1 3.82Å; L26-I30 HydrophobicContact CG-CG1 4.34Å; L26-I30 WeakPolarHBondContact O-CG1 3.09Å; L26-I30 PolarHBondContact O-N 2.98Å; I30-K32 PolarHBondContact O-N 3.22Å; I30-S33 CarbonylContact O-C 3.35Å; I30-S33 PolarHBondContact O-N 3.48Å; I30-S33 VanDerWaalsContact O-N 3.13Å; I30-A34 WeakPolarHBondContact O-CB 3.41Å; I30-A34 PolarHBondContact O-N 3.31Å; I30-L74 HydrophobicContact CG1-CD1 4.35Å |
| 31 | Q | 93.6 | Very high | 92 | Very high | 128 Ų | 128 | 73.1 Ų | 73.1 | 60% | 0.598 | 38% | 0.376 | S | S | * | . | H | α-helix | trans | -56.4 | -47.5 | 177.6 | -174.7 | -173.1 | 14.4 | 0 | 0 | 112.1 | A27 S33 A34 V35 | A27-Q31 WeakPolarHBondContact O-CB 3.09Å; A27-Q31 PolarHBondContact O-N 2.86Å; Q31-S33 VanDerWaalsContact C-N 3.31Å; Q31-S33 PolarHBondContact O-N 2.83Å; Q31-A34 PolarHBondContact O-N 3.1Å; Q31-V35 WeakPolarHBondContact O-CG2 3.44Å; Q31-V35 PolarHBondContact O-N 3.36Å; Q31-V35 VanDerWaalsContact O-N 3.13Å |
| 32 | K | 90 | Very high | 92.2 | Very high | 86 Ų | 86 | 70.5 Ų | 70.5 | 37% | 0.374 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -63.8 | -37.2 | 177.8 | -75.2 | 178 | 178.4 | -175.8 | 0 | 112.5 | R28 L29 I30 L36 | R28-K32 WeakPolarHBondContact O-CB 3.42Å; R28-K32 VanDerWaalsContact O-CG 3.31Å; R28-K32 WeakPolarHBondContact O-CG 3.02Å; R28-K32 PolarHBondContact O-N 2.91Å; L29-K32 PolarHBondContact O-N 2.82Å; I30-K32 PolarHBondContact O-N 3.22Å; K32-L36 PolarHBondContact O-N 3.29Å |
| 33 | S | 92.4 | Very high | 92.4 | Very high | 5 Ų | 5 | 68 Ų | 68 | 4% | 0.035 | 36% | 0.361 | C | S | . | . | H | α-helix | trans | -71.1 | -38.2 | 177.8 | -52.2 | 0 | 0 | 0 | 0 | 110.6 | L29 I30 Q31 V35 L36 L37 | L29-S33 WeakPolarHBondContact O-CB 3.39Å; L29-S33 PolarHBondContact O-N 3.19Å; L29-S33 PolarHBondContact O-OG 3.06Å; I30-S33 CarbonylContact O-C 3.35Å; I30-S33 PolarHBondContact O-N 3.48Å; I30-S33 VanDerWaalsContact O-N 3.13Å; Q31-S33 VanDerWaalsContact C-N 3.31Å; Q31-S33 PolarHBondContact O-N 2.83Å; S33-V35 VanDerWaalsContact C-N 3.34Å; S33-V35 PolarHBondContact O-N 2.91Å; S33-L36 WeakPolarHBondContact O-CB 3.34Å; S33-L36 PolarHBondContact O-N 2.86Å; S33-L36 VanDerWaalsContact O-N 3.1Å; S33-L37 WeakPolarHBondContact O-CG 3.47Å; S33-L37 PolarHBondContact O-N 3.48Å |
| 34 | A | 94.1 | Very high | 92.6 | Very high | 48 Ų | 48 | 63.2 Ų | 63.2 | 40% | 0.397 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -61.3 | -39.4 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | I30 Q31 L36 L37 F38 | I30-A34 WeakPolarHBondContact O-CB 3.41Å; I30-A34 PolarHBondContact O-N 3.31Å; Q31-A34 PolarHBondContact O-N 3.1Å; A34-L36 VanDerWaalsContact C-N 3.31Å; A34-L36 PolarHBondContact O-N 3.45Å; A34-L37 PolarHBondContact O-N 3.23Å; A34-F38 WeakPolarHBondContact O-CB 3.29Å; A34-F38 PolarHBondContact O-N 3Å |
| 35 | V | 93.4 | Very high | 92.8 | Very high | 76 Ų | 76 | 67.1 Ų | 67.1 | 46% | 0.461 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -60.9 | -41.4 | 173.3 | 174.3 | 0 | 0 | 0 | 0 | 111.3 | Q31 S33 F38 L39 | Q31-V35 WeakPolarHBondContact O-CG2 3.44Å; Q31-V35 PolarHBondContact O-N 3.36Å; Q31-V35 VanDerWaalsContact O-N 3.13Å; S33-V35 VanDerWaalsContact C-N 3.34Å; S33-V35 PolarHBondContact O-N 2.91Å; V35-F38 PolarHBondContact O-N 3.34Å; V35-L39 HydrophobicContact CG1-CD1 4.43Å; V35-L39 WeakPolarHBondContact O-CG 3.48Å; V35-L39 PolarHBondContact O-N 2.88Å |
| 36 | L | 93.6 | Very high | 92.8 | Very high | 16 Ų | 16 | 64.7 Ų | 64.7 | 8% | 0.084 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -68.3 | -42.2 | 176.6 | -67.9 | 172.6 | 0 | 0 | 0 | 111.8 | K32 S33 A34 F38 L39 G40 F66 L69 A70 K73 | K32-L36 PolarHBondContact O-N 3.29Å; S33-L36 WeakPolarHBondContact O-CB 3.34Å; S33-L36 PolarHBondContact O-N 2.86Å; S33-L36 VanDerWaalsContact O-N 3.1Å; A34-L36 VanDerWaalsContact C-N 3.31Å; A34-L36 PolarHBondContact O-N 3.45Å; L36-F38 VanDerWaalsContact C-N 3.29Å; L36-F38 PolarHBondContact O-N 3.47Å; L36-L39 PolarHBondContact O-N 3.37Å; L36-G40 PolarHBondContact O-N 2.96Å; L36-F66 HydrophobicContact CD2-CD1 4.24Å; L36-F66 WeakPolarHBondContact O-CB 3.33Å; L36-L69 HydrophobicContact CD1-CD2 4.25Å; L36-L69 HydrophobicContact CD1-CG 4.08Å; L36-L69 HydrophobicContact CD2-CD2 4.23Å; L36-A70 HydrophobicContact CB-CB 3.78Å; L36-A70 HydrophobicContact CD1-CB 4.42Å; L36-K73 HydrophobicContact CD1-CD 4.17Å |
| 37 | L | 95.2 | Very high | 92.7 | Very high | 75 Ų | 75 | 61.6 Ų | 61.6 | 39% | 0.393 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -60.5 | -40.4 | 174.8 | -67.5 | 176.8 | 0 | 0 | 0 | 111.6 | S33 A34 G40 A41 Y67 A70 | S33-L37 WeakPolarHBondContact O-CG 3.47Å; S33-L37 PolarHBondContact O-N 3.48Å; A34-L37 PolarHBondContact O-N 3.23Å; L37-G40 PolarHBondContact O-N 3.35Å; L37-A41 PolarHBondContact O-N 2.88Å; L37-Y67 HydrophobicContact CD2-CD1 3.73Å; L37-Y67 HydrophobicContact CD2-CE1 4.37Å; L37-A70 HydrophobicContact CD2-CB 3.61Å; L37-A70 HydrophobicContact CG-CB 3.86Å |
| 38 | F | 95.5 | Very high | 92.5 | Very high | 136 Ų | 136 | 61.6 Ų | 61.6 | 60% | 0.596 | 32% | 0.316 | S | S | * | . | H | α-helix | trans | -62.9 | -47.6 | 175.2 | 177.8 | -100.3 | 0 | 0 | 0 | 111.7 | A34 V35 L36 G40 A41 C42 | A34-F38 WeakPolarHBondContact O-CB 3.29Å; A34-F38 PolarHBondContact O-N 3Å; V35-F38 PolarHBondContact O-N 3.34Å; L36-F38 VanDerWaalsContact C-N 3.29Å; L36-F38 PolarHBondContact O-N 3.47Å; F38-G40 VanDerWaalsContact C-N 3.27Å; F38-G40 PolarHBondContact O-N 3.43Å; F38-A41 PolarHBondContact O-N 2.92Å; F38-A41 VanDerWaalsContact O-N 3.14Å; F38-C42 VanDerWaalsContact CE1-SG 3.57Å; F38-C42 VanDerWaalsContact CZ-SG 3.51Å; F38-C42 PolarHBondContact O-N 3.09Å; F38-C42 PolarHBondContact O-SG 3.39Å; F38-C42 VanDerWaalsContact O-SG 3.38Å |
| 39 | L | 93.6 | Very high | 92.5 | Very high | 31 Ų | 31 | 64.1 Ų | 64.1 | 16% | 0.162 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -60.2 | -38.1 | 174.4 | -71.1 | 173.4 | 0 | 0 | 0 | 112.2 | V35 L36 R43 F66 L255 L259 | V35-L39 HydrophobicContact CG1-CD1 4.43Å; V35-L39 WeakPolarHBondContact O-CG 3.48Å; V35-L39 PolarHBondContact O-N 2.88Å; L36-L39 PolarHBondContact O-N 3.37Å; L39-R43 WeakPolarHBondContact O-CB 3.31Å; L39-R43 PolarHBondContact O-N 2.93Å; L39-F66 HydrophobicContact CB-CD1 4.03Å; L39-F66 HydrophobicContact CB-CD2 4.47Å; L39-F66 HydrophobicContact CB-CE1 4.13Å; L39-F66 HydrophobicContact CB-CG 4.2Å; L39-F66 HydrophobicContact CB-CZ 4.41Å; L39-F66 HydrophobicContact CD1-CD1 4.46Å; L39-F66 HydrophobicContact CD1-CE1 4.14Å; L39-L255 HydrophobicContact CD1-CD1 3.88Å; L39-L255 HydrophobicContact CD1-CD2 4.36Å; L39-L259 HydrophobicContact CD1-CD1 4.41Å; L39-L259 HydrophobicContact CD1-CD2 4.44Å; L39-L259 HydrophobicContact CD2-CD1 4.12Å; L39-L259 HydrophobicContact CD2-CD2 4.13Å |
| 40 | G | 94 | Very high | 92.3 | Very high | 0 Ų | 0 | 69.4 Ų | 69.4 | 0% | 0 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -60.2 | -47.1 | 172.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | L36 L37 F38 R43 T44 N64 Y67 | L36-G40 PolarHBondContact O-N 2.96Å; L37-G40 PolarHBondContact O-N 3.35Å; F38-G40 VanDerWaalsContact C-N 3.27Å; F38-G40 PolarHBondContact O-N 3.43Å; G40-R43 PolarHBondContact O-N 3.19Å; G40-T44 PolarHBondContact O-N 3.06Å; G40-T44 PolarHBondContact O-OG1 3.4Å; G40-N64 PolarHBondContact O-ND2 3.44Å; G40-Y67 VanDerWaalsContact C-CZ 3.46Å; G40-Y67 PolarHBondContact O-OH 3.31Å |
| 41 | A | 95 | Very high | 91.8 | Very high | 35 Ų | 35 | 72.1 Ų | 72.1 | 29% | 0.289 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -63.6 | -46.4 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112 | L37 F38 R43 T44 M45 Y67 | L37-A41 PolarHBondContact O-N 2.88Å; F38-A41 PolarHBondContact O-N 2.92Å; F38-A41 VanDerWaalsContact O-N 3.14Å; A41-R43 VanDerWaalsContact C-N 3.31Å; A41-R43 PolarHBondContact O-N 2.9Å; A41-T44 PolarHBondContact O-N 3.19Å; A41-M45 VanDerWaalsContact O-CG 3.26Å; A41-M45 WeakPolarHBondContact O-CG 3.36Å; A41-M45 PolarHBondContact O-N 2.71Å; A41-Y67 WeakPolarHBondContact CA-OH 3.31Å; A41-Y67 PolarHBondContact N-OH 3.15Å; A41-Y67 VanDerWaalsContact N-OH 3.15Å |
| 42 | C | 93.4 | Very high | 91.3 | Very high | 49 Ų | 49 | 67.5 Ų | 67.5 | 33% | 0.331 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -57.1 | -45.4 | 174.7 | -69.1 | 0 | 0 | 0 | 0 | 111.4 | F38 M45 V46 | F38-C42 VanDerWaalsContact CE1-SG 3.57Å; F38-C42 VanDerWaalsContact CZ-SG 3.51Å; F38-C42 PolarHBondContact O-N 3.09Å; F38-C42 PolarHBondContact O-SG 3.39Å; F38-C42 VanDerWaalsContact O-SG 3.38Å; C42-M45 PolarHBondContact O-N 3.33Å; C42-V46 WeakPolarHBondContact O-CB 3.47Å; C42-V46 VanDerWaalsContact O-CG2 3.24Å; C42-V46 WeakPolarHBondContact O-CG2 3.36Å; C42-V46 PolarHBondContact O-N 2.88Å |
| 43 | R | 91.6 | Very high | 90.6 | Very high | 63 Ų | 63 | 68.8 Ų | 68.8 | 24% | 0.238 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -59.5 | -49.4 | 176.5 | 176.7 | 176.2 | 172.8 | 175.7 | -0.4 | 111.4 | L39 G40 A41 M45 V46 L47 F66 | L39-R43 WeakPolarHBondContact O-CB 3.31Å; L39-R43 PolarHBondContact O-N 2.93Å; G40-R43 PolarHBondContact O-N 3.19Å; A41-R43 VanDerWaalsContact C-N 3.31Å; A41-R43 PolarHBondContact O-N 2.9Å; R43-M45 VanDerWaalsContact C-N 3.32Å; R43-M45 PolarHBondContact O-N 3Å; R43-V46 PolarHBondContact O-N 3.26Å; R43-L47 HydrophobicContact CG-CD1 3.95Å; R43-L47 HydrophobicContact CG-CG 4.33Å; R43-L47 VanDerWaalsContact O-CG 3.28Å; R43-L47 WeakPolarHBondContact O-CG 3.49Å; R43-L47 PolarHBondContact O-N 3.09Å; R43-F66 HydrophobicContact CB-CD2 4.42Å; R43-F66 HydrophobicContact CB-CE2 4.43Å |
| 44 | T | 91.9 | Very high | 90 | Very high | 11 Ų | 11 | 71.9 Ų | 71.9 | 7% | 0.067 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -59.6 | -43.9 | 179.4 | -60.3 | 0 | 0 | 0 | 0 | 111.2 | G40 A41 L47 L48 H62 N64 | G40-T44 PolarHBondContact O-N 3.06Å; G40-T44 PolarHBondContact O-OG1 3.4Å; A41-T44 PolarHBondContact O-N 3.19Å; T44-L47 PolarHBondContact O-N 3.49Å; T44-L48 HydrophobicContact CG2-CD1 3.99Å; T44-L48 VanDerWaalsContact O-CG 3.28Å; T44-L48 WeakPolarHBondContact O-CG 3.24Å; T44-L48 PolarHBondContact O-N 2.75Å; T44-H62 HydrophobicContact CG2-CB 4.15Å; T44-H62 PolarHBondContact OG1-O 2.83Å; T44-N64 PolarHBondContact OG1-ND2 2.88Å |
| 45 | M | 92.7 | Very high | 89.5 | Confident | 125 Ų | 125 | 74.5 Ų | 74.5 | 62% | 0.616 | 38% | 0.379 | S | S | * | . | H | α-helix | trans | -63.6 | -42.8 | 177.7 | -66.1 | -61.9 | 153 | 0 | 0 | 112.7 | A41 C42 R43 L48 Y49 | A41-M45 VanDerWaalsContact O-CG 3.26Å; A41-M45 WeakPolarHBondContact O-CG 3.36Å; A41-M45 PolarHBondContact O-N 2.71Å; C42-M45 PolarHBondContact O-N 3.33Å; R43-M45 VanDerWaalsContact C-N 3.32Å; R43-M45 PolarHBondContact O-N 3Å; M45-L48 PolarHBondContact O-N 2.96Å; M45-Y49 VanDerWaalsContact O-CB 3.28Å; M45-Y49 WeakPolarHBondContact O-CB 3.37Å; M45-Y49 PolarHBondContact O-N 3.41Å |
| 46 | V | 90.3 | Very high | 89 | Confident | 78 Ų | 78 | 72.5 Ų | 72.5 | 47% | 0.473 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -62.8 | -45.3 | 177.2 | 168.7 | 0 | 0 | 0 | 0 | 110.8 | C42 R43 L48 Y49 F50 | C42-V46 WeakPolarHBondContact O-CB 3.47Å; C42-V46 VanDerWaalsContact O-CG2 3.24Å; C42-V46 WeakPolarHBondContact O-CG2 3.36Å; C42-V46 PolarHBondContact O-N 2.88Å; R43-V46 PolarHBondContact O-N 3.26Å; V46-L48 VanDerWaalsContact C-N 3.32Å; V46-L48 PolarHBondContact O-N 3.01Å; V46-Y49 PolarHBondContact O-N 2.72Å; V46-F50 HydrophobicContact CG1-CD2 3.74Å; V46-F50 HydrophobicContact CG1-CE2 4.02Å; V46-F50 VanDerWaalsContact O-CD2 3.31Å; V46-F50 WeakPolarHBondContact O-CD2 3.4Å; V46-F50 PolarHBondContact O-N 3.28Å |
| 47 | L | 88.1 | Confident | 88.6 | Confident | 28 Ų | 28 | 75 Ų | 75 | 15% | 0.147 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -63.1 | -39.8 | 179.3 | -67.2 | 175.7 | 0 | 0 | 0 | 112.2 | R43 T44 D51 Y52 Y54 | R43-L47 HydrophobicContact CG-CD1 3.95Å; R43-L47 HydrophobicContact CG-CG 4.33Å; R43-L47 VanDerWaalsContact O-CG 3.28Å; R43-L47 WeakPolarHBondContact O-CG 3.49Å; R43-L47 PolarHBondContact O-N 3.09Å; T44-L47 PolarHBondContact O-N 3.49Å; L47-D51 PolarHBondContact O-N 3.36Å; L47-Y52 HydrophobicContact CD2-CD1 3.49Å; L47-Y52 VanDerWaalsContact CD2-CD1 3.49Å; L47-Y52 HydrophobicContact CD2-CD2 4.33Å; L47-Y52 HydrophobicContact CD2-CE1 4.19Å; L47-Y52 HydrophobicContact CD2-CG 3.57Å; L47-Y52 PolarHBondContact O-N 3.33Å; L47-Y52 VanDerWaalsContact O-N 3.09Å; L47-Y54 HydrophobicContact CB-CD1 4.17Å; L47-Y54 HydrophobicContact CB-CE1 4.08Å; L47-Y54 HydrophobicContact CD1-CD1 4.18Å |
| 48 | L | 88.9 | Confident | 88 | Confident | 77 Ų | 77 | 73.4 Ų | 73.4 | 40% | 0.403 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -69.8 | -35.7 | 175.5 | -68.9 | 172.4 | 0 | 0 | 0 | 112.5 | T44 M45 V46 | T44-L48 HydrophobicContact CG2-CD1 3.99Å; T44-L48 VanDerWaalsContact O-CG 3.28Å; T44-L48 WeakPolarHBondContact O-CG 3.24Å; T44-L48 PolarHBondContact O-N 2.75Å; M45-L48 PolarHBondContact O-N 2.96Å; V46-L48 VanDerWaalsContact C-N 3.32Å; V46-L48 PolarHBondContact O-N 3.01Å |
| 49 | Y | 90.3 | Very high | 87.5 | Confident | 185 Ų | 185 | 67.4 Ų | 67.4 | 73% | 0.725 | 34% | 0.342 | S | S | * | . | H | α-helix | trans | -72.3 | -35.6 | -179.5 | -179.3 | -98.1 | 0 | 0 | 0 | 113.1 | M45 V46 | M45-Y49 VanDerWaalsContact O-CB 3.28Å; M45-Y49 WeakPolarHBondContact O-CB 3.37Å; M45-Y49 PolarHBondContact O-N 3.41Å; V46-Y49 PolarHBondContact O-N 2.72Å |
| 50 | F | 86.3 | Confident | 87.3 | Confident | 117 Ų | 117 | 66 Ų | 66 | 51% | 0.513 | 34% | 0.335 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -94 | 8.1 | -178.7 | -74 | -73.2 | 0 | 0 | 0 | 113.9 | V46 Y52 M270 | V46-F50 HydrophobicContact CG1-CD2 3.74Å; V46-F50 HydrophobicContact CG1-CE2 4.02Å; V46-F50 VanDerWaalsContact O-CD2 3.31Å; V46-F50 WeakPolarHBondContact O-CD2 3.4Å; V46-F50 PolarHBondContact O-N 3.28Å; F50-Y52 PolarHBondContact O-N 2.88Å; F50-Y52 VanDerWaalsContact O-N 3.07Å; F50-M270 HydrophobicContact CD1-CE 4.46Å |
| 51 | D | 84 | Confident | 86.9 | Confident | 146 Ų | 146 | 69.1 Ų | 69.1 | 78% | 0.781 | 35% | 0.35 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 43.6 | 42.9 | -172.7 | -70.6 | -44.9 | 0 | 0 | 0 | 112.1 | L47 | L47-D51 PolarHBondContact O-N 3.36Š|
| 52 | Y | 82 | Confident | 86.8 | Confident | 31 Ų | 31 | 70.4 Ų | 70.4 | 12% | 0.122 | 35% | 0.35 | C | S | . | . | trans | -68.3 | 131.5 | -170.8 | -177.5 | -83.1 | 0 | 0 | 0 | 109.7 | L47 F50 Y54 K269 M270 | L47-Y52 HydrophobicContact CD2-CD1 3.49Å; L47-Y52 VanDerWaalsContact CD2-CD1 3.49Å; L47-Y52 HydrophobicContact CD2-CD2 4.33Å; L47-Y52 HydrophobicContact CD2-CE1 4.19Å; L47-Y52 HydrophobicContact CD2-CG 3.57Å; L47-Y52 PolarHBondContact O-N 3.33Å; L47-Y52 VanDerWaalsContact O-N 3.09Å; F50-Y52 PolarHBondContact O-N 2.88Å; F50-Y52 VanDerWaalsContact O-N 3.07Å; Y52-Y54 HydrophobicContact CD1-CD1 4.33Å; Y52-Y54 WeakPolarHBondContact O-CD1 3.28Å; Y52-Y54 PolarHBondContact O-N 3.41Å; Y52-Y54 VanDerWaalsContact O-N 3.08Å; Y52-K269 HydrophobicContact CE2-CB 4.48Å; Y52-K269 VanDerWaalsContact OH-CB 3.27Å; Y52-K269 WeakPolarHBondContact OH-CB 2.94Å; Y52-K269 WeakPolarHBondContact OH-CD 3.24Å; Y52-M270 HydrophobicContact CD2-CG 3.8Å; Y52-M270 HydrophobicContact CD2-SD 3.92Å; Y52-M270 HydrophobicContact CE2-CG 3.69Å; Y52-M270 HydrophobicContact CE2-SD 4.19Å | ||
| 53 | P | 76.5 | Confident | 86.7 | Confident | 112 Ų | 112 | 70.5 Ų | 70.5 | 73% | 0.727 | 34% | 0.344 | S | S | * | . | trans | -72.6 | 105.7 | 176.7 | 29 | -33 | 0 | 0 | 0 | 109.9 | ||||
| 54 | Y | 80 | Confident | 86.7 | Confident | 71 Ų | 71 | 67.7 Ų | 67.7 | 28% | 0.278 | 33% | 0.333 | S | S | . | . | trans | -126.3 | 149.9 | 171.7 | 64.1 | -89.2 | 0 | 0 | 0 | 111.1 | L47 Y52 V56 M61 | L47-Y54 HydrophobicContact CB-CD1 4.17Å; L47-Y54 HydrophobicContact CB-CE1 4.08Å; L47-Y54 HydrophobicContact CD1-CD1 4.18Å; Y52-Y54 HydrophobicContact CD1-CD1 4.33Å; Y52-Y54 WeakPolarHBondContact O-CD1 3.28Å; Y52-Y54 PolarHBondContact O-N 3.41Å; Y52-Y54 VanDerWaalsContact O-N 3.08Å; Y54-V56 HydrophobicContact CE2-CG2 4.1Å; Y54-V56 PolarHBondContact O-N 2.98Å; Y54-M61 PolarHBondContact OH-O 2.81Å | ||
| 55 | D | 82.3 | Confident | 86.7 | Confident | 102 Ų | 102 | 67.4 Ų | 67.4 | 55% | 0.545 | 33% | 0.331 | S | S | . | . | trans | -77 | 105.6 | -179.2 | -60.5 | -42.6 | 0 | 0 | 0 | 109.9 | E57 E58 | D55-E57 PolarHBondContact O-N 3.45Å; D55-E58 HydrophobicContact CB-CG 3.93Å; D55-E58 WeakPolarHBondContact O-CB 3.38Å; D55-E58 PolarHBondContact O-N 3.43Å | ||
| 56 | V | 83.9 | Confident | 86.7 | Confident | 35 Ų | 35 | 61.8 Ų | 61.8 | 21% | 0.212 | 30% | 0.303 | C | S | . | . | G | 310 helix | trans | -57.4 | -33.2 | 179 | 177.5 | 0 | 0 | 0 | 0 | 111.2 | Y54 E58 Y59 G60 M61 P116 | Y54-V56 HydrophobicContact CE2-CG2 4.1Å; Y54-V56 PolarHBondContact O-N 2.98Å; V56-E58 PolarHBondContact O-N 3.32Å; V56-E58 VanDerWaalsContact O-N 3.15Å; V56-Y59 PolarHBondContact O-N 3.48Å; V56-G60 CarbonylContact O-C 3.34Å; V56-G60 VanDerWaalsContact O-CA 3.24Å; V56-G60 WeakPolarHBondContact O-CA 3.06Å; V56-G60 PolarHBondContact O-N 2.96Å; V56-M61 HydrophobicContact CG1-CB 4.34Å; V56-P116 HydrophobicContact CB-CB 4.41Å; V56-P116 HydrophobicContact CB-CG 4.02Å; V56-P116 HydrophobicContact CG1-CB 4.05Å; V56-P116 HydrophobicContact CG1-CG 3.94Å |
| 57 | E | 84.8 | Confident | 87 | Confident | 68 Ų | 68 | 60.1 Ų | 60.1 | 32% | 0.318 | 29% | 0.289 | S | S | . | . | G | 310 helix | trans | -65.6 | -14 | 178 | -55.9 | 179.7 | 171.1 | 0 | 0 | 113.6 | D55 P116 R192 | D55-E57 PolarHBondContact O-N 3.45Å; E57-P116 HydrophobicContact CG-CG 4.17Å; E57-R192 VanDerWaalsContact O-CD 3.31Å; E57-R192 WeakPolarHBondContact O-CD 3.17Å; E57-R192 WeakPolarHBondContact O-CG 3.3Å; E57-R192 IonicContact OE2-CZ 2.76Å; E57-R192 IonicContact OE2-NH1 3.2Å; E57-R192 PolarHBondContact OE2-NH1 2.89Å; E57-R192 IonicContact OE2-NH2 3.79Å; E57-R192 PolarHBondContact OE2-NH2 2.94Å |
| 58 | E | 83 | Confident | 87.3 | Confident | 42 Ų | 42 | 58.8 Ų | 58.8 | 20% | 0.196 | 28% | 0.282 | C | S | . | . | G | 310 helix | trans | -71.5 | -40 | 179.1 | -82.2 | -166.7 | 167.7 | 0 | 0 | 112.9 | M1 D55 V56 R191 | M1-E58 WeakPolarHBondContact CE-OE2 3.36Å; D55-E58 HydrophobicContact CB-CG 3.93Å; D55-E58 WeakPolarHBondContact O-CB 3.38Å; D55-E58 PolarHBondContact O-N 3.43Å; V56-E58 PolarHBondContact O-N 3.32Å; V56-E58 VanDerWaalsContact O-N 3.15Å; E58-R191 VanDerWaalsContact C-NH2 3.33Å; E58-R191 VanDerWaalsContact O-CZ 3.26Å; E58-R191 PolarHBondContact O-NH1 2.96Å; E58-R191 PolarHBondContact O-NH2 3Å |
| 59 | Y | 84.5 | Confident | 87.6 | Confident | 9 Ų | 9 | 55.8 Ų | 55.8 | 4% | 0.035 | 27% | 0.266 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -142.8 | -25.9 | -174.2 | -75.3 | -73 | 0 | 0 | 0 | 113 | M1 I5 V56 W63 F65 G130 | M1-Y59 HydrophobicContact CE-CE2 4.21Å; I5-Y59 WeakPolarHBondContact CD1-OH 3.47Å; V56-Y59 PolarHBondContact O-N 3.48Å; Y59-W63 VanDerWaalsContact CB-O 3.28Å; Y59-W63 WeakPolarHBondContact CB-O 3.28Å; Y59-W63 AromaticContact CD1-CD1 3.87Å; Y59-W63 WeakPolarHBondContact O-CB 3.31Å; Y59-F65 HydrophobicContact CE1-CB 4.44Å; Y59-F65 HydrophobicContact CE2-CB 4.46Å; Y59-F65 WeakPolarHBondContact OH-CB 3.29Å; Y59-G130 WeakPolarHBondContact O-CA 3.42Å; Y59-G130 PolarHBondContact O-N 3.39Å |
| 60 | G | 89.2 | Confident | 87.8 | Confident | 1 Ų | 1 | 47 Ų | 47 | 1% | 0.01 | 23% | 0.232 | C | C | . | . | trans | 121.9 | 173.7 | -163.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | V56 L126 | V56-G60 CarbonylContact O-C 3.34Å; V56-G60 VanDerWaalsContact O-CA 3.24Å; V56-G60 WeakPolarHBondContact O-CA 3.06Å; V56-G60 PolarHBondContact O-N 2.96Å; G60-L126 CarbonylContact C-O 3.54Å; G60-L126 WeakPolarHBondContact CA-O 3.32Å | ||
| 61 | M | 87 | Confident | 88.3 | Confident | 67 Ų | 67 | 44 Ų | 44 | 33% | 0.33 | 22% | 0.221 | S | C | . | . | S | Bend | trans | -68.6 | -34.9 | -177.2 | -175.5 | -178.6 | -81.7 | 0 | 0 | 113 | Y54 V56 L126 N127 | Y54-M61 PolarHBondContact OH-O 2.81Å; V56-M61 HydrophobicContact CG1-CB 4.34Å; M61-L126 HydrophobicContact CB-CB 4.19Å; M61-L126 HydrophobicContact CE-CD2 3.87Å; M61-L126 PolarHBondContact N-O 2.78Å; M61-L126 HydrophobicContact SD-CD1 4.01Å; M61-L126 HydrophobicContact SD-CD2 4.28Å; M61-N127 PolarHBondContact N-OD1 3.45Å |
| 62 | H | 91.3 | Very high | 88.9 | Confident | 62 Ų | 62 | 37.1 Ų | 37.1 | 29% | 0.287 | 18% | 0.184 | S | C | . | . | S | Bend | trans | -120.4 | -15.7 | -176.8 | -59 | -41 | 0 | 0 | 0 | 112.7 | T44 Y67 N127 | T44-H62 HydrophobicContact CG2-CB 4.15Å; T44-H62 PolarHBondContact OG1-O 2.83Å; H62-Y67 WeakPolarHBondContact O-CE2 3.34Å; H62-N127 WeakPolarHBondContact CA-OD1 3.38Å; H62-N127 PolarHBondContact N-OD1 3.07Å |
| 63 | W | 92.4 | Very high | 89.5 | Confident | 50 Ų | 50 | 37.5 Ų | 37.5 | 19% | 0.189 | 19% | 0.187 | C | C | . | . | trans | -79.3 | 150.3 | -177.6 | -158.6 | -86.4 | 0 | 0 | 0 | 111.9 | Y59 Y67 T68 L71 N127 I131 V134 | Y59-W63 VanDerWaalsContact CB-O 3.28Å; Y59-W63 WeakPolarHBondContact CB-O 3.28Å; Y59-W63 AromaticContact CD1-CD1 3.87Å; Y59-W63 WeakPolarHBondContact O-CB 3.31Å; W63-Y67 HydrophobicContact CD2-CD2 4.3Å; W63-Y67 HydrophobicContact CG-CD2 4.37Å; W63-T68 PolarHBondContact NE1-OG1 3.41Å; W63-L71 HydrophobicContact CH2-CD1 3.55Å; W63-L71 HydrophobicContact CZ2-CD1 3.78Å; W63-N127 HydrophobicContact CB-CB 4.02Å; W63-N127 WeakPolarHBondContact CB-OD1 2.83Å; W63-N127 HydrophobicContact CE3-CB 4.34Å; W63-N127 PolarHBondContact N-OD1 2.93Å; W63-I131 HydrophobicContact CD2-CG1 4.41Å; W63-I131 HydrophobicContact CE3-CG1 4Å; W63-I131 HydrophobicContact CH2-CG1 3.98Å; W63-I131 HydrophobicContact CZ2-CG1 4.41Å; W63-I131 HydrophobicContact CZ3-CD1 4.4Å; W63-I131 HydrophobicContact CZ3-CG1 3.77Å; W63-V134 HydrophobicContact CZ2-CG2 4.07Å | ||
| 64 | N | 92.1 | Very high | 90.4 | Very high | 4 Ų | 4 | 34.9 Ų | 34.9 | 2% | 0.021 | 17% | 0.166 | C | C | . | . | trans | -153.4 | 171.2 | 176.2 | 66.7 | 64.4 | 0 | 0 | 0 | 110.1 | G40 T44 F66 Y67 T68 | G40-N64 PolarHBondContact O-ND2 3.44Å; T44-N64 PolarHBondContact OG1-ND2 2.88Å; N64-F66 PolarHBondContact O-N 3.39Å; N64-F66 VanDerWaalsContact O-N 3.1Å; N64-F66 WeakPolarHBondContact OD1-CB 3.45Å; N64-F66 WeakPolarHBondContact OD1-CD2 3Å; N64-F66 PolarHBondContact OD1-N 2.88Å; N64-Y67 WeakPolarHBondContact ND2-CE2 3.36Å; N64-Y67 PolarHBondContact O-N 3.39Å; N64-Y67 VanDerWaalsContact O-N 3.07Å; N64-T68 PolarHBondContact O-N 3.32Å | ||
| 65 | F | 91.2 | Very high | 91.1 | Very high | 5 Ų | 5 | 34.9 Ų | 34.9 | 2% | 0.022 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -50.8 | -36.1 | -177 | 176.5 | -116.4 | 0 | 0 | 0 | 114.9 | I5 I8 V9 Y59 Y67 T68 L69 F258 | I5-F65 HydrophobicContact CB-CD2 4.4Å; I5-F65 HydrophobicContact CB-CE2 4.29Å; I5-F65 HydrophobicContact CG1-CD2 4.05Å; I5-F65 HydrophobicContact CG1-CE2 4.29Å; I5-F65 HydrophobicContact CG2-CD2 3.73Å; I5-F65 HydrophobicContact CG2-CE2 3.66Å; I8-F65 HydrophobicContact CB-CZ 4.06Å; I8-F65 HydrophobicContact CD1-CE1 4.25Å; I8-F65 HydrophobicContact CD1-CZ 4.21Å; I8-F65 HydrophobicContact CG2-CE1 4.26Å; I8-F65 HydrophobicContact CG2-CZ 3.69Å; V9-F65 HydrophobicContact CG2-CE2 4.38Å; Y59-F65 HydrophobicContact CE1-CB 4.44Å; Y59-F65 HydrophobicContact CE2-CB 4.46Å; Y59-F65 WeakPolarHBondContact OH-CB 3.29Å; F65-Y67 VanDerWaalsContact C-N 3.3Å; F65-Y67 PolarHBondContact O-N 3.29Å; F65-T68 PolarHBondContact O-N 3.49Å; F65-L69 HydrophobicContact CE1-CB 4.45Å; F65-L69 HydrophobicContact CE1-CD2 3.93Å; F65-L69 HydrophobicContact CE2-CB 4.31Å; F65-L69 HydrophobicContact CZ-CB 4.17Å; F65-L69 HydrophobicContact CZ-CD1 4.3Å; F65-L69 HydrophobicContact CZ-CD2 3.94Å; F65-L69 HydrophobicContact CZ-CG 4.36Å; F65-L69 WeakPolarHBondContact O-CB 3.42Å; F65-L69 PolarHBondContact O-N 2.92Å; F65-F258 HydrophobicContact CD1-CE1 4.2Å; F65-F258 AromaticContact CD1-CZ 3.68Å; F65-F258 HydrophobicContact CD1-CZ 3.68Å; F65-F258 HydrophobicContact CE1-CE1 4.3Å; F65-F258 HydrophobicContact CE1-CE2 4.39Å; F65-F258 AromaticContact CE1-CZ 3.76Å; F65-F258 HydrophobicContact CE1-CZ 3.76Å |
| 66 | F | 93.5 | Very high | 91.8 | Very high | 7 Ų | 7 | 30 Ų | 30 | 3% | 0.031 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -65.6 | -35.4 | -177.7 | -66.9 | -74.8 | 0 | 0 | 0 | 112.1 | L36 L39 R43 N64 L69 A70 F258 L259 | L36-F66 HydrophobicContact CD2-CD1 4.24Å; L36-F66 WeakPolarHBondContact O-CB 3.33Å; L39-F66 HydrophobicContact CB-CD1 4.03Å; L39-F66 HydrophobicContact CB-CD2 4.47Å; L39-F66 HydrophobicContact CB-CE1 4.13Å; L39-F66 HydrophobicContact CB-CG 4.2Å; L39-F66 HydrophobicContact CB-CZ 4.41Å; L39-F66 HydrophobicContact CD1-CD1 4.46Å; L39-F66 HydrophobicContact CD1-CE1 4.14Å; R43-F66 HydrophobicContact CB-CD2 4.42Å; R43-F66 HydrophobicContact CB-CE2 4.43Å; N64-F66 PolarHBondContact O-N 3.39Å; N64-F66 VanDerWaalsContact O-N 3.1Å; N64-F66 WeakPolarHBondContact OD1-CB 3.45Å; N64-F66 WeakPolarHBondContact OD1-CD2 3Å; N64-F66 PolarHBondContact OD1-N 2.88Å; F66-L69 PolarHBondContact O-N 3.31Å; F66-A70 VanDerWaalsContact O-CB 3.29Å; F66-A70 WeakPolarHBondContact O-CB 3.36Å; F66-A70 PolarHBondContact O-N 3.21Å; F66-F258 HydrophobicContact CD1-CE1 4.48Å; F66-F258 AromaticContact CE1-CD1 3.97Å; F66-F258 HydrophobicContact CE1-CD1 3.97Å; F66-F258 AromaticContact CE1-CE1 3.53Å; F66-F258 HydrophobicContact CE1-CE1 3.53Å; F66-F258 HydrophobicContact CE2-CE1 4.39Å; F66-F258 HydrophobicContact CZ-CD1 4.01Å; F66-F258 AromaticContact CZ-CE1 3.47Å; F66-F258 HydrophobicContact CZ-CE1 3.47Å; F66-F258 VanDerWaalsContact CZ-CE1 3.47Å; F66-L259 HydrophobicContact CE1-CD2 4.33Å; F66-L259 HydrophobicContact CZ-CD2 3.74Å |
| 67 | Y | 95.4 | Very high | 92.3 | Very high | 43 Ų | 43 | 28.8 Ų | 28.8 | 17% | 0.169 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -66.9 | -46.9 | 174.8 | -61.8 | -53.8 | 0 | 0 | 0 | 111.4 | L37 G40 A41 H62 W63 N64 F65 L69 A70 L71 | L37-Y67 HydrophobicContact CD2-CD1 3.73Å; L37-Y67 HydrophobicContact CD2-CE1 4.37Å; G40-Y67 VanDerWaalsContact C-CZ 3.46Å; G40-Y67 PolarHBondContact O-OH 3.31Å; A41-Y67 WeakPolarHBondContact CA-OH 3.31Å; A41-Y67 PolarHBondContact N-OH 3.15Å; A41-Y67 VanDerWaalsContact N-OH 3.15Å; H62-Y67 WeakPolarHBondContact O-CE2 3.34Å; W63-Y67 HydrophobicContact CD2-CD2 4.3Å; W63-Y67 HydrophobicContact CG-CD2 4.37Å; N64-Y67 WeakPolarHBondContact ND2-CE2 3.36Å; N64-Y67 PolarHBondContact O-N 3.39Å; N64-Y67 VanDerWaalsContact O-N 3.07Å; F65-Y67 VanDerWaalsContact C-N 3.3Å; F65-Y67 PolarHBondContact O-N 3.29Å; Y67-L69 VanDerWaalsContact C-N 3.31Å; Y67-L69 PolarHBondContact O-N 3.42Å; Y67-A70 PolarHBondContact O-N 3.43Å; Y67-L71 PolarHBondContact O-N 3.46Å |
| 68 | T | 95.1 | Very high | 92.8 | Very high | 1 Ų | 1 | 29.7 Ų | 29.7 | 1% | 0.006 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -55.7 | -48.8 | 173.7 | -58.2 | 0 | 0 | 0 | 0 | 110.4 | W63 N64 F65 A70 L71 V72 V134 C137 | W63-T68 PolarHBondContact NE1-OG1 3.41Å; N64-T68 PolarHBondContact O-N 3.32Å; F65-T68 PolarHBondContact O-N 3.49Å; T68-A70 PolarHBondContact O-N 3.24Å; T68-L71 PolarHBondContact O-N 3.28Å; T68-V72 HydrophobicContact CG2-CG2 4.12Å; T68-V72 WeakPolarHBondContact O-CB 3.24Å; T68-V72 WeakPolarHBondContact O-CG2 3.3Å; T68-V72 PolarHBondContact O-N 2.9Å; T68-V134 HydrophobicContact CG2-CG2 4.21Å; T68-C137 HydrophobicContact CG2-CB 4.23Å |
| 69 | L | 94.2 | Very high | 93.3 | Very high | 14 Ų | 14 | 30.1 Ų | 30.1 | 7% | 0.073 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -64.9 | -38.7 | -178.9 | -173.3 | 62.8 | 0 | 0 | 0 | 112.7 | I8 V9 L36 F65 F66 Y67 K73 | I8-L69 HydrophobicContact CG2-CD1 4.5Å; I8-L69 HydrophobicContact CG2-CD2 4.44Å; V9-L69 HydrophobicContact CG2-CD1 4.46Å; L36-L69 HydrophobicContact CD1-CD2 4.25Å; L36-L69 HydrophobicContact CD1-CG 4.08Å; L36-L69 HydrophobicContact CD2-CD2 4.23Å; F65-L69 HydrophobicContact CE1-CB 4.45Å; F65-L69 HydrophobicContact CE1-CD2 3.93Å; F65-L69 HydrophobicContact CE2-CB 4.31Å; F65-L69 HydrophobicContact CZ-CB 4.17Å; F65-L69 HydrophobicContact CZ-CD1 4.3Å; F65-L69 HydrophobicContact CZ-CD2 3.94Å; F65-L69 HydrophobicContact CZ-CG 4.36Å; F65-L69 WeakPolarHBondContact O-CB 3.42Å; F65-L69 PolarHBondContact O-N 2.92Å; F66-L69 PolarHBondContact O-N 3.31Å; Y67-L69 VanDerWaalsContact C-N 3.31Å; Y67-L69 PolarHBondContact O-N 3.42Å; L69-K73 WeakPolarHBondContact O-CB 3.38Å; L69-K73 PolarHBondContact O-N 2.9Å |
| 70 | A | 95.6 | Very high | 93.9 | Very high | 1 Ų | 1 | 29.7 Ų | 29.7 | 1% | 0.008 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -61.7 | -48 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.5 | L36 L37 F66 Y67 T68 L74 | L36-A70 HydrophobicContact CB-CB 3.78Å; L36-A70 HydrophobicContact CD1-CB 4.42Å; L37-A70 HydrophobicContact CD2-CB 3.61Å; L37-A70 HydrophobicContact CG-CB 3.86Å; F66-A70 VanDerWaalsContact O-CB 3.29Å; F66-A70 WeakPolarHBondContact O-CB 3.36Å; F66-A70 PolarHBondContact O-N 3.21Å; Y67-A70 PolarHBondContact O-N 3.43Å; T68-A70 PolarHBondContact O-N 3.24Å; A70-L74 WeakPolarHBondContact O-CB 3.37Å; A70-L74 PolarHBondContact O-N 3.14Å |
| 71 | L | 96.4 | Very high | 94 | Very high | 54 Ų | 54 | 30.7 Ų | 30.7 | 28% | 0.283 | 15% | 0.15 | S | C | . | . | H | α-helix | trans | -67.6 | -45.5 | 179.3 | -68.9 | -174.7 | 0 | 0 | 0 | 112.3 | W63 Y67 T68 K73 L74 I75 V134 | W63-L71 HydrophobicContact CH2-CD1 3.55Å; W63-L71 HydrophobicContact CZ2-CD1 3.78Å; Y67-L71 PolarHBondContact O-N 3.46Å; T68-L71 PolarHBondContact O-N 3.28Å; L71-K73 VanDerWaalsContact C-N 3.29Å; L71-K73 PolarHBondContact O-N 3.4Å; L71-L74 PolarHBondContact O-N 3.34Å; L71-I75 WeakPolarHBondContact O-CB 3.31Å; L71-I75 WeakPolarHBondContact O-CG1 3.14Å; L71-I75 PolarHBondContact O-N 3.25Å; L71-V134 HydrophobicContact CB-CG1 4.02Å; L71-V134 HydrophobicContact CB-CG2 4.46Å; L71-V134 HydrophobicContact CD1-CG2 4.13Å |
| 72 | V | 96.7 | Very high | 94.3 | Very high | 1 Ų | 1 | 35.6 Ų | 35.6 | 1% | 0.006 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -59.7 | -42.6 | 177.6 | 171.9 | 0 | 0 | 0 | 0 | 110.6 | V9 T68 G76 V134 C137 L138 F141 | V9-V72 HydrophobicContact CG1-CG1 4Å; T68-V72 HydrophobicContact CG2-CG2 4.12Å; T68-V72 WeakPolarHBondContact O-CB 3.24Å; T68-V72 WeakPolarHBondContact O-CG2 3.3Å; T68-V72 PolarHBondContact O-N 2.9Å; V72-G76 WeakPolarHBondContact O-CA 3.45Å; V72-G76 PolarHBondContact O-N 3.09Å; V72-V134 HydrophobicContact CG2-CG1 4.08Å; V72-C137 HydrophobicContact CG2-CB 3.49Å; V72-C137 VanDerWaalsContact CG2-CB 3.49Å; V72-L138 HydrophobicContact CB-CD2 4.49Å; V72-L138 HydrophobicContact CG1-CD2 4.26Å; V72-L138 HydrophobicContact CG2-CG 4.42Å; V72-F141 HydrophobicContact CG1-CB 3.81Å; V72-F141 HydrophobicContact CG1-CD2 3.91Å; V72-F141 HydrophobicContact CG1-CG 4.08Å |
| 73 | K | 94.1 | Very high | 94.3 | Very high | 39 Ų | 39 | 35 Ų | 35 | 17% | 0.17 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -66.3 | -45.5 | 177.6 | -173.6 | 174.2 | -169 | 157.3 | 0 | 112.1 | L29 L36 L69 L71 E77 | L29-K73 HydrophobicContact CD1-CG 4.19Å; L36-K73 HydrophobicContact CD1-CD 4.17Å; L69-K73 WeakPolarHBondContact O-CB 3.38Å; L69-K73 PolarHBondContact O-N 2.9Å; L71-K73 VanDerWaalsContact C-N 3.29Å; L71-K73 PolarHBondContact O-N 3.4Å; K73-E77 WeakPolarHBondContact O-CB 3.45Å; K73-E77 PolarHBondContact O-N 3.19Å |
| 74 | L | 95.1 | Very high | 94.1 | Very high | 57 Ų | 57 | 38.5 Ų | 38.5 | 30% | 0.298 | 18% | 0.182 | S | C | . | . | H | α-helix | trans | -63.1 | -54.9 | -179.5 | -178.9 | 63.5 | 0 | 0 | 0 | 111.5 | L29 I30 A70 L71 F78 | L29-L74 HydrophobicContact CD2-CD1 4.03Å; L29-L74 HydrophobicContact CG-CD1 3.86Å; I30-L74 HydrophobicContact CG1-CD1 4.35Å; A70-L74 WeakPolarHBondContact O-CB 3.37Å; A70-L74 PolarHBondContact O-N 3.14Å; L71-L74 PolarHBondContact O-N 3.34Å; L74-F78 VanDerWaalsContact O-CB 3.3Å; L74-F78 WeakPolarHBondContact O-CB 3.46Å; L74-F78 PolarHBondContact O-N 3.42Å |
| 75 | I | 96.1 | Very high | 94 | Very high | 70 Ų | 70 | 43.1 Ų | 43.1 | 36% | 0.359 | 21% | 0.21 | S | C | . | . | H | α-helix | trans | -71.7 | -49.1 | -176.7 | -61.4 | 169.1 | 0 | 0 | 0 | 110 | L71 F78 V79 L138 | L71-I75 WeakPolarHBondContact O-CB 3.31Å; L71-I75 WeakPolarHBondContact O-CG1 3.14Å; L71-I75 PolarHBondContact O-N 3.25Å; I75-F78 PolarHBondContact O-N 3.2Å; I75-V79 HydrophobicContact CG2-CG2 4.17Å; I75-V79 WeakPolarHBondContact O-CB 3.47Å; I75-V79 WeakPolarHBondContact O-CG2 3.25Å; I75-V79 PolarHBondContact O-N 3.22Å; I75-L138 HydrophobicContact CB-CD1 4.39Å; I75-L138 HydrophobicContact CB-CD2 4.01Å; I75-L138 HydrophobicContact CG2-CD1 3.9Å; I75-L138 HydrophobicContact CG2-CD2 3.96Å |
| 76 | G | 96.2 | Very high | 93.9 | Very high | 0 Ų | 0 | 46 Ų | 46 | 0% | 0 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -62.2 | -46.7 | -176.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | V72 F78 A80 F141 | V72-G76 WeakPolarHBondContact O-CA 3.45Å; V72-G76 PolarHBondContact O-N 3.09Å; G76-F78 PolarHBondContact O-N 3.44Å; G76-A80 WeakPolarHBondContact O-CB 3.45Å; G76-A80 PolarHBondContact O-N 3.43Å; G76-F141 WeakPolarHBondContact O-CE1 3.5Å |
| 77 | E | 94.6 | Very high | 93.7 | Very high | 9 Ų | 9 | 49.9 Ų | 49.9 | 4% | 0.042 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -65.8 | -41.6 | 179.1 | -161.7 | 170 | 165.7 | 0 | 0 | 110.7 | N17 I24 L29 K73 S81 F141 | N17-E77 WeakPolarHBondContact CB-OE1 3.42Å; N17-E77 PolarHBondContact N-OE1 2.92Å; N17-E77 PolarHBondContact ND2-OE1 2.88Å; I24-E77 HydrophobicContact CD1-CB 4.42Å; I24-E77 HydrophobicContact CD1-CG 3.78Å; I24-E77 WeakPolarHBondContact CD1-O 3.49Å; L29-E77 HydrophobicContact CD1-CB 4.13Å; L29-E77 HydrophobicContact CD1-CG 4.45Å; L29-E77 WeakPolarHBondContact CD1-OE2 3.04Å; L29-E77 HydrophobicContact CD2-CB 4.22Å; K73-E77 WeakPolarHBondContact O-CB 3.45Å; K73-E77 PolarHBondContact O-N 3.19Å; E77-S81 WeakPolarHBondContact O-CB 3.44Å; E77-S81 PolarHBondContact O-N 2.97Å; E77-S81 VanDerWaalsContact O-N 3.13Å; E77-F141 HydrophobicContact CB-CZ 4.27Å |
| 78 | F | 94.4 | Very high | 93.7 | Very high | 87 Ų | 87 | 48.6 Ų | 48.6 | 38% | 0.382 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -61.3 | -54 | 176.5 | -179 | -98.5 | 0 | 0 | 0 | 112.4 | L74 I75 G76 S81 | L74-F78 VanDerWaalsContact O-CB 3.3Å; L74-F78 WeakPolarHBondContact O-CB 3.46Å; L74-F78 PolarHBondContact O-N 3.42Å; I75-F78 PolarHBondContact O-N 3.2Å; G76-F78 PolarHBondContact O-N 3.44Å; F78-S81 PolarHBondContact O-N 3.18Å; F78-S81 PolarHBondContact O-OG 2.89Å |
| 79 | V | 95.2 | Very high | 93.8 | Very high | 51 Ų | 51 | 48.5 Ų | 48.5 | 31% | 0.309 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -64.2 | -46.1 | -178.7 | 173.7 | 0 | 0 | 0 | 0 | 110.9 | I75 S81 R82 L83 F142 | I75-V79 HydrophobicContact CG2-CG2 4.17Å; I75-V79 WeakPolarHBondContact O-CB 3.47Å; I75-V79 WeakPolarHBondContact O-CG2 3.25Å; I75-V79 PolarHBondContact O-N 3.22Å; V79-S81 PolarHBondContact O-N 3.46Å; V79-R82 PolarHBondContact O-N 3.23Å; V79-L83 HydrophobicContact CG1-CD1 4.37Å; V79-F142 HydrophobicContact CB-CE1 3.85Å; V79-F142 HydrophobicContact CB-CZ 3.73Å; V79-F142 HydrophobicContact CG1-CE1 3.76Å; V79-F142 HydrophobicContact CG1-CZ 3.58Å; V79-F142 HydrophobicContact CG2-CZ 4.48Å |
| 80 | A | 95.3 | Very high | 93.8 | Very high | 0 Ų | 0 | 48.4 Ų | 48.4 | 0% | 0 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -64.6 | -26 | -177.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | A18 G76 R82 L83 N89 F141 F142 T145 R149 | A18-A80 HydrophobicContact CB-CB 3.68Å; G76-A80 WeakPolarHBondContact O-CB 3.45Å; G76-A80 PolarHBondContact O-N 3.43Å; A80-R82 PolarHBondContact O-N 3.17Å; A80-L83 PolarHBondContact O-N 2.76Å; A80-N89 WeakPolarHBondContact CA-OD1 3.49Å; A80-N89 VanDerWaalsContact CB-OD1 3.29Å; A80-N89 WeakPolarHBondContact CB-OD1 3.37Å; A80-F141 HydrophobicContact CB-CE1 4.43Å; A80-F142 HydrophobicContact CB-CD1 4.03Å; A80-F142 HydrophobicContact CB-CE1 3.98Å; A80-T145 HydrophobicContact CB-CG2 4Å; A80-R149 PolarHBondContact O-NH2 3.42Å |
| 81 | S | 92.8 | Very high | 93.8 | Very high | 23 Ų | 23 | 53.9 Ų | 53.9 | 16% | 0.161 | 27% | 0.271 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -69.3 | -19.7 | 174.5 | 75.7 | 0 | 0 | 0 | 0 | 114.6 | I24 E77 F78 V79 H84 | I24-S81 WeakPolarHBondContact CD1-OG 3.33Å; E77-S81 WeakPolarHBondContact O-CB 3.44Å; E77-S81 PolarHBondContact O-N 2.97Å; E77-S81 VanDerWaalsContact O-N 3.13Å; F78-S81 PolarHBondContact O-N 3.18Å; F78-S81 PolarHBondContact O-OG 2.89Å; V79-S81 PolarHBondContact O-N 3.46Å; S81-H84 PolarHBondContact O-CE1 3.44Å; S81-H84 PolarHBondContact O-NE2 3.09Å; S81-H84 VanDerWaalsContact O-NE2 3.08Å |
| 82 | R | 92.9 | Very high | 93.9 | Very high | 169 Ų | 169 | 53.5 Ų | 53.5 | 64% | 0.638 | 27% | 0.271 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -88.7 | -22.4 | 178.6 | -55.7 | -53.9 | -176 | 105.9 | -0.7 | 112.5 | V79 A80 H84 | V79-R82 PolarHBondContact O-N 3.23Å; A80-R82 PolarHBondContact O-N 3.17Å; R82-H84 PolarHBondContact O-N 3.12Å |
| 83 | L | 92 | Very high | 93.9 | Very high | 50 Ų | 50 | 53.5 Ų | 53.5 | 26% | 0.262 | 27% | 0.27 | S | S | . | . | trans | -91.3 | 91.8 | -178.3 | -61.9 | 177 | 0 | 0 | 0 | 110.2 | V79 A80 A88 N89 V92 R149 | V79-L83 HydrophobicContact CG1-CD1 4.37Å; A80-L83 PolarHBondContact O-N 2.76Å; L83-A88 HydrophobicContact CB-CB 4.33Å; L83-N89 WeakPolarHBondContact CD1-OD1 3.26Å; L83-V92 HydrophobicContact CD1-CB 4.33Å; L83-V92 HydrophobicContact CD1-CG2 3.88Å; L83-R149 PolarHBondContact O-NH1 3.48Å; L83-R149 PolarHBondContact O-NH2 2.97Å | ||
| 84 | H | 87.2 | Confident | 94 | Very high | 124 Ų | 124 | 53.1 Ų | 53.1 | 57% | 0.574 | 27% | 0.271 | S | S | * | . | trans | -90.8 | -13.3 | -177.2 | -64.5 | -74.6 | 0 | 0 | 0 | 115.3 | W21 S81 R82 | W21-H84 AromaticContact CE3-ND1 3.73Å; W21-H84 WeakPolarHBondContact CH2-O 3.32Å; W21-H84 HydrophobicContact CZ3-CB 4.09Å; W21-H84 AromaticContact CZ3-ND1 3.37Å; W21-H84 WeakPolarHBondContact CZ3-ND1 3.27Å; S81-H84 PolarHBondContact O-CE1 3.44Å; S81-H84 PolarHBondContact O-NE2 3.09Å; S81-H84 VanDerWaalsContact O-NE2 3.08Å; R82-H84 PolarHBondContact O-N 3.12Å | ||
| 85 | V | 90.7 | Very high | 94.1 | Very high | 101 Ų | 101 | 53 Ų | 53 | 61% | 0.612 | 28% | 0.279 | S | S | * | . | S | Bend | trans | -67.8 | 137.4 | -179.6 | 178.7 | 0 | 0 | 0 | 0 | 109.8 | Y87 A88 | V85-Y87 PolarHBondContact O-N 3.23Å; V85-A88 HydrophobicContact CB-CB 3.94Å; V85-A88 HydrophobicContact CG1-CB 4.5Å; V85-A88 VanDerWaalsContact O-CB 3.27Å; V85-A88 WeakPolarHBondContact O-CB 3.27Å; V85-A88 PolarHBondContact O-N 3.44Å |
| 86 | P | 87.7 | Confident | 94.2 | Very high | 64 Ų | 64 | 51.6 Ų | 51.6 | 42% | 0.416 | 27% | 0.272 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -54.8 | 136.6 | 176.3 | -23.7 | 33.3 | 0 | 0 | 0 | 111.6 | A88 | P86-A88 PolarHBondContact O-N 3.18Å; P86-A88 VanDerWaalsContact O-N 3.09Å |
| 87 | Y | 91.2 | Very high | 94.2 | Very high | 89 Ų | 89 | 51.6 Ų | 51.6 | 35% | 0.349 | 27% | 0.272 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 64.2 | 3.7 | 179.4 | -48.9 | -71.3 | 0 | 0 | 0 | 116 | V85 N89 A90 I91 D146 | V85-Y87 PolarHBondContact O-N 3.23Å; Y87-N89 PolarHBondContact O-N 3.46Å; Y87-A90 PolarHBondContact O-N 2.7Å; Y87-I91 VanDerWaalsContact O-CG1 3.27Å; Y87-I91 WeakPolarHBondContact O-CG1 3.47Å; Y87-I91 PolarHBondContact O-N 3.01Å; Y87-D146 WeakPolarHBondContact CA-OD2 3.46Å |
| 88 | A | 94.9 | Very high | 94.2 | Very high | 16 Ų | 16 | 55.1 Ų | 55.1 | 13% | 0.132 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -66.2 | -35.1 | -179 | 0 | 0 | 0 | 0 | 0 | 113.6 | L83 V85 P86 V92 D146 | L83-A88 HydrophobicContact CB-CB 4.33Å; V85-A88 HydrophobicContact CB-CB 3.94Å; V85-A88 HydrophobicContact CG1-CB 4.5Å; V85-A88 VanDerWaalsContact O-CB 3.27Å; V85-A88 WeakPolarHBondContact O-CB 3.27Å; V85-A88 PolarHBondContact O-N 3.44Å; P86-A88 PolarHBondContact O-N 3.18Å; P86-A88 VanDerWaalsContact O-N 3.09Å; A88-V92 WeakPolarHBondContact O-CB 3.49Å; A88-V92 VanDerWaalsContact O-CG2 3.25Å; A88-V92 WeakPolarHBondContact O-CG2 3.37Å; A88-V92 PolarHBondContact O-N 3.15Å; A88-D146 PolarHBondContact N-OD2 3.38Å |
| 89 | N | 95.8 | Very high | 94.3 | Very high | 0 Ų | 0 | 53.9 Ų | 53.9 | 0% | 0 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -68.9 | -42.7 | 175.4 | -61.6 | -73.2 | 0 | 0 | 0 | 110.7 | A80 L83 Y87 I91 V92 G93 F142 D146 R149 | A80-N89 WeakPolarHBondContact CA-OD1 3.49Å; A80-N89 VanDerWaalsContact CB-OD1 3.29Å; A80-N89 WeakPolarHBondContact CB-OD1 3.37Å; L83-N89 WeakPolarHBondContact CD1-OD1 3.26Å; Y87-N89 PolarHBondContact O-N 3.46Å; N89-I91 VanDerWaalsContact C-N 3.31Å; N89-I91 PolarHBondContact O-N 3.18Å; N89-V92 CarbonylContact O-C 3.56Å; N89-V92 PolarHBondContact O-N 2.96Å; N89-G93 PolarHBondContact O-N 3.49Å; N89-F142 HydrophobicContact CB-CB 4.01Å; N89-F142 HydrophobicContact CB-CD1 4.31Å; N89-F142 WeakPolarHBondContact CB-O 3.4Å; N89-F142 VanDerWaalsContact O-CB 3.28Å; N89-F142 WeakPolarHBondContact O-CB 3.26Å; N89-D146 WeakPolarHBondContact CA-OD2 3.5Å; N89-D146 WeakPolarHBondContact CB-OD2 3.37Å; N89-D146 PolarHBondContact N-OD2 3.43Å; N89-D146 PolarHBondContact ND2-OD1 3.47Å; N89-R149 PolarHBondContact ND2-NH1 3.15Å; N89-R149 PolarHBondContact ND2-NH2 3.46Å |
| 90 | A | 95.4 | Very high | 94.2 | Very high | 12 Ų | 12 | 52 Ų | 52 | 10% | 0.099 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -60.6 | -43 | 178 | 0 | 0 | 0 | 0 | 0 | 111 | Y87 G93 V94 D146 | Y87-A90 PolarHBondContact O-N 2.7Å; A90-G93 PolarHBondContact O-N 2.69Å; A90-V94 WeakPolarHBondContact O-CG2 3.27Å; A90-V94 PolarHBondContact O-N 2.84Å; A90-D146 HydrophobicContact CB-CB 4.11Å; A90-D146 PolarHBondContact N-OD2 3.26Å |
| 91 | I | 96 | Very high | 94.2 | Very high | 115 Ų | 115 | 52.8 Ų | 52.8 | 59% | 0.59 | 29% | 0.288 | S | S | * | . | H | α-helix | trans | -60.9 | -47.9 | 174.5 | -66.5 | 164.4 | 0 | 0 | 0 | 110.8 | Y87 N89 G93 V94 A95 | Y87-I91 VanDerWaalsContact O-CG1 3.27Å; Y87-I91 WeakPolarHBondContact O-CG1 3.47Å; Y87-I91 PolarHBondContact O-N 3.01Å; N89-I91 VanDerWaalsContact C-N 3.31Å; N89-I91 PolarHBondContact O-N 3.18Å; I91-G93 VanDerWaalsContact C-N 3.31Å; I91-G93 PolarHBondContact O-N 2.92Å; I91-V94 PolarHBondContact O-N 3.44Å; I91-A95 WeakPolarHBondContact O-CB 3.39Å; I91-A95 PolarHBondContact O-N 3.32Å |
| 92 | V | 96.8 | Very high | 94.2 | Very high | 47 Ų | 47 | 56.3 Ų | 56.3 | 29% | 0.285 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -61.4 | -40.1 | 176.5 | 167.9 | 0 | 0 | 0 | 0 | 111.4 | L83 A88 N89 A95 I96 F142 | L83-V92 HydrophobicContact CD1-CB 4.33Å; L83-V92 HydrophobicContact CD1-CG2 3.88Å; A88-V92 WeakPolarHBondContact O-CB 3.49Å; A88-V92 VanDerWaalsContact O-CG2 3.25Å; A88-V92 WeakPolarHBondContact O-CG2 3.37Å; A88-V92 PolarHBondContact O-N 3.15Å; N89-V92 CarbonylContact O-C 3.56Å; N89-V92 PolarHBondContact O-N 2.96Å; V92-A95 PolarHBondContact O-N 2.96Å; V92-I96 HydrophobicContact CG1-CD1 3.7Å; V92-I96 HydrophobicContact CG1-CG1 4.32Å; V92-I96 WeakPolarHBondContact O-CB 3.25Å; V92-I96 WeakPolarHBondContact O-CG1 3.5Å; V92-I96 PolarHBondContact O-N 2.97Å; V92-F142 HydrophobicContact CG1-CD2 4.21Å; V92-F142 HydrophobicContact CG1-CE2 4.34Å |
| 93 | G | 97.1 | Very high | 94.2 | Very high | 0 Ų | 0 | 54.2 Ų | 54.2 | 0% | 0 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -63.9 | -46.1 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | N89 A90 I91 I96 A97 A139 | N89-G93 PolarHBondContact O-N 3.49Å; A90-G93 PolarHBondContact O-N 2.69Å; I91-G93 VanDerWaalsContact C-N 3.31Å; I91-G93 PolarHBondContact O-N 2.92Å; G93-I96 PolarHBondContact O-N 2.94Å; G93-A97 WeakPolarHBondContact O-CB 3.4Å; G93-A97 PolarHBondContact O-N 3.48Å; G93-A139 WeakPolarHBondContact O-CB 3.42Å |
| 94 | V | 96.8 | Very high | 94.1 | Very high | 32 Ų | 32 | 51.9 Ų | 51.9 | 19% | 0.194 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -61.6 | -44.4 | 174 | 173.4 | 0 | 0 | 0 | 0 | 110.7 | A90 I91 I96 A97 L98 I143 M175 F200 | A90-V94 WeakPolarHBondContact O-CG2 3.27Å; A90-V94 PolarHBondContact O-N 2.84Å; I91-V94 PolarHBondContact O-N 3.44Å; V94-I96 PolarHBondContact O-N 3.29Å; V94-A97 PolarHBondContact O-N 3.22Å; V94-L98 HydrophobicContact CG1-CD1 4.08Å; V94-L98 HydrophobicContact CG1-CG 4.44Å; V94-L98 WeakPolarHBondContact O-CG 3.49Å; V94-L98 PolarHBondContact O-N 3.32Å; V94-I143 HydrophobicContact CG2-CD1 4.41Å; V94-M175 HydrophobicContact CG2-CE 4.1Å; V94-F200 HydrophobicContact CB-CE1 4.46Å; V94-F200 HydrophobicContact CG1-CE1 4.28Å; V94-F200 HydrophobicContact CG1-CZ 4.21Å; V94-F200 HydrophobicContact CG2-CE1 4.12Å |
| 95 | A | 97.1 | Very high | 94.1 | Very high | 55 Ų | 55 | 50.8 Ų | 50.8 | 46% | 0.455 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -61 | -42.6 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | I91 V92 L98 A99 | I91-A95 WeakPolarHBondContact O-CB 3.39Å; I91-A95 PolarHBondContact O-N 3.32Å; V92-A95 PolarHBondContact O-N 2.96Å; A95-L98 PolarHBondContact O-N 2.93Å; A95-A99 VanDerWaalsContact O-CB 3.29Å; A95-A99 WeakPolarHBondContact O-CB 3.38Å; A95-A99 PolarHBondContact O-N 3.47Å |
| 96 | I | 97.1 | Very high | 93.8 | Very high | 40 Ų | 40 | 48.4 Ų | 48.4 | 21% | 0.205 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -63.1 | -44.9 | 174.6 | -70.4 | 166.7 | 0 | 0 | 0 | 110.6 | V92 G93 V94 L98 A99 V100 V135 A139 F142 | V92-I96 HydrophobicContact CG1-CD1 3.7Å; V92-I96 HydrophobicContact CG1-CG1 4.32Å; V92-I96 WeakPolarHBondContact O-CB 3.25Å; V92-I96 WeakPolarHBondContact O-CG1 3.5Å; V92-I96 PolarHBondContact O-N 2.97Å; G93-I96 PolarHBondContact O-N 2.94Å; V94-I96 PolarHBondContact O-N 3.29Å; I96-L98 VanDerWaalsContact C-N 3.33Å; I96-L98 PolarHBondContact O-N 3.2Å; I96-A99 PolarHBondContact O-N 2.86Å; I96-V100 HydrophobicContact CG2-CG2 4.3Å; I96-V100 WeakPolarHBondContact O-CB 2.98Å; I96-V100 VanDerWaalsContact O-CG2 3.3Å; I96-V100 WeakPolarHBondContact O-CG2 3.28Å; I96-V100 PolarHBondContact O-N 3.45Å; I96-V135 HydrophobicContact CG2-CG1 3.63Å; I96-V135 WeakPolarHBondContact CG2-O 3.49Å; I96-A139 HydrophobicContact CB-CB 4.22Å; I96-A139 HydrophobicContact CG2-CB 4.04Å; I96-F142 HydrophobicContact CD1-CD2 3.72Å; I96-F142 HydrophobicContact CD1-CE2 3.53Å |
| 97 | A | 97 | Very high | 93.8 | Very high | 0 Ų | 0 | 53.2 Ų | 53.2 | 0% | 0 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -59.9 | -43.7 | 179.1 | 0 | 0 | 0 | 0 | 0 | 111.8 | G93 V94 V100 Q101 A139 S196 V199 F200 | G93-A97 WeakPolarHBondContact O-CB 3.4Å; G93-A97 PolarHBondContact O-N 3.48Å; V94-A97 PolarHBondContact O-N 3.22Å; A97-V100 PolarHBondContact O-N 3.44Å; A97-Q101 PolarHBondContact O-N 3.3Å; A97-A139 HydrophobicContact CB-CB 4.08Å; A97-S196 WeakPolarHBondContact O-CB 3.39Å; A97-V199 HydrophobicContact CB-CB 4.18Å; A97-V199 HydrophobicContact CB-CG1 3.94Å; A97-V199 HydrophobicContact CB-CG2 4.4Å; A97-F200 HydrophobicContact CB-CE1 3.9Å; A97-F200 HydrophobicContact CB-CZ 3.82Å |
| 98 | L | 95.8 | Very high | 93.7 | Very high | 83 Ų | 83 | 51.1 Ų | 51.1 | 44% | 0.435 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -67.5 | -41.6 | 175.9 | -64.8 | 176 | 0 | 0 | 0 | 111.8 | V94 A95 I96 V100 Q101 V102 F200 | V94-L98 HydrophobicContact CG1-CD1 4.08Å; V94-L98 HydrophobicContact CG1-CG 4.44Å; V94-L98 WeakPolarHBondContact O-CG 3.49Å; V94-L98 PolarHBondContact O-N 3.32Å; A95-L98 PolarHBondContact O-N 2.93Å; I96-L98 VanDerWaalsContact C-N 3.33Å; I96-L98 PolarHBondContact O-N 3.2Å; L98-V100 VanDerWaalsContact C-N 3.33Å; L98-V100 PolarHBondContact O-N 3Å; L98-Q101 WeakPolarHBondContact O-CB 3.39Å; L98-Q101 PolarHBondContact O-N 3.3Å; L98-Q101 VanDerWaalsContact O-N 3.14Å; L98-V102 WeakPolarHBondContact O-CG2 3.45Å; L98-V102 PolarHBondContact O-N 3.43Å; L98-F200 HydrophobicContact CD2-CE2 4.24Å; L98-F200 HydrophobicContact CD2-CZ 4.22Å; L98-F200 HydrophobicContact CG-CZ 4.42Å |
| 99 | A | 95.4 | Very high | 93.3 | Very high | 60 Ų | 60 | 53.7 Ų | 53.7 | 50% | 0.496 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -62.5 | -39.9 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112 | A95 I96 Q101 V102 F103 | A95-A99 VanDerWaalsContact O-CB 3.29Å; A95-A99 WeakPolarHBondContact O-CB 3.38Å; A95-A99 PolarHBondContact O-N 3.47Å; I96-A99 PolarHBondContact O-N 2.86Å; A99-Q101 VanDerWaalsContact C-N 3.34Å; A99-V102 PolarHBondContact O-N 3.21Å; A99-F103 VanDerWaalsContact O-CB 3.31Å; A99-F103 WeakPolarHBondContact O-CB 3.19Å; A99-F103 PolarHBondContact O-N 3.35Å |
| 100 | V | 94.2 | Very high | 92.9 | Very high | 11 Ų | 11 | 60.6 Ų | 60.6 | 7% | 0.067 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -60.2 | -45.3 | 171.9 | 166.9 | 0 | 0 | 0 | 0 | 110.2 | I96 A97 L98 V102 F103 L104 V135 | I96-V100 HydrophobicContact CG2-CG2 4.3Å; I96-V100 WeakPolarHBondContact O-CB 2.98Å; I96-V100 VanDerWaalsContact O-CG2 3.3Å; I96-V100 WeakPolarHBondContact O-CG2 3.28Å; I96-V100 PolarHBondContact O-N 3.45Å; A97-V100 PolarHBondContact O-N 3.44Å; L98-V100 VanDerWaalsContact C-N 3.33Å; L98-V100 PolarHBondContact O-N 3Å; V100-V102 VanDerWaalsContact C-N 3.34Å; V100-V102 PolarHBondContact O-N 3.09Å; V100-F103 PolarHBondContact O-N 3.3Å; V100-L104 HydrophobicContact CG1-CD1 3.51Å; V100-L104 HydrophobicContact CG1-CG 4.18Å; V100-L104 WeakPolarHBondContact O-CB 3.39Å; V100-L104 WeakPolarHBondContact O-CD1 3.43Å; V100-L104 WeakPolarHBondContact O-CG 3.49Å; V100-L104 PolarHBondContact O-N 2.97Å; V100-V135 HydrophobicContact CG2-CB 3.92Å; V100-V135 HydrophobicContact CG2-CG1 3.39Å |
| 101 | Q | 94.2 | Very high | 92.6 | Very high | 18 Ų | 18 | 64.3 Ų | 64.3 | 8% | 0.084 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -62.3 | -40.8 | 178.8 | -174.4 | 55.9 | 42.6 | 0 | 0 | 112.9 | A97 L98 A99 L104 Q105 L187 S196 | A97-Q101 PolarHBondContact O-N 3.3Å; L98-Q101 WeakPolarHBondContact O-CB 3.39Å; L98-Q101 PolarHBondContact O-N 3.3Å; L98-Q101 VanDerWaalsContact O-N 3.14Å; A99-Q101 VanDerWaalsContact C-N 3.34Å; Q101-L104 PolarHBondContact O-N 3.13Å; Q101-Q105 WeakPolarHBondContact O-CG 3.35Å; Q101-L187 HydrophobicContact CG-CD2 4.37Å; Q101-L187 VanDerWaalsContact OE1-CD2 3.25Å; Q101-S196 WeakPolarHBondContact CB-OG 3.37Å; Q101-S196 WeakPolarHBondContact CG-OG 3.4Å; Q101-S196 PolarHBondContact OE1-OG 3.4Å |
| 102 | V | 92.9 | Very high | 92.2 | Very high | 96 Ų | 96 | 59 Ų | 59 | 58% | 0.582 | 32% | 0.322 | S | S | * | . | H | α-helix | trans | -66.5 | -43.2 | 175.8 | 174.2 | 0 | 0 | 0 | 0 | 110.7 | L98 A99 V100 L104 Q105 | L98-V102 WeakPolarHBondContact O-CG2 3.45Å; L98-V102 PolarHBondContact O-N 3.43Å; A99-V102 PolarHBondContact O-N 3.21Å; V100-V102 VanDerWaalsContact C-N 3.34Å; V100-V102 PolarHBondContact O-N 3.09Å; V102-L104 VanDerWaalsContact C-N 3.27Å; V102-L104 PolarHBondContact O-N 3.26Å; V102-Q105 WeakPolarHBondContact O-CB 3.39Å; V102-Q105 PolarHBondContact O-N 3.21Å; V102-Q105 VanDerWaalsContact O-N 3.14Å |
| 103 | F | 92.4 | Very high | 91.8 | Very high | 126 Ų | 126 | 60.6 Ų | 60.6 | 55% | 0.553 | 33% | 0.326 | S | S | * | . | H | α-helix | trans | -63.6 | -33 | 178.5 | -179.8 | -103.8 | 0 | 0 | 0 | 112.9 | A99 V100 Q105 V108 | A99-F103 VanDerWaalsContact O-CB 3.31Å; A99-F103 WeakPolarHBondContact O-CB 3.19Å; A99-F103 PolarHBondContact O-N 3.35Å; V100-F103 PolarHBondContact O-N 3.3Å; F103-Q105 VanDerWaalsContact C-N 3.25Å; F103-Q105 PolarHBondContact O-N 3.1Å; F103-V108 HydrophobicContact CD1-CG1 4.04Å; F103-V108 HydrophobicContact CE1-CG1 3.6Å; F103-V108 HydrophobicContact CZ-CG1 3.98Å; F103-V108 HydrophobicContact CZ-CG2 4.48Å; F103-V108 WeakPolarHBondContact O-CB 3.49Å |
| 104 | L | 90.8 | Very high | 91.3 | Very high | 1 Ų | 1 | 64 Ų | 64 | 1% | 0.005 | 34% | 0.341 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -77.2 | -5.2 | 177.6 | -68.8 | 168.8 | 0 | 0 | 0 | 113.1 | V100 Q101 V102 Q109 L112 V132 I193 N195 | V100-L104 HydrophobicContact CG1-CD1 3.51Å; V100-L104 HydrophobicContact CG1-CG 4.18Å; V100-L104 WeakPolarHBondContact O-CB 3.39Å; V100-L104 WeakPolarHBondContact O-CD1 3.43Å; V100-L104 WeakPolarHBondContact O-CG 3.49Å; V100-L104 PolarHBondContact O-N 2.97Å; Q101-L104 PolarHBondContact O-N 3.13Å; V102-L104 VanDerWaalsContact C-N 3.27Å; V102-L104 PolarHBondContact O-N 3.26Å; L104-Q109 WeakPolarHBondContact O-CB 3.38Å; L104-Q109 PolarHBondContact O-OE1 3.37Å; L104-L112 HydrophobicContact CD2-CD1 3.34Å; L104-V132 HydrophobicContact CD2-CG1 4.31Å; L104-I193 HydrophobicContact CD1-CB 4.22Å; L104-I193 HydrophobicContact CD1-CD1 3.75Å; L104-I193 HydrophobicContact CD1-CG1 3.93Å; L104-I193 HydrophobicContact CD2-CB 4.19Å; L104-I193 HydrophobicContact CD2-CD1 4.17Å; L104-I193 HydrophobicContact CG-CD1 4.47Å; L104-N195 HydrophobicContact CD1-CB 4.06Å |
| 105 | Q | 87.2 | Confident | 90.7 | Very high | 101 Ų | 101 | 67.6 Ų | 67.6 | 47% | 0.472 | 36% | 0.356 | S | S | . | . | S | Bend | trans | -73.9 | 134.1 | 178.6 | -73.7 | 171.6 | -19.7 | 0 | 0 | 111.6 | Q101 V102 F103 | Q101-Q105 WeakPolarHBondContact O-CG 3.35Å; V102-Q105 WeakPolarHBondContact O-CB 3.39Å; V102-Q105 PolarHBondContact O-N 3.21Å; V102-Q105 VanDerWaalsContact O-N 3.14Å; F103-Q105 VanDerWaalsContact C-N 3.25Å; F103-Q105 PolarHBondContact O-N 3.1Å |
| 106 | G | 84.9 | Confident | 90 | Very high | 50 Ų | 50 | 66.9 Ų | 66.9 | 52% | 0.515 | 35% | 0.347 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 84.5 | -140.7 | 174.5 | 0 | 0 | 0 | 0 | 0 | 114.2 | V108 Q109 | G106-V108 PolarHBondContact O-N 2.74Å; G106-V108 VanDerWaalsContact O-N 3.09Å; G106-Q109 PolarHBondContact O-N 2.8Å; G106-Q109 VanDerWaalsContact O-N 3.13Å |
| 107 | E | 87.1 | Confident | 89.2 | Confident | 165 Ų | 165 | 70.7 Ų | 70.7 | 77% | 0.771 | 37% | 0.372 | S | S | * | . | H | α-helix | trans | -57.7 | -26.5 | -172.1 | -62.4 | 179.1 | 177.6 | 0 | 0 | 113.7 | E110 Y111 | E107-E110 PolarHBondContact O-N 3.34Å; E107-Y111 WeakPolarHBondContact O-CB 3.48Å; E107-Y111 PolarHBondContact O-N 3.2Å |
| 108 | V | 88 | Confident | 88.6 | Confident | 45 Ų | 45 | 78.4 Ų | 78.4 | 27% | 0.273 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -65.3 | -41.5 | 179.5 | 178.4 | 0 | 0 | 0 | 0 | 111.3 | F103 G106 Y111 L112 | F103-V108 HydrophobicContact CD1-CG1 4.04Å; F103-V108 HydrophobicContact CE1-CG1 3.6Å; F103-V108 HydrophobicContact CZ-CG1 3.98Å; F103-V108 HydrophobicContact CZ-CG2 4.48Å; F103-V108 WeakPolarHBondContact O-CB 3.49Å; G106-V108 PolarHBondContact O-N 2.74Å; G106-V108 VanDerWaalsContact O-N 3.09Å; V108-Y111 PolarHBondContact O-N 3.33Å; V108-L112 HydrophobicContact CG1-CD1 4.17Å; V108-L112 VanDerWaalsContact O-CG 3.26Å; V108-L112 WeakPolarHBondContact O-CG 3.18Å; V108-L112 PolarHBondContact O-N 3.1Å |
| 109 | Q | 88.4 | Confident | 88.1 | Confident | 71 Ų | 71 | 75.3 Ų | 75.3 | 33% | 0.332 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -70.5 | -37.2 | 177.8 | 170.1 | 175.5 | -30.8 | 0 | 0 | 111.4 | L104 G106 L112 F113 | L104-Q109 WeakPolarHBondContact O-CB 3.38Å; L104-Q109 PolarHBondContact O-OE1 3.37Å; G106-Q109 PolarHBondContact O-N 2.8Å; G106-Q109 VanDerWaalsContact O-N 3.13Å; Q109-L112 PolarHBondContact O-N 3.23Å; Q109-F113 HydrophobicContact CG-CD2 3.48Å; Q109-F113 VanDerWaalsContact CG-CD2 3.48Å; Q109-F113 HydrophobicContact CG-CE2 3.39Å; Q109-F113 VanDerWaalsContact O-CD2 3.3Å; Q109-F113 WeakPolarHBondContact O-CD2 3.4Å; Q109-F113 PolarHBondContact O-N 2.97Å |
| 110 | E | 87.2 | Confident | 87.6 | Confident | 144 Ų | 144 | 79.5 Ų | 79.5 | 67% | 0.673 | 39% | 0.394 | S | S | * | . | H | α-helix | trans | -63.1 | -45.8 | 173.5 | -65.2 | -179.2 | -178.5 | 0 | 0 | 111.1 | E107 L112 F113 E114 | E107-E110 PolarHBondContact O-N 3.34Å; E110-L112 VanDerWaalsContact C-N 3.33Å; E110-L112 PolarHBondContact O-N 3.34Å; E110-F113 PolarHBondContact O-N 3.42Å; E110-E114 PolarHBondContact O-N 2.94Å |
| 111 | Y | 88 | Confident | 87.1 | Confident | 90 Ų | 90 | 88.7 Ų | 88.7 | 35% | 0.353 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -56 | -47.8 | 171.7 | 176.9 | -103 | 0 | 0 | 0 | 110.4 | E107 V108 F113 E114 R128 | E107-Y111 WeakPolarHBondContact O-CB 3.48Å; E107-Y111 PolarHBondContact O-N 3.2Å; V108-Y111 PolarHBondContact O-N 3.33Å; Y111-F113 VanDerWaalsContact C-N 3.32Å; Y111-F113 PolarHBondContact O-N 3.45Å; Y111-E114 PolarHBondContact O-N 3.34Å; Y111-R128 VanDerWaalsContact CZ-NH1 3.34Å; Y111-R128 PolarHBondContact O-NE 2.87Å; Y111-R128 VanDerWaalsContact O-NE 3.08Å; Y111-R128 PolarHBondContact O-NH1 3.45Å; Y111-R128 PolarHBondContact O-NH2 2.91Å |
| 112 | L | 88 | Confident | 86.8 | Confident | 4 Ų | 4 | 89.4 Ų | 89.4 | 2% | 0.021 | 45% | 0.445 | C | S | . | . | H | α-helix | trans | -64.6 | -33.8 | -178.9 | -71.4 | 168.9 | 0 | 0 | 0 | 113.7 | L104 V108 Q109 E110 R128 V132 I193 | L104-L112 HydrophobicContact CD2-CD1 3.34Å; V108-L112 HydrophobicContact CG1-CD1 4.17Å; V108-L112 VanDerWaalsContact O-CG 3.26Å; V108-L112 WeakPolarHBondContact O-CG 3.18Å; V108-L112 PolarHBondContact O-N 3.1Å; Q109-L112 PolarHBondContact O-N 3.23Å; E110-L112 VanDerWaalsContact C-N 3.33Å; E110-L112 PolarHBondContact O-N 3.34Å; L112-R128 HydrophobicContact CD2-CB 3.82Å; L112-R128 HydrophobicContact CD2-CG 3.79Å; L112-V132 HydrophobicContact CD1-CG1 4.15Å; L112-V132 HydrophobicContact CD1-CG2 4.32Å; L112-V132 HydrophobicContact CD2-CB 4.44Å; L112-V132 HydrophobicContact CD2-CG2 3.86Å; L112-I193 HydrophobicContact CB-CG2 4.24Å; L112-I193 HydrophobicContact CD1-CG2 3.96Å |
| 113 | F | 88 | Confident | 86.5 | Confident | 81 Ų | 81 | 91.3 Ų | 91.3 | 36% | 0.355 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -90.7 | -1.4 | -178.8 | -70.2 | -45.2 | 0 | 0 | 0 | 115.2 | Q109 E110 Y111 E115 I193 | Q109-F113 HydrophobicContact CG-CD2 3.48Å; Q109-F113 VanDerWaalsContact CG-CD2 3.48Å; Q109-F113 HydrophobicContact CG-CE2 3.39Å; Q109-F113 VanDerWaalsContact O-CD2 3.3Å; Q109-F113 WeakPolarHBondContact O-CD2 3.4Å; Q109-F113 PolarHBondContact O-N 2.97Å; E110-F113 PolarHBondContact O-N 3.42Å; Y111-F113 VanDerWaalsContact C-N 3.32Å; Y111-F113 PolarHBondContact O-N 3.45Å; F113-E115 PolarHBondContact O-N 3.33Å; F113-I193 HydrophobicContact CE1-CG2 4.27Å; F113-I193 HydrophobicContact CE2-CD1 4.3Å; F113-I193 HydrophobicContact CZ-CD1 3.87Å; F113-I193 HydrophobicContact CZ-CG2 4.34Å |
| 114 | E | 87 | Confident | 86.3 | Confident | 70 Ų | 70 | 90.7 Ų | 90.7 | 33% | 0.327 | 45% | 0.449 | S | S | . | . | S | Bend | trans | -59.1 | 136.5 | 174.7 | 158.4 | -164.7 | -125.1 | 0 | 0 | 110.9 | E110 Y111 R119 R128 | E110-E114 PolarHBondContact O-N 2.94Å; Y111-E114 PolarHBondContact O-N 3.34Å; E114-R119 PolarHBondContact O-NE 2.88Å; E114-R119 PolarHBondContact O-NH2 3.22Å; E114-R128 PolarHBondContact O-NH2 3.45Å; E114-R128 IonicContact OE2-CZ 3.42Å; E114-R128 IonicContact OE2-NH1 2.83Å; E114-R128 PolarHBondContact OE2-NH1 2.9Å; E114-R128 IonicContact OE2-NH2 2.9Å; E114-R128 PolarHBondContact OE2-NH2 2.87Å |
| 115 | E | 84.5 | Confident | 86.2 | Confident | 109 Ų | 109 | 90.9 Ų | 90.9 | 51% | 0.509 | 45% | 0.45 | S | S | . | . | trans | -59.8 | 144.5 | -172.4 | -60.9 | 179.4 | -177 | 0 | 0 | 111.3 | F113 T117 Y118 | F113-E115 PolarHBondContact O-N 3.33Å; E115-T117 PolarHBondContact O-N 2.88Å; E115-Y118 HydrophobicContact CB-CD2 3.95Å; E115-Y118 HydrophobicContact CB-CE2 4.32Å; E115-Y118 PolarHBondContact O-N 3.43Å; E115-Y118 WeakPolarHBondContact OE2-CE2 3.43Å | ||
| 116 | P | 81.7 | Confident | 86.4 | Confident | 40 Ų | 40 | 87.2 Ų | 87.2 | 26% | 0.26 | 43% | 0.434 | S | S | . | . | G | 310 helix | trans | -49.8 | -31.5 | -179 | -29.7 | 36.1 | 0 | 0 | 0 | 115.1 | V56 E57 Y118 R119 | V56-P116 HydrophobicContact CB-CB 4.41Å; V56-P116 HydrophobicContact CB-CG 4.02Å; V56-P116 HydrophobicContact CG1-CB 4.05Å; V56-P116 HydrophobicContact CG1-CG 3.94Å; E57-P116 HydrophobicContact CG-CG 4.17Å; P116-Y118 VanDerWaalsContact C-N 3.34Å; P116-Y118 PolarHBondContact O-N 3.28Å; P116-R119 PolarHBondContact O-N 3.35Å |
| 117 | T | 81.9 | Confident | 86.7 | Confident | 119 Ų | 119 | 85.1 Ų | 85.1 | 73% | 0.73 | 41% | 0.411 | S | S | * | . | G | 310 helix | trans | -65.6 | -32.1 | -178.4 | -46.1 | 0 | 0 | 0 | 0 | 113.5 | E115 | E115-T117 PolarHBondContact O-N 2.88Š|
| 118 | Y | 83.4 | Confident | 86.9 | Confident | 163 Ų | 163 | 77.3 Ų | 77.3 | 64% | 0.639 | 37% | 0.374 | S | S | * | . | G | 310 helix | trans | -93.7 | -3.4 | -175.7 | -59.7 | -68.9 | 0 | 0 | 0 | 113.3 | E115 P116 | E115-Y118 HydrophobicContact CB-CD2 3.95Å; E115-Y118 HydrophobicContact CB-CE2 4.32Å; E115-Y118 PolarHBondContact O-N 3.43Å; E115-Y118 WeakPolarHBondContact OE2-CE2 3.43Å; P116-Y118 VanDerWaalsContact C-N 3.34Å; P116-Y118 PolarHBondContact O-N 3.28Å |
| 119 | R | 85.8 | Confident | 87 | Confident | 18 Ų | 18 | 75.3 Ų | 75.3 | 7% | 0.068 | 36% | 0.362 | C | S | . | . | S | Bend | trans | -71.4 | 142.7 | -175.2 | -61.9 | -173.2 | -169.8 | -177.9 | -0.9 | 112.4 | E114 P116 L126 E129 | E114-R119 PolarHBondContact O-NE 2.88Å; E114-R119 PolarHBondContact O-NH2 3.22Å; P116-R119 PolarHBondContact O-N 3.35Å; R119-L126 HydrophobicContact CB-CD2 4.42Å; R119-E129 IonicContact CZ-OE1 2.63Å; R119-E129 IonicContact CZ-OE2 2.91Å; R119-E129 IonicContact NH1-OE1 3.01Å; R119-E129 PolarHBondContact NH1-OE1 3.45Å; R119-E129 IonicContact NH1-OE2 3.1Å; R119-E129 PolarHBondContact NH1-OE2 2.89Å; R119-E129 IonicContact NH2-OE1 2.78Å; R119-E129 PolarHBondContact NH2-OE1 3.32Å |
| 120 | E | 83.6 | Confident | 87.2 | Confident | 148 Ų | 148 | 71.9 Ų | 71.9 | 69% | 0.692 | 35% | 0.346 | S | S | * | . | trans | -60.1 | 144.6 | 166.8 | -62.2 | -177.9 | 174.3 | 0 | 0 | 110.7 | G122 S125 | E120-G122 PolarHBondContact O-N 2.73Å; E120-S125 PolarHBondContact N-OG 2.74Å; E120-S125 VanDerWaalsContact O-CB 3.23Å; E120-S125 WeakPolarHBondContact O-CB 3.38Å; E120-S125 PolarHBondContact O-OG 2.91Å | ||
| 121 | K | 84.3 | Confident | 87.5 | Confident | 204 Ų | 204 | 67.4 Ų | 67.4 | 89% | 0.887 | 33% | 0.326 | S | S | * | . | S | Bend | trans | -73.1 | 20.5 | -177.4 | -62 | -174.1 | 179.1 | -178.8 | 0 | 114.6 | ||
| 122 | G | 87.6 | Confident | 87.7 | Confident | 32 Ų | 32 | 64 Ų | 64 | 33% | 0.33 | 32% | 0.315 | S | S | . | . | S | Bend | trans | -79.8 | 145.5 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | E120 F124 S125 L126 | E120-G122 PolarHBondContact O-N 2.73Å; G122-F124 PolarHBondContact O-N 3.21Å; G122-S125 PolarHBondContact O-N 2.98Å; G122-L126 WeakPolarHBondContact O-CB 3.42Å; G122-L126 VanDerWaalsContact O-CG 3.32Å; G122-L126 WeakPolarHBondContact O-CG 3.45Å; G122-L126 PolarHBondContact O-N 2.77Å |
| 123 | L | 87.3 | Confident | 88 | Confident | 137 Ų | 137 | 64 Ų | 64 | 72% | 0.717 | 32% | 0.315 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -55.6 | -39.1 | 177.3 | -75.1 | 172.1 | 0 | 0 | 0 | 112.8 | N127 | L123-N127 WeakPolarHBondContact O-CB 3.46Å; L123-N127 PolarHBondContact O-N 3.44Å; L123-N127 PolarHBondContact O-ND2 3.11Å |
| 124 | F | 87.7 | Confident | 88.4 | Confident | 112 Ų | 112 | 60.6 Ų | 60.6 | 49% | 0.491 | 30% | 0.3 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -68.7 | -51 | 176.6 | -177.5 | -92.3 | 0 | 0 | 0 | 111.3 | G122 L126 N127 R128 I131 | G122-F124 PolarHBondContact O-N 3.21Å; F124-L126 VanDerWaalsContact C-N 3.3Å; F124-L126 PolarHBondContact O-N 3.39Å; F124-N127 CarbonylContact O-C 3.49Å; F124-N127 PolarHBondContact O-N 3.26Å; F124-R128 HydrophobicContact CE1-CB 4.31Å; F124-R128 VanDerWaalsContact O-CA 3.29Å; F124-R128 WeakPolarHBondContact O-CA 3.33Å; F124-R128 WeakPolarHBondContact O-CB 3.02Å; F124-R128 PolarHBondContact O-N 3.3Å; F124-I131 HydrophobicContact CD2-CD1 3.64Å; F124-I131 HydrophobicContact CD2-CG2 4.33Å; F124-I131 HydrophobicContact CE2-CB 4.35Å; F124-I131 HydrophobicContact CE2-CD1 4.12Å; F124-I131 HydrophobicContact CE2-CG2 3.79Å; F124-I131 HydrophobicContact CG-CD1 4.39Å |
| 125 | S | 89.4 | Confident | 88.9 | Confident | 5 Ų | 5 | 60.3 Ų | 60.3 | 4% | 0.035 | 30% | 0.304 | C | S | . | . | G | 310 helix | trans | -55.1 | -44 | 179.1 | 175.7 | 0 | 0 | 0 | 0 | 112.2 | E120 G122 N127 R128 | E120-S125 PolarHBondContact N-OG 2.74Å; E120-S125 VanDerWaalsContact O-CB 3.23Å; E120-S125 WeakPolarHBondContact O-CB 3.38Å; E120-S125 PolarHBondContact O-OG 2.91Å; G122-S125 PolarHBondContact O-N 2.98Å; S125-N127 PolarHBondContact O-N 3.42Å; S125-R128 WeakPolarHBondContact O-CD 3.34Å; S125-R128 WeakPolarHBondContact O-CG 3.28Å |
| 126 | L | 90.1 | Very high | 89.5 | Confident | 24 Ų | 24 | 55.1 Ų | 55.1 | 13% | 0.126 | 28% | 0.279 | C | S | . | . | G | 310 helix | trans | -71.3 | -16.3 | 179.1 | -67.2 | 173.6 | 0 | 0 | 0 | 114.1 | G60 M61 R119 G122 F124 | G60-L126 CarbonylContact C-O 3.54Å; G60-L126 WeakPolarHBondContact CA-O 3.32Å; M61-L126 HydrophobicContact CB-CB 4.19Å; M61-L126 HydrophobicContact CE-CD2 3.87Å; M61-L126 PolarHBondContact N-O 2.78Å; M61-L126 HydrophobicContact SD-CD1 4.01Å; M61-L126 HydrophobicContact SD-CD2 4.28Å; R119-L126 HydrophobicContact CB-CD2 4.42Å; G122-L126 WeakPolarHBondContact O-CB 3.42Å; G122-L126 VanDerWaalsContact O-CG 3.32Å; G122-L126 WeakPolarHBondContact O-CG 3.45Å; G122-L126 PolarHBondContact O-N 2.77Å; F124-L126 VanDerWaalsContact C-N 3.3Å; F124-L126 PolarHBondContact O-N 3.39Å |
| 127 | N | 92 | Very high | 90.2 | Very high | 7 Ų | 7 | 53.4 Ų | 53.4 | 4% | 0.037 | 27% | 0.268 | C | S | . | . | G | 310 helix | trans | -128.4 | 18.9 | -175 | -60.7 | -71.2 | 0 | 0 | 0 | 113.6 | M61 H62 W63 L123 F124 S125 E129 G130 I131 | M61-N127 PolarHBondContact N-OD1 3.45Å; H62-N127 WeakPolarHBondContact CA-OD1 3.38Å; H62-N127 PolarHBondContact N-OD1 3.07Å; W63-N127 HydrophobicContact CB-CB 4.02Å; W63-N127 WeakPolarHBondContact CB-OD1 2.83Å; W63-N127 HydrophobicContact CE3-CB 4.34Å; W63-N127 PolarHBondContact N-OD1 2.93Å; L123-N127 WeakPolarHBondContact O-CB 3.46Å; L123-N127 PolarHBondContact O-N 3.44Å; L123-N127 PolarHBondContact O-ND2 3.11Å; F124-N127 CarbonylContact O-C 3.49Å; F124-N127 PolarHBondContact O-N 3.26Å; S125-N127 PolarHBondContact O-N 3.42Å; N127-E129 VanDerWaalsContact C-N 3.32Å; N127-E129 PolarHBondContact O-N 3.42Å; N127-G130 PolarHBondContact O-N 3.41Å; N127-I131 HydrophobicContact CB-CD1 4.08Å; N127-I131 HydrophobicContact CB-CG1 4.47Å; N127-I131 VanDerWaalsContact O-CG1 3.3Å; N127-I131 WeakPolarHBondContact O-CG1 3.38Å; N127-I131 PolarHBondContact O-N 3.18Å; N127-I131 VanDerWaalsContact O-N 3.09Å |
| 128 | R | 91.5 | Very high | 91 | Very high | 0 Ų | 0 | 48.6 Ų | 48.6 | 0% | 0 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -61.6 | -38.4 | -167.5 | 58.9 | -172.4 | 178.1 | -159.7 | -6.2 | 112.6 | Y111 L112 E114 F124 S125 I131 V132 | Y111-R128 VanDerWaalsContact CZ-NH1 3.34Å; Y111-R128 PolarHBondContact O-NE 2.87Å; Y111-R128 VanDerWaalsContact O-NE 3.08Å; Y111-R128 PolarHBondContact O-NH1 3.45Å; Y111-R128 PolarHBondContact O-NH2 2.91Å; L112-R128 HydrophobicContact CD2-CB 3.82Å; L112-R128 HydrophobicContact CD2-CG 3.79Å; E114-R128 PolarHBondContact O-NH2 3.45Å; E114-R128 IonicContact OE2-CZ 3.42Å; E114-R128 IonicContact OE2-NH1 2.83Å; E114-R128 PolarHBondContact OE2-NH1 2.9Å; E114-R128 IonicContact OE2-NH2 2.9Å; E114-R128 PolarHBondContact OE2-NH2 2.87Å; F124-R128 HydrophobicContact CE1-CB 4.31Å; F124-R128 VanDerWaalsContact O-CA 3.29Å; F124-R128 WeakPolarHBondContact O-CA 3.33Å; F124-R128 WeakPolarHBondContact O-CB 3.02Å; F124-R128 PolarHBondContact O-N 3.3Å; S125-R128 WeakPolarHBondContact O-CD 3.34Å; S125-R128 WeakPolarHBondContact O-CG 3.28Å; R128-I131 PolarHBondContact O-N 3.18Å; R128-V132 WeakPolarHBondContact O-CB 3.37Å; R128-V132 VanDerWaalsContact O-CG2 3.31Å; R128-V132 WeakPolarHBondContact O-CG2 3.22Å; R128-V132 PolarHBondContact O-N 2.88Å |
| 129 | E | 90.9 | Very high | 91.7 | Very high | 3 Ų | 3 | 40.8 Ų | 40.8 | 1% | 0.014 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -63.5 | -51.1 | 178.9 | -58.1 | 96.9 | 131.7 | 0 | 0 | 111.3 | R119 N127 I131 V132 S133 R192 | R119-E129 IonicContact CZ-OE1 2.63Å; R119-E129 IonicContact CZ-OE2 2.91Å; R119-E129 IonicContact NH1-OE1 3.01Å; R119-E129 PolarHBondContact NH1-OE1 3.45Å; R119-E129 IonicContact NH1-OE2 3.1Å; R119-E129 PolarHBondContact NH1-OE2 2.89Å; R119-E129 IonicContact NH2-OE1 2.78Å; R119-E129 PolarHBondContact NH2-OE1 3.32Å; N127-E129 VanDerWaalsContact C-N 3.32Å; N127-E129 PolarHBondContact O-N 3.42Å; E129-I131 VanDerWaalsContact C-N 3.29Å; E129-I131 PolarHBondContact O-N 3.16Å; E129-V132 PolarHBondContact O-N 3.09Å; E129-S133 VanDerWaalsContact O-CB 3.26Å; E129-S133 WeakPolarHBondContact O-CB 3.46Å; E129-S133 PolarHBondContact O-N 3.29Å; E129-R192 CarbonylContact C-O 3.58Å |
| 130 | G | 91.6 | Very high | 92.2 | Very high | 0 Ų | 0 | 40 Ų | 40 | 0% | 0 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -62 | -38.2 | 179.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | Y59 N127 S133 V134 | Y59-G130 WeakPolarHBondContact O-CA 3.42Å; Y59-G130 PolarHBondContact O-N 3.39Å; N127-G130 PolarHBondContact O-N 3.41Å; G130-S133 PolarHBondContact O-OG 3.29Å; G130-V134 WeakPolarHBondContact O-CG2 3.43Å |
| 131 | I | 93.2 | Very high | 92.9 | Very high | 49 Ų | 49 | 33 Ų | 33 | 25% | 0.251 | 17% | 0.172 | S | C | . | . | H | α-helix | trans | -69.1 | -49.8 | 177.8 | -64.3 | 166.8 | 0 | 0 | 0 | 110.9 | W63 F124 N127 R128 E129 S133 V134 | W63-I131 HydrophobicContact CD2-CG1 4.41Å; W63-I131 HydrophobicContact CE3-CG1 4Å; W63-I131 HydrophobicContact CH2-CG1 3.98Å; W63-I131 HydrophobicContact CZ2-CG1 4.41Å; W63-I131 HydrophobicContact CZ3-CD1 4.4Å; W63-I131 HydrophobicContact CZ3-CG1 3.77Å; F124-I131 HydrophobicContact CD2-CD1 3.64Å; F124-I131 HydrophobicContact CD2-CG2 4.33Å; F124-I131 HydrophobicContact CE2-CB 4.35Å; F124-I131 HydrophobicContact CE2-CD1 4.12Å; F124-I131 HydrophobicContact CE2-CG2 3.79Å; F124-I131 HydrophobicContact CG-CD1 4.39Å; N127-I131 HydrophobicContact CB-CD1 4.08Å; N127-I131 HydrophobicContact CB-CG1 4.47Å; N127-I131 VanDerWaalsContact O-CG1 3.3Å; N127-I131 WeakPolarHBondContact O-CG1 3.38Å; N127-I131 PolarHBondContact O-N 3.18Å; N127-I131 VanDerWaalsContact O-N 3.09Å; R128-I131 PolarHBondContact O-N 3.18Å; E129-I131 VanDerWaalsContact C-N 3.29Å; E129-I131 PolarHBondContact O-N 3.16Å; I131-S133 VanDerWaalsContact C-N 3.29Å; I131-S133 PolarHBondContact O-N 3.5Å; I131-V134 VanDerWaalsContact O-CB 3.25Å; I131-V134 WeakPolarHBondContact O-CB 3.37Å; I131-V134 WeakPolarHBondContact O-CG2 3.25Å; I131-V134 PolarHBondContact O-N 2.81Å; I131-V134 VanDerWaalsContact O-N 3.14Å |
| 132 | V | 93.1 | Very high | 93.6 | Very high | 20 Ų | 20 | 23.5 Ų | 23.5 | 12% | 0.121 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -62.4 | -38.7 | 178.5 | 171.1 | 0 | 0 | 0 | 0 | 111 | L104 L112 R128 E129 V134 V135 | L104-V132 HydrophobicContact CD2-CG1 4.31Å; L112-V132 HydrophobicContact CD1-CG1 4.15Å; L112-V132 HydrophobicContact CD1-CG2 4.32Å; L112-V132 HydrophobicContact CD2-CB 4.44Å; L112-V132 HydrophobicContact CD2-CG2 3.86Å; R128-V132 WeakPolarHBondContact O-CB 3.37Å; R128-V132 VanDerWaalsContact O-CG2 3.31Å; R128-V132 WeakPolarHBondContact O-CG2 3.22Å; R128-V132 PolarHBondContact O-N 2.88Å; E129-V132 PolarHBondContact O-N 3.09Å; V132-V134 PolarHBondContact O-N 3.47Å; V132-V134 VanDerWaalsContact O-N 3.08Å; V132-V135 PolarHBondContact O-N 3.24Å |
| 133 | S | 94.4 | Very high | 94 | Very high | 3 Ų | 3 | 22.1 Ų | 22.1 | 2% | 0.021 | 12% | 0.115 | C | C | . | . | H | α-helix | trans | -59.1 | -24 | 177.5 | 81.3 | 0 | 0 | 0 | 0 | 113.6 | E129 G130 I131 V135 G136 C137 | E129-S133 VanDerWaalsContact O-CB 3.26Å; E129-S133 WeakPolarHBondContact O-CB 3.46Å; E129-S133 PolarHBondContact O-N 3.29Å; G130-S133 PolarHBondContact O-OG 3.29Å; I131-S133 VanDerWaalsContact C-N 3.29Å; I131-S133 PolarHBondContact O-N 3.5Å; S133-V135 PolarHBondContact O-N 3.31Å; S133-G136 PolarHBondContact O-N 3.3Å; S133-C137 WeakPolarHBondContact O-CB 3.39Å; S133-C137 PolarHBondContact O-N 3.43Å; S133-C137 PolarHBondContact O-SG 3.3Å; S133-C137 VanDerWaalsContact O-SG 3.33Å |
| 134 | V | 96.3 | Very high | 94.5 | Very high | 9 Ų | 9 | 15.6 Ų | 15.6 | 6% | 0.055 | 8% | 0.081 | C | C | . | . | H | α-helix | trans | -57.7 | -38.8 | 176.6 | 175.8 | 0 | 0 | 0 | 0 | 110.3 | W63 T68 L71 V72 G130 I131 V132 C137 L138 | W63-V134 HydrophobicContact CZ2-CG2 4.07Å; T68-V134 HydrophobicContact CG2-CG2 4.21Å; L71-V134 HydrophobicContact CB-CG1 4.02Å; L71-V134 HydrophobicContact CB-CG2 4.46Å; L71-V134 HydrophobicContact CD1-CG2 4.13Å; V72-V134 HydrophobicContact CG2-CG1 4.08Å; G130-V134 WeakPolarHBondContact O-CG2 3.43Å; I131-V134 VanDerWaalsContact O-CB 3.25Å; I131-V134 WeakPolarHBondContact O-CB 3.37Å; I131-V134 WeakPolarHBondContact O-CG2 3.25Å; I131-V134 PolarHBondContact O-N 2.81Å; I131-V134 VanDerWaalsContact O-N 3.14Å; V132-V134 PolarHBondContact O-N 3.47Å; V132-V134 VanDerWaalsContact O-N 3.08Å; V134-C137 PolarHBondContact O-N 2.9Å; V134-L138 HydrophobicContact CG1-CD1 4.2Å; V134-L138 HydrophobicContact CG1-CG 4.45Å; V134-L138 WeakPolarHBondContact O-CG 3.33Å; V134-L138 PolarHBondContact O-N 2.74Å |
| 135 | V | 96.7 | Very high | 95 | Very high | 65 Ų | 65 | 10.2 Ų | 10.2 | 39% | 0.394 | 6% | 0.058 | S | C | . | . | H | α-helix | trans | -68.1 | -45.9 | -177.7 | -171.7 | 0 | 0 | 0 | 0 | 110.7 | I96 V100 V132 S133 L138 A139 | I96-V135 HydrophobicContact CG2-CG1 3.63Å; I96-V135 WeakPolarHBondContact CG2-O 3.49Å; V100-V135 HydrophobicContact CG2-CB 3.92Å; V100-V135 HydrophobicContact CG2-CG1 3.39Å; V132-V135 PolarHBondContact O-N 3.24Å; S133-V135 PolarHBondContact O-N 3.31Å; V135-L138 WeakPolarHBondContact O-CB 3.35Å; V135-L138 PolarHBondContact O-N 2.97Å; V135-A139 PolarHBondContact O-N 3.13Å |
| 136 | G | 96.4 | Very high | 95.2 | Very high | 0 Ų | 0 | 10.3 Ų | 10.3 | 0% | 0 | 6% | 0.058 | C | C | . | . | H | α-helix | trans | -64.1 | -38.9 | 172.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | S133 L138 A139 I140 A194 V199 | S133-G136 PolarHBondContact O-N 3.3Å; G136-L138 VanDerWaalsContact C-N 3.33Å; G136-L138 PolarHBondContact O-N 3.22Å; G136-A139 WeakPolarHBondContact O-CB 3.26Å; G136-A139 PolarHBondContact O-N 3.41Å; G136-I140 PolarHBondContact O-N 3.07Å; G136-A194 WeakPolarHBondContact CA-O 3.37Å; G136-V199 WeakPolarHBondContact O-CG2 3.08Å |
| 137 | C | 97.3 | Very high | 95.5 | Very high | 4 Ų | 4 | 9.2 Ų | 9.2 | 3% | 0.027 | 5% | 0.052 | C | C | . | . | H | α-helix | trans | -65.4 | -33 | 174.1 | -71.1 | 0 | 0 | 0 | 0 | 113.1 | V9 T68 V72 S133 V134 A139 I140 F141 | V9-C137 HydrophobicContact CG1-CB 4.21Å; V9-C137 VanDerWaalsContact CG1-O 3.27Å; V9-C137 WeakPolarHBondContact CG1-O 3.34Å; V9-C137 HydrophobicContact CG2-CB 4.41Å; T68-C137 HydrophobicContact CG2-CB 4.23Å; V72-C137 HydrophobicContact CG2-CB 3.49Å; V72-C137 VanDerWaalsContact CG2-CB 3.49Å; S133-C137 WeakPolarHBondContact O-CB 3.39Å; S133-C137 PolarHBondContact O-N 3.43Å; S133-C137 PolarHBondContact O-SG 3.3Å; S133-C137 VanDerWaalsContact O-SG 3.33Å; V134-C137 PolarHBondContact O-N 2.9Å; C137-A139 VanDerWaalsContact C-N 3.31Å; C137-I140 PolarHBondContact O-N 3.06Å; C137-F141 PolarHBondContact O-N 3.25Å |
| 138 | L | 97.8 | Very high | 95.6 | Very high | 17 Ų | 17 | 8.9 Ų | 8.9 | 9% | 0.089 | 5% | 0.05 | C | C | . | . | H | α-helix | trans | -62.7 | -39 | 172.1 | -78.3 | 167.5 | 0 | 0 | 0 | 111.4 | V72 I75 V134 V135 G136 I140 F141 F142 | V72-L138 HydrophobicContact CB-CD2 4.49Å; V72-L138 HydrophobicContact CG1-CD2 4.26Å; V72-L138 HydrophobicContact CG2-CG 4.42Å; I75-L138 HydrophobicContact CB-CD1 4.39Å; I75-L138 HydrophobicContact CB-CD2 4.01Å; I75-L138 HydrophobicContact CG2-CD1 3.9Å; I75-L138 HydrophobicContact CG2-CD2 3.96Å; V134-L138 HydrophobicContact CG1-CD1 4.2Å; V134-L138 HydrophobicContact CG1-CG 4.45Å; V134-L138 WeakPolarHBondContact O-CG 3.33Å; V134-L138 PolarHBondContact O-N 2.74Å; V135-L138 WeakPolarHBondContact O-CB 3.35Å; V135-L138 PolarHBondContact O-N 2.97Å; G136-L138 VanDerWaalsContact C-N 3.33Å; G136-L138 PolarHBondContact O-N 3.22Å; L138-I140 PolarHBondContact O-N 3.37Å; L138-F141 WeakPolarHBondContact O-CB 3.44Å; L138-F141 PolarHBondContact O-N 2.97Å; L138-F142 HydrophobicContact CB-CD2 4.45Å; L138-F142 HydrophobicContact CB-CE2 4.07Å; L138-F142 HydrophobicContact CD2-CE2 4.47Å; L138-F142 HydrophobicContact CD2-CZ 4.47Å; L138-F142 WeakPolarHBondContact O-CD2 3.49Å; L138-F142 WeakPolarHBondContact O-CG 3.17Å; L138-F142 PolarHBondContact O-N 3.37Å |
| 139 | A | 97.9 | Very high | 95.7 | Very high | 0 Ų | 0 | 9.4 Ų | 9.4 | 0% | 0 | 5% | 0.052 | C | C | . | . | H | α-helix | trans | -58.8 | -46.3 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | G93 I96 A97 V135 G136 C137 F141 F142 I143 V199 | G93-A139 WeakPolarHBondContact O-CB 3.42Å; I96-A139 HydrophobicContact CB-CB 4.22Å; I96-A139 HydrophobicContact CG2-CB 4.04Å; A97-A139 HydrophobicContact CB-CB 4.08Å; V135-A139 PolarHBondContact O-N 3.13Å; G136-A139 WeakPolarHBondContact O-CB 3.26Å; G136-A139 PolarHBondContact O-N 3.41Å; C137-A139 VanDerWaalsContact C-N 3.31Å; A139-F141 VanDerWaalsContact C-N 3.34Å; A139-F141 PolarHBondContact O-N 3.12Å; A139-F142 PolarHBondContact O-N 2.82Å; A139-I143 WeakPolarHBondContact O-CG1 3.04Å; A139-I143 PolarHBondContact O-N 3.44Å; A139-I143 VanDerWaalsContact O-N 3.1Å; A139-V199 HydrophobicContact CB-CG1 3.82Å; A139-V199 HydrophobicContact CB-CG2 4.27Å |
| 140 | I | 98.1 | Very high | 95.7 | Very high | 0 Ų | 0 | 9.6 Ų | 9.6 | 0% | 0 | 5% | 0.053 | C | C | . | . | H | α-helix | trans | -58.2 | -46.7 | 174.5 | -60.3 | 170.7 | 0 | 0 | 0 | 110.5 | V9 F10 G136 C137 L138 F142 I143 A144 Y198 V199 I202 | V9-I140 HydrophobicContact CB-CG2 4.37Å; V9-I140 HydrophobicContact CG1-CB 4.03Å; V9-I140 HydrophobicContact CG1-CG2 4Å; F10-I140 HydrophobicContact CB-CG2 3.83Å; F10-I140 HydrophobicContact CD2-CG2 4.08Å; F10-I140 HydrophobicContact CG-CG2 4.47Å; G136-I140 PolarHBondContact O-N 3.07Å; C137-I140 PolarHBondContact O-N 3.06Å; L138-I140 PolarHBondContact O-N 3.37Å; I140-F142 VanDerWaalsContact C-N 3.34Å; I140-F142 PolarHBondContact O-N 3Å; I140-I143 PolarHBondContact O-N 3Å; I140-A144 WeakPolarHBondContact O-CB 3.22Å; I140-A144 PolarHBondContact O-N 3.44Å; I140-Y198 HydrophobicContact CD1-CD1 4.34Å; I140-Y198 HydrophobicContact CD1-CE1 3.86Å; I140-V199 HydrophobicContact CD1-CG2 4.46Å; I140-V199 HydrophobicContact CG1-CB 4.19Å; I140-V199 HydrophobicContact CG1-CG1 3.85Å; I140-V199 HydrophobicContact CG1-CG2 4.09Å; I140-I202 HydrophobicContact CD1-CB 4.19Å; I140-I202 HydrophobicContact CD1-CG1 4.45Å; I140-I202 HydrophobicContact CD1-CG2 4.05Å; I140-I202 HydrophobicContact CG2-CG2 4.04Å |
| 141 | F | 98 | Very high | 95.6 | Very high | 2 Ų | 2 | 12 Ų | 12 | 1% | 0.009 | 7% | 0.066 | C | C | . | . | H | α-helix | trans | -59.9 | -42.7 | -179.8 | -176.6 | -82 | 0 | 0 | 0 | 112.3 | V9 N12 V72 G76 E77 A80 C137 L138 A139 A144 T145 | V9-F141 HydrophobicContact CG1-CB 4.22Å; N12-F141 HydrophobicContact CB-CE2 4.31Å; V72-F141 HydrophobicContact CG1-CB 3.81Å; V72-F141 HydrophobicContact CG1-CD2 3.91Å; V72-F141 HydrophobicContact CG1-CG 4.08Å; G76-F141 WeakPolarHBondContact O-CE1 3.5Å; E77-F141 HydrophobicContact CB-CZ 4.27Å; A80-F141 HydrophobicContact CB-CE1 4.43Å; C137-F141 PolarHBondContact O-N 3.25Å; L138-F141 WeakPolarHBondContact O-CB 3.44Å; L138-F141 PolarHBondContact O-N 2.97Å; A139-F141 VanDerWaalsContact C-N 3.34Å; A139-F141 PolarHBondContact O-N 3.12Å; F141-A144 PolarHBondContact O-N 3.42Å; F141-T145 WeakPolarHBondContact CE1-OG1 3.32Å; F141-T145 WeakPolarHBondContact O-CB 3.42Å; F141-T145 PolarHBondContact O-N 2.99Å; F141-T145 PolarHBondContact O-OG1 3Å |
| 142 | F | 98 | Very high | 95.4 | Very high | 5 Ų | 5 | 12.9 Ų | 12.9 | 2% | 0.022 | 7% | 0.067 | C | C | . | . | H | α-helix | trans | -68.9 | -43.6 | -179.5 | -70.5 | -50.7 | 0 | 0 | 0 | 112.6 | V79 A80 N89 V92 I96 L138 A139 I140 A144 T145 D146 | V79-F142 HydrophobicContact CB-CE1 3.85Å; V79-F142 HydrophobicContact CB-CZ 3.73Å; V79-F142 HydrophobicContact CG1-CE1 3.76Å; V79-F142 HydrophobicContact CG1-CZ 3.58Å; V79-F142 HydrophobicContact CG2-CZ 4.48Å; A80-F142 HydrophobicContact CB-CD1 4.03Å; A80-F142 HydrophobicContact CB-CE1 3.98Å; N89-F142 HydrophobicContact CB-CB 4.01Å; N89-F142 HydrophobicContact CB-CD1 4.31Å; N89-F142 WeakPolarHBondContact CB-O 3.4Å; N89-F142 VanDerWaalsContact O-CB 3.28Å; N89-F142 WeakPolarHBondContact O-CB 3.26Å; V92-F142 HydrophobicContact CG1-CD2 4.21Å; V92-F142 HydrophobicContact CG1-CE2 4.34Å; I96-F142 HydrophobicContact CD1-CD2 3.72Å; I96-F142 HydrophobicContact CD1-CE2 3.53Å; L138-F142 HydrophobicContact CB-CD2 4.45Å; L138-F142 HydrophobicContact CB-CE2 4.07Å; L138-F142 HydrophobicContact CD2-CE2 4.47Å; L138-F142 HydrophobicContact CD2-CZ 4.47Å; L138-F142 WeakPolarHBondContact O-CD2 3.49Å; L138-F142 WeakPolarHBondContact O-CG 3.17Å; L138-F142 PolarHBondContact O-N 3.37Å; A139-F142 PolarHBondContact O-N 2.82Å; I140-F142 VanDerWaalsContact C-N 3.34Å; I140-F142 PolarHBondContact O-N 3Å; F142-A144 VanDerWaalsContact C-N 3.31Å; F142-A144 PolarHBondContact O-N 2.79Å; F142-T145 PolarHBondContact O-N 3.18Å; F142-D146 PolarHBondContact O-N 3.45Å |
| 143 | I | 97.5 | Very high | 95 | Very high | 2 Ų | 2 | 15.2 Ų | 15.2 | 1% | 0.01 | 7% | 0.073 | C | C | . | . | H | α-helix | trans | -56.5 | -49.6 | 173 | -66.1 | 167.1 | 0 | 0 | 0 | 109.7 | F10 V94 A139 I140 T145 D146 V147 V199 A203 | F10-I143 HydrophobicContact CE2-CG2 4.39Å; V94-I143 HydrophobicContact CG2-CD1 4.41Å; A139-I143 WeakPolarHBondContact O-CG1 3.04Å; A139-I143 PolarHBondContact O-N 3.44Å; A139-I143 VanDerWaalsContact O-N 3.1Å; I140-I143 PolarHBondContact O-N 3Å; I143-T145 VanDerWaalsContact C-N 3.29Å; I143-T145 PolarHBondContact O-N 3.12Å; I143-D146 PolarHBondContact O-N 3.2Å; I143-V147 WeakPolarHBondContact O-CG2 3.33Å; I143-V147 PolarHBondContact O-N 3.17Å; I143-V199 HydrophobicContact CD1-CG1 4.13Å; I143-A203 HydrophobicContact CD1-CB 4.39Å; I143-A203 HydrophobicContact CG2-CB 4.24Å |
| 144 | A | 97.7 | Very high | 94 | Very high | 0 Ų | 0 | 15.8 Ų | 15.8 | 0% | 0 | 8% | 0.077 | C | C | . | . | H | α-helix | trans | -63.8 | -32.4 | -179.9 | 0 | 0 | 0 | 0 | 0 | 113.6 | F10 L14 I140 F141 F142 D146 V147 G148 | F10-A144 HydrophobicContact CB-CB 4.25Å; F10-A144 HydrophobicContact CD1-CB 3.84Å; F10-A144 HydrophobicContact CD2-CB 3.56Å; F10-A144 HydrophobicContact CE1-CB 4.03Å; F10-A144 HydrophobicContact CE2-CB 3.75Å; F10-A144 HydrophobicContact CG-CB 3.6Å; F10-A144 HydrophobicContact CZ-CB 3.99Å; F10-A144 WeakPolarHBondContact O-CB 3.35Å; L14-A144 WeakPolarHBondContact CA-O 3.34Å; I140-A144 WeakPolarHBondContact O-CB 3.22Å; I140-A144 PolarHBondContact O-N 3.44Å; F141-A144 PolarHBondContact O-N 3.42Å; F142-A144 VanDerWaalsContact C-N 3.31Å; F142-A144 PolarHBondContact O-N 2.79Å; A144-D146 PolarHBondContact O-N 3.11Å; A144-V147 PolarHBondContact O-N 3.47Å; A144-G148 PolarHBondContact O-N 2.82Å |
| 145 | T | 96.8 | Very high | 92.9 | Very high | 0 Ų | 0 | 24.7 Ų | 24.7 | 0% | 0 | 11% | 0.11 | C | C | . | . | H | α-helix | trans | -62.8 | -41.1 | 178.4 | -62.9 | 0 | 0 | 0 | 0 | 112 | G13 A18 A19 A80 F141 F142 I143 G148 R149 | G13-T145 WeakPolarHBondContact O-CA 3.48Å; G13-T145 PolarHBondContact O-OG1 2.82Å; A18-T145 HydrophobicContact CB-CG2 4.11Å; A19-T145 HydrophobicContact CB-CG2 4.12Å; A80-T145 HydrophobicContact CB-CG2 4Å; F141-T145 WeakPolarHBondContact CE1-OG1 3.32Å; F141-T145 WeakPolarHBondContact O-CB 3.42Å; F141-T145 PolarHBondContact O-N 2.99Å; F141-T145 PolarHBondContact O-OG1 3Å; F142-T145 PolarHBondContact O-N 3.18Å; I143-T145 VanDerWaalsContact C-N 3.29Å; I143-T145 PolarHBondContact O-N 3.12Å; T145-G148 PolarHBondContact O-N 3.22Å; T145-R149 WeakPolarHBondContact O-CG 3.45Å; T145-R149 PolarHBondContact O-N 2.95Å |
| 146 | D | 95 | Very high | 91.6 | Very high | 7 Ų | 7 | 31.5 Ų | 31.5 | 4% | 0.037 | 13% | 0.128 | C | C | . | . | H | α-helix | trans | -74.1 | -33.3 | 177 | -82.5 | -16.9 | 0 | 0 | 0 | 112.9 | Y87 A88 N89 A90 F142 I143 A144 G148 R149 L150 | Y87-D146 WeakPolarHBondContact CA-OD2 3.46Å; A88-D146 PolarHBondContact N-OD2 3.38Å; N89-D146 WeakPolarHBondContact CA-OD2 3.5Å; N89-D146 WeakPolarHBondContact CB-OD2 3.37Å; N89-D146 PolarHBondContact N-OD2 3.43Å; N89-D146 PolarHBondContact ND2-OD1 3.47Å; A90-D146 HydrophobicContact CB-CB 4.11Å; A90-D146 PolarHBondContact N-OD2 3.26Å; F142-D146 PolarHBondContact O-N 3.45Å; I143-D146 PolarHBondContact O-N 3.2Å; A144-D146 PolarHBondContact O-N 3.11Å; D146-G148 VanDerWaalsContact C-N 3.26Å; D146-G148 PolarHBondContact O-N 3.22Å; D146-R149 WeakPolarHBondContact O-CB 3.45Å; D146-R149 PolarHBondContact O-N 3.42Å; D146-R149 VanDerWaalsContact OD1-CD 3.28Å; D146-R149 WeakPolarHBondContact OD1-CD 3.4Å; D146-R149 IonicContact OD1-CZ 3.79Å; D146-R149 IonicContact OD1-NE 3.83Å; D146-R149 IonicContact OD1-NH1 2.67Å; D146-R149 PolarHBondContact OD1-NH1 3.37Å; D146-L150 PolarHBondContact O-N 3.37Å |
| 147 | V | 94.9 | Very high | 90 | Very high | 1 Ų | 1 | 37.4 Ų | 37.4 | 1% | 0.006 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -58.9 | -43.5 | 167.9 | -179 | 0 | 0 | 0 | 0 | 109.9 | F10 L14 I143 A144 R149 L150 L151 L171 L207 | F10-V147 HydrophobicContact CZ-CB 4.44Å; F10-V147 HydrophobicContact CZ-CG2 4.18Å; L14-V147 HydrophobicContact CD1-CB 3.88Å; L14-V147 HydrophobicContact CD1-CG1 3.62Å; I143-V147 WeakPolarHBondContact O-CG2 3.33Å; I143-V147 PolarHBondContact O-N 3.17Å; A144-V147 PolarHBondContact O-N 3.47Å; V147-R149 VanDerWaalsContact C-N 3.34Å; V147-R149 PolarHBondContact O-N 3.32Å; V147-L150 WeakPolarHBondContact O-CB 3.41Å; V147-L150 PolarHBondContact O-N 3.14Å; V147-L151 WeakPolarHBondContact O-CG 3.28Å; V147-L151 PolarHBondContact O-N 3.25Å; V147-L151 VanDerWaalsContact O-N 3.09Å; V147-L171 HydrophobicContact CG2-CD1 3.89Å; V147-L207 HydrophobicContact CG1-CD2 4.14Å; V147-L207 HydrophobicContact CG2-CD2 3.56Å |
| 148 | G | 94.9 | Very high | 88.6 | Confident | 0 Ų | 0 | 48.7 Ų | 48.7 | 0% | 0 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -58.9 | -44.5 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | L14 A144 T145 D146 L150 L151 Y152 | L14-G148 WeakPolarHBondContact O-CA 3.19Å; A144-G148 PolarHBondContact O-N 2.82Å; T145-G148 PolarHBondContact O-N 3.22Å; D146-G148 VanDerWaalsContact C-N 3.26Å; D146-G148 PolarHBondContact O-N 3.22Å; G148-L150 VanDerWaalsContact C-N 3.34Å; G148-L150 PolarHBondContact O-N 3.04Å; G148-L151 PolarHBondContact O-N 2.91Å; G148-Y152 WeakPolarHBondContact O-CD2 3.03Å; G148-Y152 PolarHBondContact O-N 2.94Å |
| 149 | R | 92.7 | Very high | 86.8 | Confident | 10 Ų | 10 | 52.7 Ų | 52.7 | 4% | 0.038 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -61.3 | -40 | 176 | -71.6 | 169.1 | 174 | -173.6 | -1.5 | 112.7 | A18 A19 W21 A80 L83 N89 T145 D146 V147 L151 Y152 R153 | A18-R149 PolarHBondContact O-NE 3.49Å; A19-R149 WeakPolarHBondContact O-CG 3.33Å; W21-R149 HydrophobicContact CH2-CG 4.41Å; W21-R149 HydrophobicContact CZ2-CB 4.21Å; W21-R149 VanDerWaalsContact CZ2-CD 3.4Å; W21-R149 HydrophobicContact CZ2-CG 3.71Å; A80-R149 PolarHBondContact O-NH2 3.42Å; L83-R149 PolarHBondContact O-NH1 3.48Å; L83-R149 PolarHBondContact O-NH2 2.97Å; N89-R149 PolarHBondContact ND2-NH1 3.15Å; N89-R149 PolarHBondContact ND2-NH2 3.46Å; T145-R149 WeakPolarHBondContact O-CG 3.45Å; T145-R149 PolarHBondContact O-N 2.95Å; D146-R149 WeakPolarHBondContact O-CB 3.45Å; D146-R149 PolarHBondContact O-N 3.42Å; D146-R149 VanDerWaalsContact OD1-CD 3.28Å; D146-R149 WeakPolarHBondContact OD1-CD 3.4Å; D146-R149 IonicContact OD1-CZ 3.79Å; D146-R149 IonicContact OD1-NE 3.83Å; D146-R149 IonicContact OD1-NH1 2.67Å; D146-R149 PolarHBondContact OD1-NH1 3.37Å; V147-R149 VanDerWaalsContact C-N 3.34Å; V147-R149 PolarHBondContact O-N 3.32Å; R149-L151 VanDerWaalsContact C-N 3.34Å; R149-Y152 PolarHBondContact O-N 2.83Å; R149-R153 VanDerWaalsContact O-CB 3.25Å; R149-R153 WeakPolarHBondContact O-CB 3.29Å; R149-R153 PolarHBondContact O-N 2.87Å |
| 150 | L | 91.1 | Very high | 85.9 | Confident | 8 Ų | 8 | 58.2 Ų | 58.2 | 4% | 0.042 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -59.7 | -45.7 | 175.5 | -179.2 | 64 | 0 | 0 | 0 | 110.8 | D146 V147 G148 C154 Y163 I168 | D146-L150 PolarHBondContact O-N 3.37Å; V147-L150 WeakPolarHBondContact O-CB 3.41Å; V147-L150 PolarHBondContact O-N 3.14Å; G148-L150 VanDerWaalsContact C-N 3.34Å; G148-L150 PolarHBondContact O-N 3.04Å; L150-C154 PolarHBondContact O-SG 3.18Å; L150-C154 VanDerWaalsContact O-SG 3.33Å; L150-Y163 HydrophobicContact CD1-CD1 4.24Å; L150-Y163 HydrophobicContact CD1-CE1 3.89Å; L150-I168 HydrophobicContact CD2-CG1 4.04Å |
| 151 | L | 90.7 | Very high | 85.2 | Confident | 51 Ų | 51 | 60.7 Ų | 60.7 | 27% | 0.267 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -64.6 | -48.5 | 176.9 | -64 | 177.3 | 0 | 0 | 0 | 112.3 | L14 V147 G148 R149 R153 C154 R155 I164 I168 V210 | L14-L151 HydrophobicContact CD1-CD1 3.95Å; L14-L151 HydrophobicContact CD2-CD1 4.39Å; L14-L151 HydrophobicContact CG-CD1 4.39Å; V147-L151 WeakPolarHBondContact O-CG 3.28Å; V147-L151 PolarHBondContact O-N 3.25Å; V147-L151 VanDerWaalsContact O-N 3.09Å; G148-L151 PolarHBondContact O-N 2.91Å; R149-L151 VanDerWaalsContact C-N 3.34Å; L151-R153 PolarHBondContact O-N 3.46Å; L151-C154 PolarHBondContact O-N 3.48Å; L151-R155 PolarHBondContact O-N 3.36Å; L151-I164 HydrophobicContact CD2-CG2 3.77Å; L151-I168 HydrophobicContact CD2-CD1 4.11Å; L151-V210 HydrophobicContact CD1-CG1 4.16Å |
| 152 | Y | 88.5 | Confident | 84.7 | Confident | 67 Ų | 67 | 62.7 Ų | 62.7 | 26% | 0.263 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -68.4 | -30.9 | -179 | -74.6 | -64.9 | 0 | 0 | 0 | 113.4 | A19 R20 G148 R149 C154 R155 R156 | A19-Y152 HydrophobicContact CB-CD2 4.32Å; A19-Y152 HydrophobicContact CB-CE2 4.27Å; A19-Y152 WeakPolarHBondContact O-CD2 3.48Å; R20-Y152 WeakPolarHBondContact CD-OH 3.07Å; R20-Y152 HydrophobicContact CG-CD1 4.06Å; R20-Y152 HydrophobicContact CG-CD2 3.66Å; R20-Y152 HydrophobicContact CG-CE1 3.67Å; R20-Y152 HydrophobicContact CG-CE2 3.28Å; R20-Y152 HydrophobicContact CG-CG 4.07Å; G148-Y152 WeakPolarHBondContact O-CD2 3.03Å; G148-Y152 PolarHBondContact O-N 2.94Å; R149-Y152 PolarHBondContact O-N 2.83Å; Y152-C154 VanDerWaalsContact C-N 3.25Å; Y152-C154 PolarHBondContact O-N 3.47Å; Y152-R155 PolarHBondContact O-N 3.08Å; Y152-R156 PolarHBondContact O-N 3.24Å |
| 153 | R | 83.3 | Confident | 84.3 | Confident | 69 Ų | 69 | 66.9 Ų | 66.9 | 26% | 0.26 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -60.5 | -38.9 | 175.4 | -177.1 | 176 | -75.6 | 173.3 | -3.5 | 111.1 | R149 L151 R156 H157 | R149-R153 VanDerWaalsContact O-CB 3.25Å; R149-R153 WeakPolarHBondContact O-CB 3.29Å; R149-R153 PolarHBondContact O-N 2.87Å; L151-R153 PolarHBondContact O-N 3.46Å; R153-R156 PolarHBondContact O-N 2.84Å; R153-H157 PolarHBondContact O-N 3.13Å |
| 154 | C | 73.8 | Confident | 84 | Confident | 15 Ų | 15 | 67.3 Ų | 67.3 | 10% | 0.101 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -70.8 | -37.4 | -179.7 | -62.1 | 0 | 0 | 0 | 0 | 112.4 | L150 L151 Y152 R156 R158 W159 I164 | L150-C154 PolarHBondContact O-SG 3.18Å; L150-C154 VanDerWaalsContact O-SG 3.33Å; L151-C154 PolarHBondContact O-N 3.48Å; Y152-C154 VanDerWaalsContact C-N 3.25Å; Y152-C154 PolarHBondContact O-N 3.47Å; C154-R156 PolarHBondContact O-N 3.4Å; C154-R158 PolarHBondContact O-N 2.98Å; C154-R158 VanDerWaalsContact O-N 3.1Å; C154-W159 HydrophobicContact CB-CB 4.23Å; C154-W159 VanDerWaalsContact SG-CB 3.59Å; C154-I164 HydrophobicContact CB-CD1 3.28Å; C154-I164 HydrophobicContact CB-CG1 3.86Å; C154-I164 WeakPolarHBondContact SG-CD1 3.44Å; C154-I164 WeakPolarHBondContact SG-CG1 3.46Å |
| 155 | R | 74.2 | Confident | 83.7 | Confident | 195 Ų | 195 | 68.5 Ų | 68.5 | 74% | 0.736 | 30% | 0.301 | S | S | * | . | H | α-helix | trans | -58.2 | -36.5 | 170.8 | -173.3 | 177.4 | 176.8 | 129.7 | 2.1 | 112.2 | L151 Y152 | L151-R155 PolarHBondContact O-N 3.36Å; Y152-R155 PolarHBondContact O-N 3.08Å |
| 156 | R | 68.7 | Low | 83.5 | Confident | 209 Ų | 209 | 75.9 Ų | 75.9 | 79% | 0.789 | 33% | 0.333 | S | S | * | . | H | α-helix | trans | -85 | -40.9 | -176.2 | -166.1 | 177.1 | -177.1 | 102.1 | 0.5 | 113.9 | Y152 R153 C154 | Y152-R156 PolarHBondContact O-N 3.24Å; R153-R156 PolarHBondContact O-N 2.84Å; C154-R156 PolarHBondContact O-N 3.4Å |
| 157 | H | 63.9 | Low | 83.4 | Confident | 123 Ų | 123 | 76.2 Ų | 76.2 | 57% | 0.569 | 34% | 0.339 | S | S | * | . | H | α-helix | trans | -111.1 | 12.8 | -169.6 | -77.3 | -75.6 | 0 | 0 | 0 | 114.3 | R153 W159 | R153-H157 PolarHBondContact O-N 3.13Å; H157-W159 PolarHBondContact O-N 2.88Å |
| 158 | R | 66.4 | Low | 83.4 | Confident | 242 Ų | 242 | 76.2 Ų | 76.2 | 91% | 0.913 | 34% | 0.338 | S | S | * | . | trans | 51.8 | 38.6 | 179.7 | -59.3 | -172.1 | 179 | -174.9 | -0.3 | 113.8 | C154 | C154-R158 PolarHBondContact O-N 2.98Å; C154-R158 VanDerWaalsContact O-N 3.1Å | ||
| 159 | W | 60.2 | Low | 83.4 | Confident | 101 Ų | 101 | 77.8 Ų | 77.8 | 38% | 0.383 | 35% | 0.351 | S | S | . | . | trans | -66.1 | 146.3 | 178.1 | -73.2 | 49.5 | 0 | 0 | 0 | 109.8 | C154 H157 V161 Y163 | C154-W159 HydrophobicContact CB-CB 4.23Å; C154-W159 VanDerWaalsContact SG-CB 3.59Å; H157-W159 PolarHBondContact O-N 2.88Å; W159-V161 PolarHBondContact O-N 3.11Å; W159-Y163 HydrophobicContact CD2-CD1 4.48Å; W159-Y163 AromaticContact CE3-CD1 3.39Å; W159-Y163 HydrophobicContact CE3-CD1 3.39Å; W159-Y163 HydrophobicContact CE3-CD2 4.09Å; W159-Y163 AromaticContact CE3-CE1 3.61Å; W159-Y163 HydrophobicContact CE3-CE1 3.61Å; W159-Y163 HydrophobicContact CE3-CE2 4.29Å; W159-Y163 AromaticContact CE3-CG 3.65Å; W159-Y163 HydrophobicContact CE3-CG 3.65Å; W159-Y163 AromaticContact CZ3-CD1 3.73Å; W159-Y163 HydrophobicContact CZ3-CD1 3.73Å; W159-Y163 AromaticContact CZ3-CD2 3.98Å; W159-Y163 HydrophobicContact CZ3-CD2 3.98Å; W159-Y163 AromaticContact CZ3-CE1 3.47Å; W159-Y163 HydrophobicContact CZ3-CE1 3.47Å; W159-Y163 VanDerWaalsContact CZ3-CE1 3.47Å; W159-Y163 AromaticContact CZ3-CE2 3.74Å; W159-Y163 HydrophobicContact CZ3-CE2 3.74Å; W159-Y163 AromaticContact CZ3-CG 3.98Å; W159-Y163 HydrophobicContact CZ3-CG 3.98Å; W159-Y163 AromaticContact CZ3-CZ 3.47Å; W159-Y163 VanDerWaalsContact CZ3-CZ 3.47Å | ||
| 160 | N | 78.9 | Confident | 83.5 | Confident | 116 Ų | 116 | 80.5 Ų | 80.5 | 62% | 0.62 | 37% | 0.371 | S | S | * | . | trans | -57.8 | 128.4 | 176.4 | -171.7 | -24.3 | 0 | 0 | 0 | 109.3 | A162 Y163 | N160-A162 PolarHBondContact O-N 3.18Å; N160-A162 VanDerWaalsContact OD1-CB 3.27Å; N160-A162 WeakPolarHBondContact OD1-CB 3.48Å; N160-A162 PolarHBondContact OD1-N 2.69Å; N160-Y163 WeakPolarHBondContact O-CB 3.44Å; N160-Y163 PolarHBondContact O-N 3.48Å | ||
| 161 | V | 84.5 | Confident | 83.7 | Confident | 52 Ų | 52 | 81.3 Ų | 81.3 | 32% | 0.315 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -52.7 | -30.3 | 176.5 | -178.5 | 0 | 0 | 0 | 0 | 111.3 | W159 Y163 I164 A165 L214 L218 | W159-V161 PolarHBondContact O-N 3.11Å; V161-Y163 VanDerWaalsContact C-N 3.25Å; V161-Y163 PolarHBondContact O-N 3.36Å; V161-I164 WeakPolarHBondContact O-CB 3.45Å; V161-I164 PolarHBondContact O-N 2.97Å; V161-I164 VanDerWaalsContact O-N 3.13Å; V161-A165 PolarHBondContact O-N 2.91Å; V161-L214 HydrophobicContact CG1-CD1 3.86Å; V161-L214 HydrophobicContact CG1-CD2 4.18Å; V161-L214 HydrophobicContact CG1-CG 4.24Å; V161-L218 HydrophobicContact CB-CD2 4.46Å; V161-L218 HydrophobicContact CG1-CD1 3.9Å; V161-L218 HydrophobicContact CG1-CD2 3.97Å; V161-L218 HydrophobicContact CG1-CG 4.28Å; V161-L218 HydrophobicContact CG2-CD2 4.42Å |
| 162 | A | 87.9 | Confident | 84 | Confident | 44 Ų | 44 | 80.4 Ų | 80.4 | 36% | 0.364 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -57.5 | -34.3 | 173.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | N160 K166 | N160-A162 PolarHBondContact O-N 3.18Å; N160-A162 VanDerWaalsContact OD1-CB 3.27Å; N160-A162 WeakPolarHBondContact OD1-CB 3.48Å; N160-A162 PolarHBondContact OD1-N 2.69Å; A162-K166 WeakPolarHBondContact O-CB 3.16Å; A162-K166 WeakPolarHBondContact O-CG 3.39Å; A162-K166 PolarHBondContact O-N 2.91Å |
| 163 | Y | 89.6 | Confident | 84.5 | Confident | 92 Ų | 92 | 82.5 Ų | 82.5 | 36% | 0.361 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -68.4 | -41.8 | 176.2 | -177.3 | -91.3 | 0 | 0 | 0 | 111.6 | L150 W159 N160 V161 K166 G167 | L150-Y163 HydrophobicContact CD1-CD1 4.24Å; L150-Y163 HydrophobicContact CD1-CE1 3.89Å; W159-Y163 HydrophobicContact CD2-CD1 4.48Å; W159-Y163 AromaticContact CE3-CD1 3.39Å; W159-Y163 HydrophobicContact CE3-CD1 3.39Å; W159-Y163 HydrophobicContact CE3-CD2 4.09Å; W159-Y163 AromaticContact CE3-CE1 3.61Å; W159-Y163 HydrophobicContact CE3-CE1 3.61Å; W159-Y163 HydrophobicContact CE3-CE2 4.29Å; W159-Y163 AromaticContact CE3-CG 3.65Å; W159-Y163 HydrophobicContact CE3-CG 3.65Å; W159-Y163 AromaticContact CZ3-CD1 3.73Å; W159-Y163 HydrophobicContact CZ3-CD1 3.73Å; W159-Y163 AromaticContact CZ3-CD2 3.98Å; W159-Y163 HydrophobicContact CZ3-CD2 3.98Å; W159-Y163 AromaticContact CZ3-CE1 3.47Å; W159-Y163 HydrophobicContact CZ3-CE1 3.47Å; W159-Y163 VanDerWaalsContact CZ3-CE1 3.47Å; W159-Y163 AromaticContact CZ3-CE2 3.74Å; W159-Y163 HydrophobicContact CZ3-CE2 3.74Å; W159-Y163 AromaticContact CZ3-CG 3.98Å; W159-Y163 HydrophobicContact CZ3-CG 3.98Å; W159-Y163 AromaticContact CZ3-CZ 3.47Å; W159-Y163 VanDerWaalsContact CZ3-CZ 3.47Å; N160-Y163 WeakPolarHBondContact O-CB 3.44Å; N160-Y163 PolarHBondContact O-N 3.48Å; V161-Y163 VanDerWaalsContact C-N 3.25Å; V161-Y163 PolarHBondContact O-N 3.36Å; Y163-K166 PolarHBondContact O-N 2.89Å; Y163-G167 PolarHBondContact O-N 3.35Å |
| 164 | I | 89.7 | Confident | 85.1 | Confident | 12 Ų | 12 | 82.9 Ų | 82.9 | 6% | 0.062 | 39% | 0.391 | C | S | . | . | H | α-helix | trans | -61.3 | -51.1 | 174.2 | -57 | 173.4 | 0 | 0 | 0 | 109.8 | L151 C154 V161 K166 G167 I168 L214 | L151-I164 HydrophobicContact CD2-CG2 3.77Å; C154-I164 HydrophobicContact CB-CD1 3.28Å; C154-I164 HydrophobicContact CB-CG1 3.86Å; C154-I164 WeakPolarHBondContact SG-CD1 3.44Å; C154-I164 WeakPolarHBondContact SG-CG1 3.46Å; V161-I164 WeakPolarHBondContact O-CB 3.45Å; V161-I164 PolarHBondContact O-N 2.97Å; V161-I164 VanDerWaalsContact O-N 3.13Å; I164-K166 VanDerWaalsContact C-N 3.27Å; I164-K166 PolarHBondContact O-N 2.9Å; I164-G167 PolarHBondContact O-N 3.34Å; I164-I168 HydrophobicContact CG2-CD1 3.58Å; I164-I168 HydrophobicContact CG2-CG1 4.1Å; I164-I168 WeakPolarHBondContact O-CG1 3.3Å; I164-I168 PolarHBondContact O-N 3.42Å; I164-L214 HydrophobicContact CG2-CD2 4.13Å |
| 165 | A | 92.1 | Very high | 86.2 | Confident | 24 Ų | 24 | 82.4 Ų | 82.4 | 20% | 0.198 | 39% | 0.388 | C | S | . | . | H | α-helix | trans | -57.6 | -43.5 | -178.4 | 0 | 0 | 0 | 0 | 0 | 110.7 | V161 A169 F211 L214 | V161-A165 PolarHBondContact O-N 2.91Å; A165-A169 WeakPolarHBondContact O-CB 3.45Å; A165-A169 PolarHBondContact O-N 3.34Å; A165-F211 HydrophobicContact CB-CE2 4.17Å; A165-L214 HydrophobicContact CB-CD2 4.08Å |
| 166 | K | 93 | Very high | 87.3 | Confident | 156 Ų | 156 | 75 Ų | 75 | 68% | 0.678 | 37% | 0.368 | S | S | * | . | H | α-helix | trans | -62.3 | -44.2 | 173.3 | -74.9 | 176 | -177.1 | -172.7 | 0 | 112.6 | A162 Y163 I164 A169 C170 | A162-K166 WeakPolarHBondContact O-CB 3.16Å; A162-K166 WeakPolarHBondContact O-CG 3.39Å; A162-K166 PolarHBondContact O-N 2.91Å; Y163-K166 PolarHBondContact O-N 2.89Å; I164-K166 VanDerWaalsContact C-N 3.27Å; I164-K166 PolarHBondContact O-N 2.9Å; K166-A169 PolarHBondContact O-N 3.37Å; K166-C170 VanDerWaalsContact O-CB 3.31Å; K166-C170 WeakPolarHBondContact O-CB 3.29Å; K166-C170 PolarHBondContact O-N 2.84Å |
| 167 | G | 92.6 | Very high | 88.7 | Confident | 14 Ų | 14 | 69.6 Ų | 69.6 | 14% | 0.144 | 36% | 0.358 | C | S | . | . | H | α-helix | trans | -63.1 | -45.8 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | Y163 I164 C170 L171 | Y163-G167 PolarHBondContact O-N 3.35Å; I164-G167 PolarHBondContact O-N 3.34Å; G167-C170 PolarHBondContact O-N 2.91Å; G167-L171 WeakPolarHBondContact O-CG 3.2Å; G167-L171 PolarHBondContact O-N 3.42Å; G167-L171 VanDerWaalsContact O-N 3.09Å |
| 168 | I | 94 | Very high | 90.3 | Very high | 0 Ų | 0 | 66 Ų | 66 | 0% | 0 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -66.4 | -44.9 | 176.7 | -63.3 | 177.5 | 0 | 0 | 0 | 110.5 | L150 L151 I164 C170 L171 I172 L207 V210 F211 | L150-I168 HydrophobicContact CD2-CG1 4.04Å; L151-I168 HydrophobicContact CD2-CD1 4.11Å; I164-I168 HydrophobicContact CG2-CD1 3.58Å; I164-I168 HydrophobicContact CG2-CG1 4.1Å; I164-I168 WeakPolarHBondContact O-CG1 3.3Å; I164-I168 PolarHBondContact O-N 3.42Å; I168-C170 VanDerWaalsContact C-N 3.3Å; I168-C170 PolarHBondContact O-N 3.42Å; I168-L171 PolarHBondContact O-N 2.85Å; I168-L171 VanDerWaalsContact O-N 3.15Å; I168-I172 HydrophobicContact CG2-CD1 4.02Å; I168-I172 HydrophobicContact CG2-CG1 4.41Å; I168-I172 WeakPolarHBondContact O-CG1 3.15Å; I168-I172 PolarHBondContact O-N 3.34Å; I168-L207 HydrophobicContact CG2-CD2 4.33Å; I168-V210 HydrophobicContact CD1-CG1 3.85Å; I168-F211 HydrophobicContact CB-CD2 4.32Å; I168-F211 HydrophobicContact CG2-CB 3.89Å; I168-F211 HydrophobicContact CG2-CD2 3.99Å; I168-F211 HydrophobicContact CG2-CG 4.43Å |
| 169 | A | 95.5 | Very high | 91.7 | Very high | 33 Ų | 33 | 55 Ų | 55 | 27% | 0.273 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -59.8 | -40.1 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | A165 K166 I172 I173 F211 | A165-A169 WeakPolarHBondContact O-CB 3.45Å; A165-A169 PolarHBondContact O-N 3.34Å; K166-A169 PolarHBondContact O-N 3.37Å; A169-I172 WeakPolarHBondContact O-CB 3.31Å; A169-I172 PolarHBondContact O-N 3.38Å; A169-I173 WeakPolarHBondContact O-CG1 3.38Å; A169-I173 PolarHBondContact O-N 3.28Å; A169-F211 HydrophobicContact CB-CE2 4.34Å |
| 170 | C | 95.8 | Very high | 93.5 | Very high | 68 Ų | 68 | 57.9 Ų | 57.9 | 46% | 0.459 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -61 | -46.5 | 173.9 | -175.1 | 0 | 0 | 0 | 0 | 111.6 | K166 G167 I168 I172 I173 I174 | K166-C170 VanDerWaalsContact O-CB 3.31Å; K166-C170 WeakPolarHBondContact O-CB 3.29Å; K166-C170 PolarHBondContact O-N 2.84Å; G167-C170 PolarHBondContact O-N 2.91Å; I168-C170 VanDerWaalsContact C-N 3.3Å; I168-C170 PolarHBondContact O-N 3.42Å; C170-I172 VanDerWaalsContact C-N 3.33Å; C170-I172 PolarHBondContact O-N 2.91Å; C170-I173 PolarHBondContact O-N 3.47Å; C170-I174 VanDerWaalsContact O-CG1 3.32Å; C170-I174 WeakPolarHBondContact O-CG1 3.22Å; C170-I174 PolarHBondContact O-N 3.45Å |
| 171 | L | 95.6 | Very high | 94.3 | Very high | 24 Ų | 24 | 54 Ų | 54 | 13% | 0.126 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -62.6 | -38.4 | 176.1 | -69.2 | 171.5 | 0 | 0 | 0 | 112.3 | V147 G167 I168 I174 M175 L207 | V147-L171 HydrophobicContact CG2-CD1 3.89Å; G167-L171 WeakPolarHBondContact O-CG 3.2Å; G167-L171 PolarHBondContact O-N 3.42Å; G167-L171 VanDerWaalsContact O-N 3.09Å; I168-L171 PolarHBondContact O-N 2.85Å; I168-L171 VanDerWaalsContact O-N 3.15Å; L171-I174 PolarHBondContact O-N 3.45Å; L171-M175 VanDerWaalsContact O-CG 3.29Å; L171-M175 WeakPolarHBondContact O-CG 3.49Å; L171-M175 PolarHBondContact O-N 3.3Å; L171-L207 HydrophobicContact CB-CD1 3.8Å; L171-L207 HydrophobicContact CB-CD2 4.06Å; L171-L207 HydrophobicContact CD1-CD2 4.19Å |
| 172 | I | 97.1 | Very high | 94.8 | Very high | 33 Ų | 33 | 52.9 Ų | 52.9 | 17% | 0.169 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -58.8 | -48.7 | 173.9 | -71.2 | 170.6 | 0 | 0 | 0 | 110.2 | I168 A169 C170 I174 M175 A176 L204 L207 F211 | I168-I172 HydrophobicContact CG2-CD1 4.02Å; I168-I172 HydrophobicContact CG2-CG1 4.41Å; I168-I172 WeakPolarHBondContact O-CG1 3.15Å; I168-I172 PolarHBondContact O-N 3.34Å; A169-I172 WeakPolarHBondContact O-CB 3.31Å; A169-I172 PolarHBondContact O-N 3.38Å; C170-I172 VanDerWaalsContact C-N 3.33Å; C170-I172 PolarHBondContact O-N 2.91Å; I172-I174 PolarHBondContact O-N 2.87Å; I172-M175 PolarHBondContact O-N 2.89Å; I172-A176 VanDerWaalsContact O-CB 3.28Å; I172-A176 WeakPolarHBondContact O-CB 3.43Å; I172-A176 PolarHBondContact O-N 2.66Å; I172-L204 HydrophobicContact CG2-CD1 3.83Å; I172-L207 HydrophobicContact CD1-CB 4.36Å; I172-L207 HydrophobicContact CG1-CB 3.62Å; I172-F211 HydrophobicContact CD1-CB 3.85Å; I172-F211 HydrophobicContact CD1-CD2 4.49Å; I172-F211 HydrophobicContact CD1-CG 4.16Å |
| 173 | I | 97.4 | Very high | 95.1 | Very high | 110 Ų | 110 | 55.1 Ų | 55.1 | 56% | 0.564 | 30% | 0.3 | S | S | * | . | H | α-helix | trans | -60.5 | -46.3 | 178.8 | -66.8 | 164.5 | 0 | 0 | 0 | 110.5 | A169 C170 M175 A176 V177 | A169-I173 WeakPolarHBondContact O-CG1 3.38Å; A169-I173 PolarHBondContact O-N 3.28Å; C170-I173 PolarHBondContact O-N 3.47Å; I173-M175 PolarHBondContact O-N 2.94Å; I173-A176 PolarHBondContact O-N 2.98Å; I173-V177 HydrophobicContact CG2-CG2 4.39Å; I173-V177 VanDerWaalsContact O-CG2 3.31Å; I173-V177 WeakPolarHBondContact O-CG2 3.49Å; I173-V177 PolarHBondContact O-N 3.4Å |
| 174 | I | 96.7 | Very high | 95.4 | Very high | 77 Ų | 77 | 55.2 Ų | 55.2 | 40% | 0.395 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -60 | -48.8 | 178.8 | -66.4 | 165.4 | 0 | 0 | 0 | 110.7 | C170 L171 I172 A176 V177 L178 | C170-I174 VanDerWaalsContact O-CG1 3.32Å; C170-I174 WeakPolarHBondContact O-CG1 3.22Å; C170-I174 PolarHBondContact O-N 3.45Å; L171-I174 PolarHBondContact O-N 3.45Å; I172-I174 PolarHBondContact O-N 2.87Å; I174-A176 VanDerWaalsContact C-N 3.33Å; I174-A176 PolarHBondContact O-N 3.47Å; I174-V177 PolarHBondContact O-N 2.94Å; I174-L178 HydrophobicContact CG2-CD1 4.07Å; I174-L178 WeakPolarHBondContact O-CG 3.32Å; I174-L178 PolarHBondContact O-N 3.11Å |
| 175 | M | 97 | Very high | 95.5 | Very high | 5 Ų | 5 | 62.7 Ų | 62.7 | 3% | 0.025 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -65.4 | -36.6 | 179.4 | -65.4 | -59.8 | 129.6 | 0 | 0 | 112 | V94 L171 I172 I173 L178 C179 F200 A203 L204 L207 | V94-M175 HydrophobicContact CG2-CE 4.1Å; L171-M175 VanDerWaalsContact O-CG 3.29Å; L171-M175 WeakPolarHBondContact O-CG 3.49Å; L171-M175 PolarHBondContact O-N 3.3Å; I172-M175 PolarHBondContact O-N 2.89Å; I173-M175 PolarHBondContact O-N 2.94Å; M175-L178 HydrophobicContact CE-CD1 4.13Å; M175-L178 PolarHBondContact O-N 2.72Å; M175-L178 HydrophobicContact SD-CD1 4.24Å; M175-C179 WeakPolarHBondContact O-CB 3.29Å; M175-C179 PolarHBondContact O-N 3.23Å; M175-C179 PolarHBondContact O-SG 3.41Å; M175-F200 HydrophobicContact SD-CB 4.35Å; M175-F200 HydrophobicContact SD-CD1 3.7Å; M175-F200 HydrophobicContact SD-CE1 4.49Å; M175-F200 HydrophobicContact SD-CG 4.37Å; M175-A203 HydrophobicContact CG-CB 4.07Å; M175-A203 HydrophobicContact SD-CB 3.92Å; M175-L204 HydrophobicContact CB-CB 4.04Å; M175-L204 HydrophobicContact CB-CD1 4.45Å; M175-L207 HydrophobicContact CG-CD1 3.76Å |
| 176 | A | 97.4 | Very high | 95.5 | Very high | 39 Ų | 39 | 64.5 Ų | 64.5 | 32% | 0.322 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -64.7 | -43.8 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112 | I172 I173 I174 L178 C179 Y180 L204 | I172-A176 VanDerWaalsContact O-CB 3.28Å; I172-A176 WeakPolarHBondContact O-CB 3.43Å; I172-A176 PolarHBondContact O-N 2.66Å; I173-A176 PolarHBondContact O-N 2.98Å; I174-A176 VanDerWaalsContact C-N 3.33Å; I174-A176 PolarHBondContact O-N 3.47Å; A176-L178 VanDerWaalsContact C-N 3.35Å; A176-C179 PolarHBondContact O-N 2.96Å; A176-Y180 WeakPolarHBondContact O-CB 3.4Å; A176-Y180 PolarHBondContact O-N 3.32Å; A176-L204 HydrophobicContact CB-CD1 4.12Å; A176-L204 HydrophobicContact CB-CD2 4.39Å |
| 177 | V | 97.5 | Very high | 95.5 | Very high | 96 Ų | 96 | 58.2 Ų | 58.2 | 58% | 0.582 | 33% | 0.334 | S | S | * | . | H | α-helix | trans | -62.6 | -42.1 | 175.3 | 171.4 | 0 | 0 | 0 | 0 | 111 | I173 I174 Y180 G181 | I173-V177 HydrophobicContact CG2-CG2 4.39Å; I173-V177 VanDerWaalsContact O-CG2 3.31Å; I173-V177 WeakPolarHBondContact O-CG2 3.49Å; I173-V177 PolarHBondContact O-N 3.4Å; I174-V177 PolarHBondContact O-N 2.94Å; V177-Y180 PolarHBondContact O-N 3.43Å; V177-G181 PolarHBondContact O-N 2.9Å |
| 178 | L | 96.6 | Very high | 95.5 | Very high | 49 Ų | 49 | 61.8 Ų | 61.8 | 26% | 0.257 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -63.9 | -43.2 | 176 | -71.2 | 170.1 | 0 | 0 | 0 | 112.2 | I174 M175 A176 G181 L182 F200 | I174-L178 HydrophobicContact CG2-CD1 4.07Å; I174-L178 WeakPolarHBondContact O-CG 3.32Å; I174-L178 PolarHBondContact O-N 3.11Å; M175-L178 HydrophobicContact CE-CD1 4.13Å; M175-L178 PolarHBondContact O-N 2.72Å; M175-L178 HydrophobicContact SD-CD1 4.24Å; A176-L178 VanDerWaalsContact C-N 3.35Å; L178-G181 PolarHBondContact O-N 3.05Å; L178-L182 WeakPolarHBondContact O-CG 3.31Å; L178-L182 PolarHBondContact O-N 2.92Å; L178-L182 VanDerWaalsContact O-N 3.12Å; L178-F200 HydrophobicContact CB-CB 4.41Å; L178-F200 HydrophobicContact CB-CD2 3.72Å; L178-F200 HydrophobicContact CB-CE2 4.11Å; L178-F200 HydrophobicContact CB-CG 4.02Å; L178-F200 HydrophobicContact CD1-CD1 3.99Å; L178-F200 HydrophobicContact CD1-CD2 4.29Å; L178-F200 HydrophobicContact CD1-CE1 3.87Å; L178-F200 HydrophobicContact CD1-CE2 4.17Å; L178-F200 HydrophobicContact CD1-CG 4.21Å; L178-F200 HydrophobicContact CD1-CZ 3.97Å; L178-F200 HydrophobicContact CD2-CE2 4.38Å; L178-F200 HydrophobicContact CG-CD2 4.5Å; L178-F200 HydrophobicContact CG-CE2 4.46Å |
| 179 | C | 97.1 | Very high | 95.5 | Very high | 9 Ų | 9 | 64.5 Ų | 64.5 | 6% | 0.061 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -62 | -47.3 | 175.1 | -67.5 | 0 | 0 | 0 | 0 | 111.1 | M175 A176 G181 L182 D183 W201 | M175-C179 WeakPolarHBondContact O-CB 3.29Å; M175-C179 PolarHBondContact O-N 3.23Å; M175-C179 PolarHBondContact O-SG 3.41Å; A176-C179 PolarHBondContact O-N 2.96Å; C179-G181 VanDerWaalsContact C-N 3.34Å; C179-G181 PolarHBondContact O-N 3.31Å; C179-L182 PolarHBondContact O-N 3.31Å; C179-D183 WeakPolarHBondContact O-CB 3.29Å; C179-D183 PolarHBondContact O-N 3.4Å; C179-W201 PolarHBondContact SG-N 3.34Å |
| 180 | Y | 96.8 | Very high | 95.4 | Very high | 163 Ų | 163 | 64 Ų | 64 | 64% | 0.639 | 37% | 0.369 | S | S | * | . | H | α-helix | trans | -59.6 | -43.8 | 178.1 | -178.5 | -98.4 | 0 | 0 | 0 | 111.8 | A176 V177 L182 D183 T184 | A176-Y180 WeakPolarHBondContact O-CB 3.4Å; A176-Y180 PolarHBondContact O-N 3.32Å; V177-Y180 PolarHBondContact O-N 3.43Å; Y180-L182 VanDerWaalsContact C-N 3.34Å; Y180-L182 PolarHBondContact O-N 3.32Å; Y180-D183 PolarHBondContact O-N 3.47Å; Y180-T184 HydrophobicContact CD1-CG2 4.2Å; Y180-T184 HydrophobicContact CE1-CG2 3.77Å; Y180-T184 HydrophobicContact CE2-CG2 4.29Å; Y180-T184 WeakPolarHBondContact O-CG2 3.46Å; Y180-T184 PolarHBondContact O-N 3.33Å; Y180-T184 PolarHBondContact O-OG1 3.48Å |
| 181 | G | 96 | Very high | 95.2 | Very high | 35 Ų | 35 | 61.4 Ų | 61.4 | 36% | 0.361 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -59.5 | -41.9 | 176 | 0 | 0 | 0 | 0 | 0 | 113 | V177 L178 C179 T184 Y185 | V177-G181 PolarHBondContact O-N 2.9Å; L178-G181 PolarHBondContact O-N 3.05Å; C179-G181 VanDerWaalsContact C-N 3.34Å; C179-G181 PolarHBondContact O-N 3.31Å; G181-T184 PolarHBondContact O-N 3.08Å; G181-T184 PolarHBondContact O-OG1 2.95Å; G181-Y185 PolarHBondContact O-N 2.93Å; G181-Y185 VanDerWaalsContact O-N 3.17Å |
| 182 | L | 95.1 | Very high | 95 | Very high | 27 Ų | 27 | 64.3 Ų | 64.3 | 14% | 0.141 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -72 | -34.5 | 177.7 | -66.7 | 173.5 | 0 | 0 | 0 | 112.9 | L178 C179 Y180 Y185 G186 L187 S196 Y197 F200 | L178-L182 WeakPolarHBondContact O-CG 3.31Å; L178-L182 PolarHBondContact O-N 2.92Å; L178-L182 VanDerWaalsContact O-N 3.12Å; C179-L182 PolarHBondContact O-N 3.31Å; Y180-L182 VanDerWaalsContact C-N 3.34Å; Y180-L182 PolarHBondContact O-N 3.32Å; L182-Y185 WeakPolarHBondContact O-CB 3.27Å; L182-Y185 PolarHBondContact O-N 3.24Å; L182-G186 PolarHBondContact O-N 3.09Å; L182-L187 HydrophobicContact CB-CD2 4.46Å; L182-L187 HydrophobicContact CD2-CD2 4.02Å; L182-L187 PolarHBondContact O-N 3.14Å; L182-L187 VanDerWaalsContact O-N 3.09Å; L182-S196 WeakPolarHBondContact CD1-OG 3.49Å; L182-Y197 HydrophobicContact CB-CD2 3.69Å; L182-Y197 HydrophobicContact CB-CE2 4.35Å; L182-Y197 HydrophobicContact CB-CG 4.32Å; L182-Y197 HydrophobicContact CD1-CG 4.49Å; L182-F200 HydrophobicContact CD1-CD2 3.64Å; L182-F200 HydrophobicContact CD1-CE2 3.99Å |
| 183 | D | 94.8 | Very high | 94.7 | Very high | 91 Ų | 91 | 62.9 Ų | 62.9 | 49% | 0.487 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -64.1 | -43.8 | 173.3 | -169.5 | 55.8 | 0 | 0 | 0 | 111.1 | C179 Y180 Y185 G186 Y197 | C179-D183 WeakPolarHBondContact O-CB 3.29Å; C179-D183 PolarHBondContact O-N 3.4Å; Y180-D183 PolarHBondContact O-N 3.47Å; D183-Y185 PolarHBondContact O-N 2.82Å; D183-G186 WeakPolarHBondContact O-CA 3.46Å; D183-G186 PolarHBondContact O-N 3Å; D183-Y197 HydrophobicContact CB-CE2 3.91Å |
| 184 | T | 95.2 | Very high | 94.6 | Very high | 94 Ų | 94 | 57.6 Ų | 57.6 | 58% | 0.577 | 33% | 0.325 | S | S | * | . | H | α-helix | trans | -65 | -23.8 | 174.1 | 59.2 | 0 | 0 | 0 | 0 | 113.6 | Y180 G181 | Y180-T184 HydrophobicContact CD1-CG2 4.2Å; Y180-T184 HydrophobicContact CE1-CG2 3.77Å; Y180-T184 HydrophobicContact CE2-CG2 4.29Å; Y180-T184 WeakPolarHBondContact O-CG2 3.46Å; Y180-T184 PolarHBondContact O-N 3.33Å; Y180-T184 PolarHBondContact O-OG1 3.48Å; G181-T184 PolarHBondContact O-N 3.08Å; G181-T184 PolarHBondContact O-OG1 2.95Å |
| 185 | Y | 91.9 | Very high | 94.5 | Very high | 169 Ų | 169 | 54.1 Ų | 54.1 | 66% | 0.663 | 31% | 0.307 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -79.2 | -5.8 | 172.1 | -170.6 | -100.5 | 0 | 0 | 0 | 112.5 | G181 L182 D183 L187 | G181-Y185 PolarHBondContact O-N 2.93Å; G181-Y185 VanDerWaalsContact O-N 3.17Å; L182-Y185 WeakPolarHBondContact O-CB 3.27Å; L182-Y185 PolarHBondContact O-N 3.24Å; D183-Y185 PolarHBondContact O-N 2.82Å; Y185-L187 VanDerWaalsContact C-N 3.33Å; Y185-L187 HydrophobicContact CD1-CB 4.4Å |
| 186 | G | 92.7 | Very high | 94.5 | Very high | 63 Ų | 63 | 53.9 Ų | 53.9 | 65% | 0.649 | 31% | 0.306 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 77.9 | 14.6 | -178.6 | 0 | 0 | 0 | 0 | 0 | 114 | L182 D183 | L182-G186 PolarHBondContact O-N 3.09Å; D183-G186 WeakPolarHBondContact O-CA 3.46Å; D183-G186 PolarHBondContact O-N 3Å |
| 187 | L | 92.5 | Very high | 94.4 | Very high | 24 Ų | 24 | 53.5 Ų | 53.5 | 13% | 0.126 | 30% | 0.296 | C | S | . | . | P | Polyproline II helix | trans | -80.4 | 129.8 | 177.7 | -173.5 | 69.9 | 0 | 0 | 0 | 109.8 | Q101 L182 Y185 Y197 | Q101-L187 HydrophobicContact CG-CD2 4.37Å; Q101-L187 VanDerWaalsContact OE1-CD2 3.25Å; L182-L187 HydrophobicContact CB-CD2 4.46Å; L182-L187 HydrophobicContact CD2-CD2 4.02Å; L182-L187 PolarHBondContact O-N 3.14Å; L182-L187 VanDerWaalsContact O-N 3.09Å; Y185-L187 VanDerWaalsContact C-N 3.33Å; Y185-L187 HydrophobicContact CD1-CB 4.4Å; L187-Y197 WeakPolarHBondContact O-CD2 3.37Å; L187-Y197 WeakPolarHBondContact O-CE2 3.44Å |
| 188 | S | 92.9 | Very high | 94.4 | Very high | 89 Ų | 89 | 49.1 Ų | 49.1 | 62% | 0.622 | 27% | 0.269 | S | S | * | . | P | Polyproline II helix | trans | -93.5 | 146.4 | 173.3 | -66.3 | 0 | 0 | 0 | 0 | 111.9 | S190 N195 | S188-S190 PolarHBondContact O-N 3.32Å; S188-N195 PolarHBondContact O-ND2 3.07Å |
| 189 | P | 93.6 | Very high | 94.5 | Very high | 56 Ų | 56 | 46.8 Ų | 46.8 | 36% | 0.364 | 26% | 0.257 | S | S | . | . | P | Polyproline II helix | trans | -63.7 | 128.2 | 173.1 | 23.9 | -30.7 | 0 | 0 | 0 | 110.9 | Y197 W201 | P189-Y197 HydrophobicContact CB-CD1 3.58Å; P189-Y197 HydrophobicContact CB-CE1 4.08Å; P189-Y197 HydrophobicContact CB-CG 4.14Å; P189-Y197 HydrophobicContact CG-CD1 3.98Å; P189-Y197 HydrophobicContact CG-CE1 3.99Å; P189-W201 HydrophobicContact CB-CE3 4.36Å |
| 190 | S | 93.4 | Very high | 94.5 | Very high | 23 Ų | 23 | 46.4 Ų | 46.4 | 16% | 0.161 | 25% | 0.254 | C | S | . | . | trans | -127.1 | 113.5 | 174.1 | 179.3 | 0 | 0 | 0 | 0 | 110.7 | S188 R192 A194 N195 | S188-S190 PolarHBondContact O-N 3.32Å; S190-R192 VanDerWaalsContact C-N 3.34Å; S190-A194 VanDerWaalsContact O-CA 3.3Å; S190-A194 WeakPolarHBondContact O-CA 3.49Å; S190-A194 PolarHBondContact O-N 3.15Å; S190-N195 PolarHBondContact N-OD1 3.48Å; S190-N195 PolarHBondContact O-N 3.29Å | ||
| 191 | R | 92 | Very high | 94.5 | Very high | 14 Ų | 14 | 42.6 Ų | 42.6 | 5% | 0.053 | 24% | 0.239 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -65.3 | -38.8 | 172.6 | -173.9 | -152.8 | 50.8 | 79.9 | -2.1 | 111.4 | D2 E58 I193 A194 Y198 | D2-R191 HydrophobicContact CB-CB 4.01Å; D2-R191 HydrophobicContact CB-CG 4.23Å; D2-R191 WeakPolarHBondContact OD1-CD 3.24Å; D2-R191 IonicContact OD1-NE 3.09Å; D2-R191 PolarHBondContact OD1-NE 3.4Å; E58-R191 VanDerWaalsContact C-NH2 3.33Å; E58-R191 VanDerWaalsContact O-CZ 3.26Å; E58-R191 PolarHBondContact O-NH1 2.96Å; E58-R191 PolarHBondContact O-NH2 3Å; R191-I193 PolarHBondContact O-N 3.49Å; R191-A194 PolarHBondContact O-N 3.33Å; R191-Y198 HydrophobicContact CB-CD2 4.09Å; R191-Y198 HydrophobicContact CB-CE2 3.75Å; R191-Y198 HydrophobicContact CG-CE1 4.25Å; R191-Y198 HydrophobicContact CG-CE2 3.92Å |
| 192 | R | 91.3 | Very high | 94.6 | Very high | 84 Ų | 84 | 41 Ų | 41 | 32% | 0.317 | 22% | 0.222 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -51.6 | -44 | -172.9 | -64.3 | 180 | 179.3 | -170.2 | -9.4 | 112 | E57 E129 S190 | E57-R192 VanDerWaalsContact O-CD 3.31Å; E57-R192 WeakPolarHBondContact O-CD 3.17Å; E57-R192 WeakPolarHBondContact O-CG 3.3Å; E57-R192 IonicContact OE2-CZ 2.76Å; E57-R192 IonicContact OE2-NH1 3.2Å; E57-R192 PolarHBondContact OE2-NH1 2.89Å; E57-R192 IonicContact OE2-NH2 3.79Å; E57-R192 PolarHBondContact OE2-NH2 2.94Å; E129-R192 CarbonylContact C-O 3.58Å; S190-R192 VanDerWaalsContact C-N 3.34Å |
| 193 | I | 91.5 | Very high | 94.8 | Very high | 3 Ų | 3 | 39.7 Ų | 39.7 | 2% | 0.015 | 22% | 0.215 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -104.3 | -1.3 | 177.6 | 65.4 | -172.9 | 0 | 0 | 0 | 113.2 | L104 L112 F113 R191 N195 | L104-I193 HydrophobicContact CD1-CB 4.22Å; L104-I193 HydrophobicContact CD1-CD1 3.75Å; L104-I193 HydrophobicContact CD1-CG1 3.93Å; L104-I193 HydrophobicContact CD2-CB 4.19Å; L104-I193 HydrophobicContact CD2-CD1 4.17Å; L104-I193 HydrophobicContact CG-CD1 4.47Å; L112-I193 HydrophobicContact CB-CG2 4.24Å; L112-I193 HydrophobicContact CD1-CG2 3.96Å; F113-I193 HydrophobicContact CE1-CG2 4.27Å; F113-I193 HydrophobicContact CE2-CD1 4.3Å; F113-I193 HydrophobicContact CZ-CD1 3.87Å; F113-I193 HydrophobicContact CZ-CG2 4.34Å; R191-I193 PolarHBondContact O-N 3.49Å; I193-N195 HydrophobicContact CD1-CB 4.29Å; I193-N195 HydrophobicContact CG1-CB 4.09Å; I193-N195 PolarHBondContact O-N 3.4Å |
| 194 | A | 94.4 | Very high | 94.9 | Very high | 0 Ų | 0 | 36.9 Ų | 36.9 | 0% | 0 | 20% | 0.2 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 44.3 | 55.5 | -173.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | G136 S190 R191 Y198 | G136-A194 WeakPolarHBondContact CA-O 3.37Å; S190-A194 VanDerWaalsContact O-CA 3.3Å; S190-A194 WeakPolarHBondContact O-CA 3.49Å; S190-A194 PolarHBondContact O-N 3.15Å; R191-A194 PolarHBondContact O-N 3.33Å; A194-Y198 HydrophobicContact CB-CD1 4.04Å; A194-Y198 HydrophobicContact CB-CE1 4.38Å |
| 195 | N | 95.3 | Very high | 95 | Very high | 4 Ų | 4 | 35.1 Ų | 35.1 | 2% | 0.021 | 19% | 0.186 | C | C | . | . | trans | -63.4 | 170.1 | -178.6 | 70.7 | -10.9 | 0 | 0 | 0 | 112.9 | L104 S188 S190 I193 Y197 Y198 V199 | L104-N195 HydrophobicContact CD1-CB 4.06Å; S188-N195 PolarHBondContact O-ND2 3.07Å; S190-N195 PolarHBondContact N-OD1 3.48Å; S190-N195 PolarHBondContact O-N 3.29Å; I193-N195 HydrophobicContact CD1-CB 4.29Å; I193-N195 HydrophobicContact CG1-CB 4.09Å; I193-N195 PolarHBondContact O-N 3.4Å; N195-Y197 VanDerWaalsContact C-N 3.27Å; N195-Y197 PolarHBondContact O-N 2.9Å; N195-Y198 PolarHBondContact O-N 2.91Å; N195-Y198 VanDerWaalsContact O-N 3.12Å; N195-Y198 WeakPolarHBondContact OD1-CB 3.17Å; N195-Y198 PolarHBondContact OD1-N 3.43Å; N195-V199 WeakPolarHBondContact O-CG2 3.37Å; N195-V199 PolarHBondContact O-N 3.18Å | ||
| 196 | S | 96.3 | Very high | 95.3 | Very high | 0 Ų | 0 | 27.2 Ų | 27.2 | 0% | 0 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -57.2 | -40.2 | -177.5 | 57.4 | 0 | 0 | 0 | 0 | 112.7 | A97 Q101 L182 V199 F200 | A97-S196 WeakPolarHBondContact O-CB 3.39Å; Q101-S196 WeakPolarHBondContact CB-OG 3.37Å; Q101-S196 WeakPolarHBondContact CG-OG 3.4Å; Q101-S196 PolarHBondContact OE1-OG 3.4Å; L182-S196 WeakPolarHBondContact CD1-OG 3.49Å; S196-V199 PolarHBondContact O-N 3.06Å; S196-F200 WeakPolarHBondContact O-CD2 3.48Å; S196-F200 WeakPolarHBondContact O-CG 3.49Å; S196-F200 PolarHBondContact O-N 2.8Å |
| 197 | Y | 96.7 | Very high | 95.5 | Very high | 31 Ų | 31 | 24.2 Ų | 24.2 | 12% | 0.122 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -57.9 | -54.1 | 176.7 | -166.2 | -48.7 | 0 | 0 | 0 | 109.5 | L182 D183 L187 P189 N195 V199 F200 W201 | L182-Y197 HydrophobicContact CB-CD2 3.69Å; L182-Y197 HydrophobicContact CB-CE2 4.35Å; L182-Y197 HydrophobicContact CB-CG 4.32Å; L182-Y197 HydrophobicContact CD1-CG 4.49Å; D183-Y197 HydrophobicContact CB-CE2 3.91Å; L187-Y197 WeakPolarHBondContact O-CD2 3.37Å; L187-Y197 WeakPolarHBondContact O-CE2 3.44Å; P189-Y197 HydrophobicContact CB-CD1 3.58Å; P189-Y197 HydrophobicContact CB-CE1 4.08Å; P189-Y197 HydrophobicContact CB-CG 4.14Å; P189-Y197 HydrophobicContact CG-CD1 3.98Å; P189-Y197 HydrophobicContact CG-CE1 3.99Å; N195-Y197 VanDerWaalsContact C-N 3.27Å; N195-Y197 PolarHBondContact O-N 2.9Å; Y197-V199 VanDerWaalsContact C-N 3.28Å; Y197-V199 PolarHBondContact O-N 3.23Å; Y197-F200 PolarHBondContact O-N 3.23Å; Y197-W201 HydrophobicContact CD1-CB 3.98Å; Y197-W201 HydrophobicContact CE1-CB 4.03Å; Y197-W201 HydrophobicContact CE1-CG 4.28Å; Y197-W201 VanDerWaalsContact O-CB 3.25Å; Y197-W201 WeakPolarHBondContact O-CB 3.21Å; Y197-W201 PolarHBondContact O-N 2.97Å |
| 198 | Y | 97 | Very high | 95.7 | Very high | 3 Ų | 3 | 26.3 Ų | 26.3 | 1% | 0.012 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -55.4 | -43.8 | 179.2 | 175 | -98.2 | 0 | 0 | 0 | 111.8 | D2 G6 I140 R191 A194 N195 W201 I202 | D2-Y198 HydrophobicContact CB-CE2 4.37Å; D2-Y198 PolarHBondContact O-OH 3.3Å; G6-Y198 WeakPolarHBondContact CA-OH 3.49Å; G6-Y198 PolarHBondContact N-OH 3.02Å; I140-Y198 HydrophobicContact CD1-CD1 4.34Å; I140-Y198 HydrophobicContact CD1-CE1 3.86Å; R191-Y198 HydrophobicContact CB-CD2 4.09Å; R191-Y198 HydrophobicContact CB-CE2 3.75Å; R191-Y198 HydrophobicContact CG-CE1 4.25Å; R191-Y198 HydrophobicContact CG-CE2 3.92Å; A194-Y198 HydrophobicContact CB-CD1 4.04Å; A194-Y198 HydrophobicContact CB-CE1 4.38Å; N195-Y198 PolarHBondContact O-N 2.91Å; N195-Y198 VanDerWaalsContact O-N 3.12Å; N195-Y198 WeakPolarHBondContact OD1-CB 3.17Å; N195-Y198 PolarHBondContact OD1-N 3.43Å; Y198-W201 HydrophobicContact CD2-CE3 4.44Å; Y198-W201 PolarHBondContact O-N 3.07Å; Y198-I202 HydrophobicContact CD1-CG1 4.35Å; Y198-I202 HydrophobicContact CD2-CG1 4.07Å; Y198-I202 HydrophobicContact CE1-CG1 3.94Å; Y198-I202 HydrophobicContact CE2-CD1 3.81Å; Y198-I202 HydrophobicContact CE2-CG1 3.62Å; Y198-I202 HydrophobicContact CG-CG1 4.41Å; Y198-I202 WeakPolarHBondContact O-CB 3.07Å; Y198-I202 VanDerWaalsContact O-CG1 3.26Å; Y198-I202 WeakPolarHBondContact O-CG1 3.48Å; Y198-I202 PolarHBondContact O-N 3.28Å |
| 199 | V | 97.7 | Very high | 95.8 | Very high | 0 Ų | 0 | 25.7 Ų | 25.7 | 0% | 0 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -58.9 | -51.6 | 177.6 | 172.7 | 0 | 0 | 0 | 0 | 111.9 | A97 G136 A139 I140 I143 N195 S196 Y197 A203 | A97-V199 HydrophobicContact CB-CB 4.18Å; A97-V199 HydrophobicContact CB-CG1 3.94Å; A97-V199 HydrophobicContact CB-CG2 4.4Å; G136-V199 WeakPolarHBondContact O-CG2 3.08Å; A139-V199 HydrophobicContact CB-CG1 3.82Å; A139-V199 HydrophobicContact CB-CG2 4.27Å; I140-V199 HydrophobicContact CD1-CG2 4.46Å; I140-V199 HydrophobicContact CG1-CB 4.19Å; I140-V199 HydrophobicContact CG1-CG1 3.85Å; I140-V199 HydrophobicContact CG1-CG2 4.09Å; I143-V199 HydrophobicContact CD1-CG1 4.13Å; N195-V199 WeakPolarHBondContact O-CG2 3.37Å; N195-V199 PolarHBondContact O-N 3.18Å; S196-V199 PolarHBondContact O-N 3.06Å; Y197-V199 VanDerWaalsContact C-N 3.28Å; Y197-V199 PolarHBondContact O-N 3.23Å; V199-A203 WeakPolarHBondContact O-CB 3.3Å; V199-A203 PolarHBondContact O-N 2.69Å |
| 200 | F | 97.8 | Very high | 95.8 | Very high | 1 Ų | 1 | 24 Ų | 24 | 0% | 0.004 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -69.3 | -35.3 | -178 | -59.3 | -38.9 | 0 | 0 | 0 | 112.1 | V94 A97 L98 M175 L178 L182 S196 Y197 A203 L204 | V94-F200 HydrophobicContact CB-CE1 4.46Å; V94-F200 HydrophobicContact CG1-CE1 4.28Å; V94-F200 HydrophobicContact CG1-CZ 4.21Å; V94-F200 HydrophobicContact CG2-CE1 4.12Å; A97-F200 HydrophobicContact CB-CE1 3.9Å; A97-F200 HydrophobicContact CB-CZ 3.82Å; L98-F200 HydrophobicContact CD2-CE2 4.24Å; L98-F200 HydrophobicContact CD2-CZ 4.22Å; L98-F200 HydrophobicContact CG-CZ 4.42Å; M175-F200 HydrophobicContact SD-CB 4.35Å; M175-F200 HydrophobicContact SD-CD1 3.7Å; M175-F200 HydrophobicContact SD-CE1 4.49Å; M175-F200 HydrophobicContact SD-CG 4.37Å; L178-F200 HydrophobicContact CB-CB 4.41Å; L178-F200 HydrophobicContact CB-CD2 3.72Å; L178-F200 HydrophobicContact CB-CE2 4.11Å; L178-F200 HydrophobicContact CB-CG 4.02Å; L178-F200 HydrophobicContact CD1-CD1 3.99Å; L178-F200 HydrophobicContact CD1-CD2 4.29Å; L178-F200 HydrophobicContact CD1-CE1 3.87Å; L178-F200 HydrophobicContact CD1-CE2 4.17Å; L178-F200 HydrophobicContact CD1-CG 4.21Å; L178-F200 HydrophobicContact CD1-CZ 3.97Å; L178-F200 HydrophobicContact CD2-CE2 4.38Å; L178-F200 HydrophobicContact CG-CD2 4.5Å; L178-F200 HydrophobicContact CG-CE2 4.46Å; L182-F200 HydrophobicContact CD1-CD2 3.64Å; L182-F200 HydrophobicContact CD1-CE2 3.99Å; S196-F200 WeakPolarHBondContact O-CD2 3.48Å; S196-F200 WeakPolarHBondContact O-CG 3.49Å; S196-F200 PolarHBondContact O-N 2.8Å; Y197-F200 PolarHBondContact O-N 3.23Å; F200-A203 PolarHBondContact O-N 3.47Å; F200-L204 VanDerWaalsContact O-CB 3.31Å; F200-L204 WeakPolarHBondContact O-CB 3.41Å; F200-L204 PolarHBondContact O-N 3.36Å |
| 201 | W | 97.4 | Very high | 95.9 | Very high | 84 Ų | 84 | 26.1 Ų | 26.1 | 32% | 0.318 | 12% | 0.123 | S | C | . | . | H | α-helix | trans | -66 | -45 | 176.7 | -177.4 | 56.7 | 0 | 0 | 0 | 111.8 | V3 C179 P189 Y197 Y198 A203 L204 L205 | V3-W201 HydrophobicContact CG2-CH2 3.6Å; V3-W201 HydrophobicContact CG2-CZ2 4.38Å; V3-W201 HydrophobicContact CG2-CZ3 3.89Å; C179-W201 PolarHBondContact SG-N 3.34Å; P189-W201 HydrophobicContact CB-CE3 4.36Å; Y197-W201 HydrophobicContact CD1-CB 3.98Å; Y197-W201 HydrophobicContact CE1-CB 4.03Å; Y197-W201 HydrophobicContact CE1-CG 4.28Å; Y197-W201 VanDerWaalsContact O-CB 3.25Å; Y197-W201 WeakPolarHBondContact O-CB 3.21Å; Y197-W201 PolarHBondContact O-N 2.97Å; Y198-W201 HydrophobicContact CD2-CE3 4.44Å; Y198-W201 PolarHBondContact O-N 3.07Å; W201-A203 VanDerWaalsContact C-N 3.34Å; W201-A203 PolarHBondContact O-N 3.18Å; W201-L204 PolarHBondContact O-N 3.31Å; W201-L205 HydrophobicContact CD2-CD1 4.09Å; W201-L205 HydrophobicContact CH2-CD1 4.41Å; W201-L205 HydrophobicContact CZ2-CD1 3.89Å; W201-L205 WeakPolarHBondContact O-CG 3.14Å; W201-L205 PolarHBondContact O-N 2.84Å |
| 202 | I | 97.9 | Very high | 96 | Very high | 0 Ų | 0 | 30.7 Ų | 30.7 | 0% | 0 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -62.9 | -41.8 | 173.1 | -67.3 | -60 | 0 | 0 | 0 | 111.1 | I140 Y198 L205 S206 | I140-I202 HydrophobicContact CD1-CB 4.19Å; I140-I202 HydrophobicContact CD1-CG1 4.45Å; I140-I202 HydrophobicContact CD1-CG2 4.05Å; I140-I202 HydrophobicContact CG2-CG2 4.04Å; Y198-I202 HydrophobicContact CD1-CG1 4.35Å; Y198-I202 HydrophobicContact CD2-CG1 4.07Å; Y198-I202 HydrophobicContact CE1-CG1 3.94Å; Y198-I202 HydrophobicContact CE2-CD1 3.81Å; Y198-I202 HydrophobicContact CE2-CG1 3.62Å; Y198-I202 HydrophobicContact CG-CG1 4.41Å; Y198-I202 WeakPolarHBondContact O-CB 3.07Å; Y198-I202 VanDerWaalsContact O-CG1 3.26Å; Y198-I202 WeakPolarHBondContact O-CG1 3.48Å; Y198-I202 PolarHBondContact O-N 3.28Å; I202-L205 PolarHBondContact O-N 2.79Å; I202-S206 VanDerWaalsContact O-CB 3.28Å; I202-S206 WeakPolarHBondContact O-CB 3.44Å; I202-S206 PolarHBondContact O-N 3.33Å; I202-S206 PolarHBondContact O-OG 3.33Å |
| 203 | A | 97.8 | Very high | 95.9 | Very high | 0 Ų | 0 | 29.9 Ų | 29.9 | 0% | 0 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -62.1 | -43.6 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.4 | I143 M175 V199 F200 W201 S206 L207 | I143-A203 HydrophobicContact CD1-CB 4.39Å; I143-A203 HydrophobicContact CG2-CB 4.24Å; M175-A203 HydrophobicContact CG-CB 4.07Å; M175-A203 HydrophobicContact SD-CB 3.92Å; V199-A203 WeakPolarHBondContact O-CB 3.3Å; V199-A203 PolarHBondContact O-N 2.69Å; F200-A203 PolarHBondContact O-N 3.47Å; W201-A203 VanDerWaalsContact C-N 3.34Å; W201-A203 PolarHBondContact O-N 3.18Å; A203-S206 PolarHBondContact O-N 2.86Å; A203-L207 VanDerWaalsContact O-CB 3.24Å; A203-L207 WeakPolarHBondContact O-CB 3.12Å; A203-L207 WeakPolarHBondContact O-CD1 3.27Å; A203-L207 WeakPolarHBondContact O-CG 3.49Å; A203-L207 PolarHBondContact O-N 3.31Å |
| 204 | L | 97.9 | Very high | 95.8 | Very high | 33 Ų | 33 | 31.1 Ų | 31.1 | 17% | 0.173 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -59.5 | -51.3 | 176.4 | 175.8 | 61.7 | 0 | 0 | 0 | 111.8 | I172 M175 A176 F200 W201 S206 L207 T208 | I172-L204 HydrophobicContact CG2-CD1 3.83Å; M175-L204 HydrophobicContact CB-CB 4.04Å; M175-L204 HydrophobicContact CB-CD1 4.45Å; A176-L204 HydrophobicContact CB-CD1 4.12Å; A176-L204 HydrophobicContact CB-CD2 4.39Å; F200-L204 VanDerWaalsContact O-CB 3.31Å; F200-L204 WeakPolarHBondContact O-CB 3.41Å; F200-L204 PolarHBondContact O-N 3.36Å; W201-L204 PolarHBondContact O-N 3.31Å; L204-S206 VanDerWaalsContact C-N 3.33Å; L204-S206 PolarHBondContact O-N 3.25Å; L204-L207 PolarHBondContact O-N 3.29Å; L204-T208 WeakPolarHBondContact O-CB 3.44Å; L204-T208 PolarHBondContact O-N 3.04Å; L204-T208 PolarHBondContact O-OG1 3.13Å |
| 205 | L | 97.5 | Very high | 95.5 | Very high | 56 Ų | 56 | 33.7 Ų | 33.7 | 29% | 0.293 | 17% | 0.172 | S | C | . | . | H | α-helix | trans | -59.8 | -45.1 | 178 | -70.7 | 175.7 | 0 | 0 | 0 | 111.2 | V3 M7 W201 I202 T208 D209 | V3-L205 HydrophobicContact CG1-CD1 4Å; V3-L205 HydrophobicContact CG2-CD1 4.24Å; M7-L205 HydrophobicContact CE-CB 3.75Å; W201-L205 HydrophobicContact CD2-CD1 4.09Å; W201-L205 HydrophobicContact CH2-CD1 4.41Å; W201-L205 HydrophobicContact CZ2-CD1 3.89Å; W201-L205 WeakPolarHBondContact O-CG 3.14Å; W201-L205 PolarHBondContact O-N 2.84Å; I202-L205 PolarHBondContact O-N 2.79Å; L205-T208 PolarHBondContact O-N 3.49Å; L205-D209 PolarHBondContact O-N 3.07Å |
| 206 | S | 97.6 | Very high | 95.2 | Very high | 3 Ų | 3 | 38.1 Ų | 38.1 | 2% | 0.021 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -69.2 | -39 | -178.3 | -51.9 | 0 | 0 | 0 | 0 | 112.4 | F10 I202 A203 L204 T208 D209 V210 | F10-S206 WeakPolarHBondContact CG-OG 3.37Å; I202-S206 VanDerWaalsContact O-CB 3.28Å; I202-S206 WeakPolarHBondContact O-CB 3.44Å; I202-S206 PolarHBondContact O-N 3.33Å; I202-S206 PolarHBondContact O-OG 3.33Å; A203-S206 PolarHBondContact O-N 2.86Å; L204-S206 VanDerWaalsContact C-N 3.33Å; L204-S206 PolarHBondContact O-N 3.25Å; S206-T208 VanDerWaalsContact C-N 3.34Å; S206-D209 PolarHBondContact O-N 2.89Å; S206-V210 VanDerWaalsContact O-CG2 3.3Å; S206-V210 WeakPolarHBondContact O-CG2 3.36Å; S206-V210 PolarHBondContact O-N 3.13Å |
| 207 | L | 97.3 | Very high | 94.6 | Very high | 1 Ų | 1 | 40.9 Ų | 40.9 | 1% | 0.005 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -65.4 | -39.7 | 174.7 | -75.8 | 164.7 | 0 | 0 | 0 | 111.5 | F10 V147 I168 L171 I172 M175 A203 L204 V210 F211 | F10-L207 HydrophobicContact CZ-CD2 4.36Å; F10-L207 HydrophobicContact CZ-CG 4.29Å; V147-L207 HydrophobicContact CG1-CD2 4.14Å; V147-L207 HydrophobicContact CG2-CD2 3.56Å; I168-L207 HydrophobicContact CG2-CD2 4.33Å; L171-L207 HydrophobicContact CB-CD1 3.8Å; L171-L207 HydrophobicContact CB-CD2 4.06Å; L171-L207 HydrophobicContact CD1-CD2 4.19Å; I172-L207 HydrophobicContact CD1-CB 4.36Å; I172-L207 HydrophobicContact CG1-CB 3.62Å; M175-L207 HydrophobicContact CG-CD1 3.76Å; A203-L207 VanDerWaalsContact O-CB 3.24Å; A203-L207 WeakPolarHBondContact O-CB 3.12Å; A203-L207 WeakPolarHBondContact O-CD1 3.27Å; A203-L207 WeakPolarHBondContact O-CG 3.49Å; A203-L207 PolarHBondContact O-N 3.31Å; L204-L207 PolarHBondContact O-N 3.29Å; L207-V210 PolarHBondContact O-N 3.09Å; L207-F211 WeakPolarHBondContact O-CB 3.43Å; L207-F211 PolarHBondContact O-N 3.42Å |
| 208 | T | 97.1 | Very high | 94 | Very high | 67 Ų | 67 | 42.4 Ų | 42.4 | 41% | 0.411 | 22% | 0.222 | S | C | . | . | H | α-helix | trans | -63.3 | -43.5 | 175.8 | -56.4 | 0 | 0 | 0 | 0 | 110.8 | L204 L205 S206 F211 L212 | L204-T208 WeakPolarHBondContact O-CB 3.44Å; L204-T208 PolarHBondContact O-N 3.04Å; L204-T208 PolarHBondContact O-OG1 3.13Å; L205-T208 PolarHBondContact O-N 3.49Å; S206-T208 VanDerWaalsContact C-N 3.34Å; T208-F211 PolarHBondContact O-N 3.33Å; T208-L212 WeakPolarHBondContact O-CB 3.32Å; T208-L212 PolarHBondContact O-N 3.36Å |
| 209 | D | 94.4 | Very high | 93.5 | Very high | 77 Ų | 77 | 46.2 Ų | 46.2 | 41% | 0.412 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -60.7 | -48.4 | 174.7 | -175.3 | 47.1 | 0 | 0 | 0 | 111.7 | L205 S206 F211 L212 L213 | L205-D209 PolarHBondContact O-N 3.07Å; S206-D209 PolarHBondContact O-N 2.89Å; D209-F211 VanDerWaalsContact C-N 3.29Å; D209-F211 PolarHBondContact O-N 3.14Å; D209-L212 PolarHBondContact O-N 2.88Å; D209-L213 WeakPolarHBondContact O-CB 3.2Å; D209-L213 WeakPolarHBondContact O-CG 3.42Å; D209-L213 PolarHBondContact O-N 3.04Å |
| 210 | V | 93.8 | Very high | 92.8 | Very high | 19 Ų | 19 | 47.4 Ų | 47.4 | 12% | 0.115 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -59.9 | -40.1 | 175.7 | 175.3 | 0 | 0 | 0 | 0 | 111.6 | F10 L14 L151 I168 S206 L207 L214 | F10-V210 HydrophobicContact CE1-CG2 4.39Å; L14-V210 HydrophobicContact CD2-CG2 4.35Å; L151-V210 HydrophobicContact CD1-CG1 4.16Å; I168-V210 HydrophobicContact CD1-CG1 3.85Å; S206-V210 VanDerWaalsContact O-CG2 3.3Å; S206-V210 WeakPolarHBondContact O-CG2 3.36Å; S206-V210 PolarHBondContact O-N 3.13Å; L207-V210 PolarHBondContact O-N 3.09Å; V210-L214 WeakPolarHBondContact O-CB 3.03Å; V210-L214 PolarHBondContact O-N 2.92Å |
| 211 | F | 94.5 | Very high | 91.9 | Very high | 68 Ų | 68 | 49.5 Ų | 49.5 | 30% | 0.298 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -65.9 | -44 | 177.1 | -173 | -94.2 | 0 | 0 | 0 | 111.9 | A165 I168 A169 I172 L207 T208 D209 L214 V215 | A165-F211 HydrophobicContact CB-CE2 4.17Å; I168-F211 HydrophobicContact CB-CD2 4.32Å; I168-F211 HydrophobicContact CG2-CB 3.89Å; I168-F211 HydrophobicContact CG2-CD2 3.99Å; I168-F211 HydrophobicContact CG2-CG 4.43Å; A169-F211 HydrophobicContact CB-CE2 4.34Å; I172-F211 HydrophobicContact CD1-CB 3.85Å; I172-F211 HydrophobicContact CD1-CD2 4.49Å; I172-F211 HydrophobicContact CD1-CG 4.16Å; L207-F211 WeakPolarHBondContact O-CB 3.43Å; L207-F211 PolarHBondContact O-N 3.42Å; T208-F211 PolarHBondContact O-N 3.33Å; D209-F211 VanDerWaalsContact C-N 3.29Å; D209-F211 PolarHBondContact O-N 3.14Å; F211-L214 WeakPolarHBondContact O-CB 3.06Å; F211-L214 PolarHBondContact O-N 3.36Å; F211-V215 HydrophobicContact CD1-CG2 4.21Å; F211-V215 HydrophobicContact CE1-CG2 3.89Å; F211-V215 HydrophobicContact CZ-CG2 4.37Å; F211-V215 WeakPolarHBondContact O-CG2 3.4Å; F211-V215 PolarHBondContact O-N 3.48Å |
| 212 | L | 93.8 | Very high | 91.2 | Very high | 111 Ų | 111 | 49.7 Ų | 49.7 | 58% | 0.581 | 28% | 0.276 | S | S | * | . | H | α-helix | trans | -62.9 | -43.6 | 176.9 | -179 | 63.5 | 0 | 0 | 0 | 111.4 | T208 D209 L214 V215 L216 | T208-L212 WeakPolarHBondContact O-CB 3.32Å; T208-L212 PolarHBondContact O-N 3.36Å; D209-L212 PolarHBondContact O-N 2.88Å; L212-L214 VanDerWaalsContact C-N 3.28Å; L212-L214 PolarHBondContact O-N 2.64Å; L212-V215 PolarHBondContact O-N 3.1Å; L212-L216 WeakPolarHBondContact O-CB 3.02Å; L212-L216 PolarHBondContact O-N 2.86Å |
| 213 | L | 89.8 | Confident | 90.4 | Very high | 67 Ų | 67 | 55.4 Ų | 55.4 | 35% | 0.351 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -61.2 | -37.2 | 174.5 | -72.4 | 172.6 | 0 | 0 | 0 | 111.9 | D209 T217 | D209-L213 WeakPolarHBondContact O-CB 3.2Å; D209-L213 WeakPolarHBondContact O-CG 3.42Å; D209-L213 PolarHBondContact O-N 3.04Å; L213-T217 VanDerWaalsContact O-CB 3.31Å; L213-T217 WeakPolarHBondContact O-CB 3.32Å; L213-T217 PolarHBondContact O-N 2.9Å; L213-T217 PolarHBondContact O-OG1 3.25Å |
| 214 | L | 88.8 | Confident | 89.3 | Confident | 28 Ų | 28 | 56.4 Ų | 56.4 | 15% | 0.147 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -63.2 | -45.7 | 173.8 | -176.6 | 66.5 | 0 | 0 | 0 | 111.2 | V161 I164 A165 V210 F211 L212 T217 L218 | V161-L214 HydrophobicContact CG1-CD1 3.86Å; V161-L214 HydrophobicContact CG1-CD2 4.18Å; V161-L214 HydrophobicContact CG1-CG 4.24Å; I164-L214 HydrophobicContact CG2-CD2 4.13Å; A165-L214 HydrophobicContact CB-CD2 4.08Å; V210-L214 WeakPolarHBondContact O-CB 3.03Å; V210-L214 PolarHBondContact O-N 2.92Å; F211-L214 WeakPolarHBondContact O-CB 3.06Å; F211-L214 PolarHBondContact O-N 3.36Å; L212-L214 VanDerWaalsContact C-N 3.28Å; L212-L214 PolarHBondContact O-N 2.64Å; L214-T217 WeakPolarHBondContact O-CB 3.47Å; L214-T217 PolarHBondContact O-N 3.22Å; L214-L218 WeakPolarHBondContact O-CG 3.18Å; L214-L218 PolarHBondContact O-N 3.38Å |
| 215 | V | 89.8 | Confident | 88.2 | Confident | 55 Ų | 55 | 60.4 Ų | 60.4 | 33% | 0.333 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -62.6 | -46.7 | 176.9 | 172.7 | 0 | 0 | 0 | 0 | 111.2 | F211 L212 T217 L218 I219 | F211-V215 HydrophobicContact CD1-CG2 4.21Å; F211-V215 HydrophobicContact CE1-CG2 3.89Å; F211-V215 HydrophobicContact CZ-CG2 4.37Å; F211-V215 WeakPolarHBondContact O-CG2 3.4Å; F211-V215 PolarHBondContact O-N 3.48Å; L212-V215 PolarHBondContact O-N 3.1Å; V215-T217 VanDerWaalsContact C-N 3.28Å; V215-T217 PolarHBondContact O-N 2.78Å; V215-L218 WeakPolarHBondContact O-CB 3.5Å; V215-L218 PolarHBondContact O-N 3.43Å; V215-L218 VanDerWaalsContact O-N 3.16Å; V215-I219 HydrophobicContact CG1-CD1 3.82Å; V215-I219 HydrophobicContact CG1-CG1 4.41Å; V215-I219 WeakPolarHBondContact O-CG1 3.4Å; V215-I219 PolarHBondContact O-N 3.23Å |
| 216 | L | 88.2 | Confident | 87.5 | Confident | 96 Ų | 96 | 67.6 Ų | 67.6 | 50% | 0.503 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -58.5 | -42.9 | 176.5 | -179 | 64.1 | 0 | 0 | 0 | 111.3 | L212 L218 I219 A220 | L212-L216 WeakPolarHBondContact O-CB 3.02Å; L212-L216 PolarHBondContact O-N 2.86Å; L216-L218 VanDerWaalsContact C-N 3.34Å; L216-L218 PolarHBondContact O-N 3.04Å; L216-I219 PolarHBondContact O-N 2.99Å; L216-A220 WeakPolarHBondContact O-CB 3.3Å; L216-A220 PolarHBondContact O-N 2.96Å |
| 217 | T | 83.5 | Confident | 86.6 | Confident | 58 Ų | 58 | 72.8 Ų | 72.8 | 36% | 0.356 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -61.1 | -43 | 176.7 | -60.4 | 0 | 0 | 0 | 0 | 111.7 | L213 L214 V215 A220 L221 Y242 | L213-T217 VanDerWaalsContact O-CB 3.31Å; L213-T217 WeakPolarHBondContact O-CB 3.32Å; L213-T217 PolarHBondContact O-N 2.9Å; L213-T217 PolarHBondContact O-OG1 3.25Å; L214-T217 WeakPolarHBondContact O-CB 3.47Å; L214-T217 PolarHBondContact O-N 3.22Å; V215-T217 VanDerWaalsContact C-N 3.28Å; V215-T217 PolarHBondContact O-N 2.78Å; T217-A220 PolarHBondContact O-N 3.44Å; T217-L221 WeakPolarHBondContact O-CB 3.48Å; T217-L221 PolarHBondContact O-N 3.41Å; T217-Y242 VanDerWaalsContact CA-OH 3.24Å; T217-Y242 WeakPolarHBondContact CA-OH 3.39Å; T217-Y242 VanDerWaalsContact CB-OH 3.31Å; T217-Y242 WeakPolarHBondContact CB-OH 3.39Å; T217-Y242 VanDerWaalsContact CG2-OH 3.29Å; T217-Y242 WeakPolarHBondContact CG2-OH 3.23Å; T217-Y242 PolarHBondContact OG1-OH 2.88Å |
| 218 | L | 84.6 | Confident | 85.1 | Confident | 64 Ų | 64 | 74.9 Ų | 74.9 | 34% | 0.335 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -65.3 | -43.5 | 176.9 | -73 | 176.4 | 0 | 0 | 0 | 112 | V161 L214 V215 L216 L221 C222 | V161-L218 HydrophobicContact CB-CD2 4.46Å; V161-L218 HydrophobicContact CG1-CD1 3.9Å; V161-L218 HydrophobicContact CG1-CD2 3.97Å; V161-L218 HydrophobicContact CG1-CG 4.28Å; V161-L218 HydrophobicContact CG2-CD2 4.42Å; L214-L218 WeakPolarHBondContact O-CG 3.18Å; L214-L218 PolarHBondContact O-N 3.38Å; V215-L218 WeakPolarHBondContact O-CB 3.5Å; V215-L218 PolarHBondContact O-N 3.43Å; V215-L218 VanDerWaalsContact O-N 3.16Å; L216-L218 VanDerWaalsContact C-N 3.34Å; L216-L218 PolarHBondContact O-N 3.04Å; L218-L221 WeakPolarHBondContact O-CB 3.45Å; L218-L221 PolarHBondContact O-N 2.92Å; L218-C222 PolarHBondContact O-N 3.17Å; L218-C222 PolarHBondContact O-SG 2.82Å |
| 219 | I | 86.4 | Confident | 83.4 | Confident | 82 Ų | 82 | 76 Ų | 76 | 42% | 0.421 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -60.3 | -48.1 | 176.7 | -69.6 | 168.6 | 0 | 0 | 0 | 110.2 | V215 L216 L221 C222 F223 | V215-I219 HydrophobicContact CG1-CD1 3.82Å; V215-I219 HydrophobicContact CG1-CG1 4.41Å; V215-I219 WeakPolarHBondContact O-CG1 3.4Å; V215-I219 PolarHBondContact O-N 3.23Å; L216-I219 PolarHBondContact O-N 2.99Å; I219-L221 VanDerWaalsContact C-N 3.29Å; I219-L221 PolarHBondContact O-N 2.88Å; I219-C222 WeakPolarHBondContact O-CB 3.14Å; I219-C222 PolarHBondContact O-N 2.97Å; I219-C222 VanDerWaalsContact O-N 3.14Å; I219-F223 HydrophobicContact CG2-CD2 3.67Å; I219-F223 HydrophobicContact CG2-CE2 3.52Å; I219-F223 VanDerWaalsContact O-CD2 3.26Å; I219-F223 WeakPolarHBondContact O-CD2 3.26Å; I219-F223 PolarHBondContact O-N 3.13Å |
| 220 | A | 82.6 | Confident | 81.8 | Confident | 25 Ų | 25 | 77.4 Ų | 77.4 | 21% | 0.207 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -62 | -38.9 | 179.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | L216 T217 F223 Y224 L241 | L216-A220 WeakPolarHBondContact O-CB 3.3Å; L216-A220 PolarHBondContact O-N 2.96Å; T217-A220 PolarHBondContact O-N 3.44Å; A220-F223 PolarHBondContact O-N 3.04Å; A220-Y224 WeakPolarHBondContact O-CB 3.48Å; A220-Y224 PolarHBondContact O-N 3.32Å; A220-L241 HydrophobicContact CB-CD2 3.45Å; A220-L241 VanDerWaalsContact CB-CD2 3.45Å |
| 221 | L | 79.1 | Confident | 79.9 | Confident | 46 Ų | 46 | 82 Ų | 82 | 24% | 0.241 | 43% | 0.43 | C | S | . | . | H | α-helix | trans | -64.3 | -42.2 | 173.3 | -169.3 | 67 | 0 | 0 | 0 | 112 | T217 L218 I219 Y224 Y225 | T217-L221 WeakPolarHBondContact O-CB 3.48Å; T217-L221 PolarHBondContact O-N 3.41Å; L218-L221 WeakPolarHBondContact O-CB 3.45Å; L218-L221 PolarHBondContact O-N 2.92Å; I219-L221 VanDerWaalsContact C-N 3.29Å; I219-L221 PolarHBondContact O-N 2.88Å; L221-Y224 WeakPolarHBondContact O-CB 3.45Å; L221-Y224 PolarHBondContact O-N 2.93Å; L221-Y225 HydrophobicContact CD1-CD2 3.98Å; L221-Y225 HydrophobicContact CD1-CE2 3.52Å; L221-Y225 HydrophobicContact CD2-CE2 4.09Å; L221-Y225 HydrophobicContact CG-CD2 3.78Å; L221-Y225 HydrophobicContact CG-CE2 3.59Å; L221-Y225 VanDerWaalsContact O-CD2 3.28Å; L221-Y225 WeakPolarHBondContact O-CD2 3.43Å; L221-Y225 PolarHBondContact O-N 3.47Å |
| 222 | C | 82.6 | Confident | 78 | Confident | 87 Ų | 87 | 85.8 Ų | 85.8 | 59% | 0.588 | 45% | 0.453 | S | S | * | . | H | α-helix | trans | -62 | -43.6 | 175.6 | -71.8 | 0 | 0 | 0 | 0 | 112.3 | L218 I219 Y224 R226 | L218-C222 PolarHBondContact O-N 3.17Å; L218-C222 PolarHBondContact O-SG 2.82Å; I219-C222 WeakPolarHBondContact O-CB 3.14Å; I219-C222 PolarHBondContact O-N 2.97Å; I219-C222 VanDerWaalsContact O-N 3.14Å; C222-Y224 VanDerWaalsContact C-N 3.32Å; C222-R226 VanDerWaalsContact O-CB 3.24Å; C222-R226 WeakPolarHBondContact O-CB 3.08Å; C222-R226 PolarHBondContact O-N 3.38Å |
| 223 | F | 82.4 | Confident | 76 | Confident | 121 Ų | 121 | 82.7 Ų | 82.7 | 53% | 0.531 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -62 | -42.2 | 174.2 | -83.9 | -71.3 | 0 | 0 | 0 | 111.8 | I219 A220 R226 N227 | I219-F223 HydrophobicContact CG2-CD2 3.67Å; I219-F223 HydrophobicContact CG2-CE2 3.52Å; I219-F223 VanDerWaalsContact O-CD2 3.26Å; I219-F223 WeakPolarHBondContact O-CD2 3.26Å; I219-F223 PolarHBondContact O-N 3.13Å; A220-F223 PolarHBondContact O-N 3.04Å; F223-R226 PolarHBondContact O-N 2.86Å; F223-N227 WeakPolarHBondContact O-CB 3.35Å; F223-N227 VanDerWaalsContact O-CG 3.3Å; F223-N227 PolarHBondContact O-N 3.11Å; F223-N227 VanDerWaalsContact O-N 3.08Å; F223-N227 PolarHBondContact O-ND2 2.74Å |
| 224 | Y | 74.1 | Confident | 74.3 | Confident | 21 Ų | 21 | 88.7 Ų | 88.7 | 8% | 0.082 | 46% | 0.457 | C | S | . | . | H | α-helix | trans | -59.8 | -51.2 | 177.9 | -178.3 | -97.9 | 0 | 0 | 0 | 112.4 | A220 L221 C222 R226 N227 L229 V233 Y240 | A220-Y224 WeakPolarHBondContact O-CB 3.48Å; A220-Y224 PolarHBondContact O-N 3.32Å; L221-Y224 WeakPolarHBondContact O-CB 3.45Å; L221-Y224 PolarHBondContact O-N 2.93Å; C222-Y224 VanDerWaalsContact C-N 3.32Å; Y224-R226 PolarHBondContact O-N 2.92Å; Y224-N227 PolarHBondContact O-N 2.67Å; Y224-L229 HydrophobicContact CD2-CB 3.86Å; Y224-L229 HydrophobicContact CD2-CD1 3.54Å; Y224-L229 HydrophobicContact CD2-CG 4.35Å; Y224-L229 HydrophobicContact CE1-CB 4Å; Y224-L229 HydrophobicContact CE2-CB 3.24Å; Y224-L229 HydrophobicContact CE2-CD1 3.5Å; Y224-L229 VanDerWaalsContact CE2-CD1 3.5Å; Y224-L229 HydrophobicContact CE2-CG 3.95Å; Y224-L229 HydrophobicContact CG-CB 4.48Å; Y224-L229 WeakPolarHBondContact OH-CB 3.22Å; Y224-L229 PolarHBondContact OH-O 2.87Å; Y224-V233 WeakPolarHBondContact OH-CB 3.3Å; Y224-V233 WeakPolarHBondContact OH-CG2 3.36Å; Y224-Y240 WeakPolarHBondContact CD1-OH 3.37Å; Y224-Y240 AromaticContact CD2-CE2 3.38Å; Y224-Y240 HydrophobicContact CD2-CE2 3.38Å; Y224-Y240 AromaticContact CD2-CZ 3.4Å; Y224-Y240 WeakPolarHBondContact CD2-OH 3.38Å; Y224-Y240 AromaticContact CE1-CZ 3.99Å; Y224-Y240 WeakPolarHBondContact CE1-OH 3.26Å; Y224-Y240 HydrophobicContact CE2-CD2 4.31Å; Y224-Y240 AromaticContact CE2-CE1 3.96Å; Y224-Y240 HydrophobicContact CE2-CE1 3.96Å; Y224-Y240 AromaticContact CE2-CE2 3.19Å; Y224-Y240 HydrophobicContact CE2-CE2 3.19Å; Y224-Y240 AromaticContact CE2-CZ 3.04Å; Y224-Y240 WeakPolarHBondContact CE2-OH 3.42Å; Y224-Y240 HydrophobicContact CG-CE2 4.28Å; Y224-Y240 AromaticContact CG-CZ 3.96Å; Y224-Y240 AromaticContact CZ-CE1 3.92Å; Y224-Y240 AromaticContact CZ-CZ 3.37Å |
| 225 | Y | 75.2 | Confident | 72.6 | Confident | 117 Ų | 117 | 93.3 Ų | 93.3 | 46% | 0.459 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -65.1 | -38.3 | 177.9 | -81.5 | -66.6 | 0 | 0 | 0 | 112.6 | L221 N227 G228 D230 | L221-Y225 HydrophobicContact CD1-CD2 3.98Å; L221-Y225 HydrophobicContact CD1-CE2 3.52Å; L221-Y225 HydrophobicContact CD2-CE2 4.09Å; L221-Y225 HydrophobicContact CG-CD2 3.78Å; L221-Y225 HydrophobicContact CG-CE2 3.59Å; L221-Y225 VanDerWaalsContact O-CD2 3.28Å; L221-Y225 WeakPolarHBondContact O-CD2 3.43Å; L221-Y225 PolarHBondContact O-N 3.47Å; Y225-N227 VanDerWaalsContact C-N 3.28Å; Y225-N227 PolarHBondContact O-N 3.33Å; Y225-G228 PolarHBondContact O-N 2.95Å; Y225-D230 WeakPolarHBondContact CE1-OD1 3.24Å |
| 226 | R | 82.3 | Confident | 70.7 | Confident | 206 Ų | 206 | 97.3 Ų | 97.3 | 78% | 0.777 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -63.5 | -33.4 | 178 | -176.9 | 175.5 | 178.8 | 176.6 | 0 | 112.7 | C222 F223 Y224 G228 | C222-R226 VanDerWaalsContact O-CB 3.24Å; C222-R226 WeakPolarHBondContact O-CB 3.08Å; C222-R226 PolarHBondContact O-N 3.38Å; F223-R226 PolarHBondContact O-N 2.86Å; Y224-R226 PolarHBondContact O-N 2.92Å; R226-G228 PolarHBondContact O-N 2.97Å |
| 227 | N | 77.7 | Confident | 68.9 | Low | 112 Ų | 112 | 96 Ų | 96 | 60% | 0.599 | 50% | 0.495 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -81.7 | 7.7 | -179.4 | -70 | -22 | 0 | 0 | 0 | 113.6 | F223 Y224 Y225 L229 | F223-N227 WeakPolarHBondContact O-CB 3.35Å; F223-N227 VanDerWaalsContact O-CG 3.3Å; F223-N227 PolarHBondContact O-N 3.11Å; F223-N227 VanDerWaalsContact O-N 3.08Å; F223-N227 PolarHBondContact O-ND2 2.74Å; Y224-N227 PolarHBondContact O-N 2.67Å; Y225-N227 VanDerWaalsContact C-N 3.28Å; Y225-N227 PolarHBondContact O-N 3.33Å; N227-L229 HydrophobicContact CB-CD1 4.28Å; N227-L229 PolarHBondContact O-N 2.76Å |
| 228 | G | 65.6 | Low | 67.6 | Low | 46 Ų | 46 | 96.2 Ų | 96.2 | 47% | 0.474 | 49% | 0.492 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 69.6 | 18.8 | 172.1 | 0 | 0 | 0 | 0 | 0 | 114.6 | Y225 R226 D230 | Y225-G228 PolarHBondContact O-N 2.95Å; R226-G228 PolarHBondContact O-N 2.97Å; G228-D230 PolarHBondContact O-N 3.32Å; G228-D230 VanDerWaalsContact O-N 3.09Å |
| 229 | L | 63.3 | Low | 66.3 | Low | 90 Ų | 90 | 99.2 Ų | 99.2 | 47% | 0.471 | 50% | 0.5 | S | S | . | . | G | 310 helix | trans | -75.6 | 12.4 | 177.2 | -68.1 | 160.7 | 0 | 0 | 0 | 112.8 | Y224 N227 T231 | Y224-L229 HydrophobicContact CD2-CB 3.86Å; Y224-L229 HydrophobicContact CD2-CD1 3.54Å; Y224-L229 HydrophobicContact CD2-CG 4.35Å; Y224-L229 HydrophobicContact CE1-CB 4Å; Y224-L229 HydrophobicContact CE2-CB 3.24Å; Y224-L229 HydrophobicContact CE2-CD1 3.5Å; Y224-L229 VanDerWaalsContact CE2-CD1 3.5Å; Y224-L229 HydrophobicContact CE2-CG 3.95Å; Y224-L229 HydrophobicContact CG-CB 4.48Å; Y224-L229 WeakPolarHBondContact OH-CB 3.22Å; Y224-L229 PolarHBondContact OH-O 2.87Å; N227-L229 HydrophobicContact CB-CD1 4.28Å; N227-L229 PolarHBondContact O-N 2.76Å; L229-T231 PolarHBondContact O-N 3.41Å |
| 230 | D | 59.4 | Low | 64.8 | Low | 107 Ų | 107 | 99 Ų | 99 | 57% | 0.572 | 49% | 0.494 | S | S | * | . | G | 310 helix | trans | -66.1 | -7.6 | -176 | -151.5 | 15.9 | 0 | 0 | 0 | 113.6 | Y225 G228 N232 | Y225-D230 WeakPolarHBondContact CE1-OD1 3.24Å; G228-D230 PolarHBondContact O-N 3.32Å; G228-D230 VanDerWaalsContact O-N 3.09Å; D230-N232 PolarHBondContact O-N 2.86Å |
| 231 | T | 55 | Low | 63.7 | Low | 115 Ų | 115 | 100.1 Ų | 100.1 | 71% | 0.706 | 50% | 0.497 | S | S | * | . | G | 310 helix | trans | -84.4 | -10.2 | -162.3 | 54.4 | 0 | 0 | 0 | 0 | 115.9 | L229 | L229-T231 PolarHBondContact O-N 3.41Š|
| 232 | N | 53.6 | Low | 63 | Low | 147 Ų | 147 | 101 Ų | 101 | 79% | 0.786 | 50% | 0.497 | S | S | * | . | S | Bend | trans | -146.1 | 6 | -176.1 | -82.9 | -45.1 | 0 | 0 | 0 | 116.9 | D230 | D230-N232 PolarHBondContact O-N 2.86Š|
| 233 | V | 53.1 | Low | 62 | Low | 47 Ų | 47 | 100.4 Ų | 100.4 | 29% | 0.285 | 49% | 0.488 | S | S | . | . | trans | -102.6 | 106.1 | -170.5 | 161.3 | 0 | 0 | 0 | 0 | 110.1 | Y224 D237 Y240 | Y224-V233 WeakPolarHBondContact OH-CB 3.3Å; Y224-V233 WeakPolarHBondContact OH-CG2 3.36Å; V233-D237 WeakPolarHBondContact CA-OD2 3.35Å; V233-D237 HydrophobicContact CB-CB 3.97Å; V233-D237 HydrophobicContact CG1-CB 3.41Å; V233-D237 VanDerWaalsContact CG1-CB 3.41Å; V233-D237 HydrophobicContact CG2-CB 3.96Å; V233-Y240 HydrophobicContact CB-CE1 4.48Å; V233-Y240 HydrophobicContact CG1-CD1 4.36Å; V233-Y240 HydrophobicContact CG1-CE1 3.66Å; V233-Y240 HydrophobicContact CG2-CD1 4.23Å; V233-Y240 HydrophobicContact CG2-CE1 4.01Å | ||
| 234 | R | 53 | Low | 61.2 | Low | 192 Ų | 192 | 95.8 Ų | 95.8 | 73% | 0.725 | 48% | 0.475 | S | S | * | . | trans | -61.1 | 154.6 | 166.3 | -77.9 | -178.1 | 168 | -176.9 | -1.2 | 107.6 | E236 D237 | R234-E236 PolarHBondContact O-N 2.88Å; R234-D237 PolarHBondContact N-OD2 2.71Å; R234-D237 WeakPolarHBondContact O-CB 3.42Å; R234-D237 PolarHBondContact O-N 3.4Å | ||
| 235 | T | 52.9 | Low | 61.4 | Low | 125 Ų | 125 | 96.6 Ų | 96.6 | 77% | 0.767 | 48% | 0.483 | S | S | * | . | G | 310 helix | trans | -51 | -19.9 | 175 | 27.3 | 0 | 0 | 0 | 0 | 114.4 | D237 H238 | T235-D237 VanDerWaalsContact C-N 3.34Å; T235-H238 PolarHBondContact O-ND1 3.36Å |
| 236 | E | 50.9 | Low | 61.8 | Low | 140 Ų | 140 | 94.6 Ų | 94.6 | 65% | 0.654 | 48% | 0.48 | S | S | * | . | G | 310 helix | trans | -74.4 | -19.2 | 174.6 | -61.9 | -174 | 155.8 | 0 | 0 | 113.8 | R234 H238 Y239 | R234-E236 PolarHBondContact O-N 2.88Å; E236-H238 PolarHBondContact O-N 2.9Å; E236-Y239 WeakPolarHBondContact O-CD2 3.36Å; E236-Y239 WeakPolarHBondContact O-CE2 3.31Å |
| 237 | D | 50.8 | Low | 61.7 | Low | 69 Ų | 69 | 91.6 Ų | 91.6 | 37% | 0.369 | 47% | 0.469 | S | S | . | . | G | 310 helix | trans | -84.4 | -8.9 | -172.6 | -68.7 | -34.9 | 0 | 0 | 0 | 113.5 | V233 R234 T235 Y239 Y240 | V233-D237 WeakPolarHBondContact CA-OD2 3.35Å; V233-D237 HydrophobicContact CB-CB 3.97Å; V233-D237 HydrophobicContact CG1-CB 3.41Å; V233-D237 VanDerWaalsContact CG1-CB 3.41Å; V233-D237 HydrophobicContact CG2-CB 3.96Å; R234-D237 PolarHBondContact N-OD2 2.71Å; R234-D237 WeakPolarHBondContact O-CB 3.42Å; R234-D237 PolarHBondContact O-N 3.4Å; T235-D237 VanDerWaalsContact C-N 3.34Å; D237-Y239 PolarHBondContact O-N 3.47Å; D237-Y240 HydrophobicContact CB-CD1 4.3Å; D237-Y240 WeakPolarHBondContact O-CD1 3.35Å; D237-Y240 WeakPolarHBondContact O-CE1 3.44Å; D237-Y240 PolarHBondContact O-N 3.43Å |
| 238 | H | 55.8 | Low | 61.9 | Low | 62 Ų | 62 | 87.3 Ų | 87.3 | 29% | 0.287 | 45% | 0.445 | S | S | . | . | G | 310 helix | trans | -53.5 | -10.3 | 177.8 | -69.6 | 84.2 | 0 | 0 | 0 | 114.9 | T235 E236 Y240 | T235-H238 PolarHBondContact O-ND1 3.36Å; E236-H238 PolarHBondContact O-N 2.9Å; H238-Y240 PolarHBondContact O-N 2.96Å |
| 239 | Y | 55.9 | Low | 62.7 | Low | 126 Ų | 126 | 85.1 Ų | 85.1 | 49% | 0.494 | 42% | 0.423 | S | S | . | . | G | 310 helix | trans | -57.4 | -31.5 | 166.9 | -64.8 | -71.7 | 0 | 0 | 0 | 113.3 | E236 D237 L241 Y242 D243 | E236-Y239 WeakPolarHBondContact O-CD2 3.36Å; E236-Y239 WeakPolarHBondContact O-CE2 3.31Å; D237-Y239 PolarHBondContact O-N 3.47Å; Y239-L241 PolarHBondContact O-N 2.98Å; Y239-Y242 PolarHBondContact O-N 3.26Å; Y239-D243 WeakPolarHBondContact O-CB 3.5Å; Y239-D243 PolarHBondContact O-N 2.76Å |
| 240 | Y | 56 | Low | 63.8 | Low | 78 Ų | 78 | 82.8 Ų | 82.8 | 31% | 0.306 | 41% | 0.41 | S | S | . | . | G | 310 helix | trans | -59.6 | -32.6 | -177.7 | 74.1 | -97.9 | 0 | 0 | 0 | 112.5 | Y224 V233 D237 H238 Y242 D243 | Y224-Y240 WeakPolarHBondContact CD1-OH 3.37Å; Y224-Y240 AromaticContact CD2-CE2 3.38Å; Y224-Y240 HydrophobicContact CD2-CE2 3.38Å; Y224-Y240 AromaticContact CD2-CZ 3.4Å; Y224-Y240 WeakPolarHBondContact CD2-OH 3.38Å; Y224-Y240 AromaticContact CE1-CZ 3.99Å; Y224-Y240 WeakPolarHBondContact CE1-OH 3.26Å; Y224-Y240 HydrophobicContact CE2-CD2 4.31Å; Y224-Y240 AromaticContact CE2-CE1 3.96Å; Y224-Y240 HydrophobicContact CE2-CE1 3.96Å; Y224-Y240 AromaticContact CE2-CE2 3.19Å; Y224-Y240 HydrophobicContact CE2-CE2 3.19Å; Y224-Y240 AromaticContact CE2-CZ 3.04Å; Y224-Y240 WeakPolarHBondContact CE2-OH 3.42Å; Y224-Y240 HydrophobicContact CG-CE2 4.28Å; Y224-Y240 AromaticContact CG-CZ 3.96Å; Y224-Y240 AromaticContact CZ-CE1 3.92Å; Y224-Y240 AromaticContact CZ-CZ 3.37Å; V233-Y240 HydrophobicContact CB-CE1 4.48Å; V233-Y240 HydrophobicContact CG1-CD1 4.36Å; V233-Y240 HydrophobicContact CG1-CE1 3.66Å; V233-Y240 HydrophobicContact CG2-CD1 4.23Å; V233-Y240 HydrophobicContact CG2-CE1 4.01Å; D237-Y240 HydrophobicContact CB-CD1 4.3Å; D237-Y240 WeakPolarHBondContact O-CD1 3.35Å; D237-Y240 WeakPolarHBondContact O-CE1 3.44Å; D237-Y240 PolarHBondContact O-N 3.43Å; H238-Y240 PolarHBondContact O-N 2.96Å; Y240-Y242 PolarHBondContact O-N 3.38Å; Y240-Y242 VanDerWaalsContact O-N 3.09Å; Y240-D243 PolarHBondContact O-N 3.03Å |
| 241 | L | 59.8 | Low | 64.9 | Low | 49 Ų | 49 | 82.2 Ų | 82.2 | 26% | 0.257 | 41% | 0.407 | S | S | . | . | G | 310 helix | trans | -60.2 | -23.6 | -179.9 | -103.8 | 143.3 | 0 | 0 | 0 | 112.8 | A220 Y239 | A220-L241 HydrophobicContact CB-CD2 3.45Å; A220-L241 VanDerWaalsContact CB-CD2 3.45Å; Y239-L241 PolarHBondContact O-N 2.98Å |
| 242 | Y | 63.5 | Low | 66.1 | Low | 65 Ų | 65 | 78.9 Ų | 78.9 | 26% | 0.255 | 39% | 0.391 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -121.7 | -3.8 | -176.3 | -60 | -75.5 | 0 | 0 | 0 | 112.5 | T217 Y239 Y240 S245 Q248 | T217-Y242 VanDerWaalsContact CA-OH 3.24Å; T217-Y242 WeakPolarHBondContact CA-OH 3.39Å; T217-Y242 VanDerWaalsContact CB-OH 3.31Å; T217-Y242 WeakPolarHBondContact CB-OH 3.39Å; T217-Y242 VanDerWaalsContact CG2-OH 3.29Å; T217-Y242 WeakPolarHBondContact CG2-OH 3.23Å; T217-Y242 PolarHBondContact OG1-OH 2.88Å; Y239-Y242 PolarHBondContact O-N 3.26Å; Y240-Y242 PolarHBondContact O-N 3.38Å; Y240-Y242 VanDerWaalsContact O-N 3.09Å; Y242-S245 VanDerWaalsContact O-CB 3.26Å; Y242-S245 WeakPolarHBondContact O-CB 3.32Å; Y242-S245 PolarHBondContact O-N 2.96Å; Y242-S245 VanDerWaalsContact O-N 3.15Å; Y242-S245 PolarHBondContact O-OG 3.03Å; Y242-Q248 VanDerWaalsContact C-CD 3.47Å; Y242-Q248 VanDerWaalsContact C-NE2 3.27Å; Y242-Q248 WeakPolarHBondContact O-CG 3.4Å; Y242-Q248 PolarHBondContact O-NE2 3.14Å; Y242-Q248 VanDerWaalsContact O-NE2 3.15Å; Y242-Q248 PolarHBondContact O-OE1 3.39Å |
| 243 | D | 62.9 | Low | 67.5 | Low | 74 Ų | 74 | 72.3 Ų | 72.3 | 40% | 0.396 | 36% | 0.357 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -64.8 | 136.7 | -174.1 | -153.9 | -4.4 | 0 | 0 | 0 | 110.5 | Y239 Y240 S245 W302 | Y239-D243 WeakPolarHBondContact O-CB 3.5Å; Y239-D243 PolarHBondContact O-N 2.76Å; Y240-D243 PolarHBondContact O-N 3.03Å; D243-S245 PolarHBondContact O-N 3.39Å; D243-W302 WeakPolarHBondContact OD1-CZ2 3.17Å |
| 244 | G | 64.4 | Low | 68.9 | Low | 24 Ų | 24 | 71.6 Ų | 71.6 | 25% | 0.247 | 36% | 0.359 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 69.8 | 3 | -175.2 | 0 | 0 | 0 | 0 | 0 | 116.2 | R299 | G244-R299 PolarHBondContact O-NE 2.97Š|
| 245 | S | 79.3 | Confident | 70.3 | Confident | 38 Ų | 38 | 66.4 Ų | 66.4 | 27% | 0.266 | 35% | 0.345 | S | S | . | . | trans | -67.8 | 146.1 | 173.9 | 66.6 | 0 | 0 | 0 | 0 | 111.5 | Y242 D243 W247 Q248 A249 | Y242-S245 VanDerWaalsContact O-CB 3.26Å; Y242-S245 WeakPolarHBondContact O-CB 3.32Å; Y242-S245 PolarHBondContact O-N 2.96Å; Y242-S245 VanDerWaalsContact O-N 3.15Å; Y242-S245 PolarHBondContact O-OG 3.03Å; D243-S245 PolarHBondContact O-N 3.39Å; S245-W247 PolarHBondContact O-N 3.34Å; S245-Q248 PolarHBondContact O-N 2.92Å; S245-Q248 WeakPolarHBondContact OG-CG 3.42Å; S245-Q248 PolarHBondContact OG-N 3.24Å; S245-A249 PolarHBondContact O-N 2.9Å; S245-A249 VanDerWaalsContact O-N 3.11Å | ||
| 246 | L | 83.9 | Confident | 71.8 | Confident | 74 Ų | 74 | 63.4 Ų | 63.4 | 39% | 0.387 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -54.5 | -36.8 | 176.3 | 176.6 | 61.8 | 0 | 0 | 0 | 111.8 | Q248 A249 I250 S295 A298 | L246-Q248 PolarHBondContact O-N 3.35Å; L246-A249 WeakPolarHBondContact O-CB 3.31Å; L246-A249 PolarHBondContact O-N 2.88Å; L246-I250 HydrophobicContact CD1-CD1 4.08Å; L246-I250 HydrophobicContact CD1-CG1 4.17Å; L246-I250 HydrophobicContact CD2-CD1 4.44Å; L246-I250 HydrophobicContact CG-CD1 3.86Å; L246-I250 HydrophobicContact CG-CG1 4.38Å; L246-I250 WeakPolarHBondContact O-CG1 3.49Å; L246-I250 PolarHBondContact O-N 2.98Å; L246-S295 WeakPolarHBondContact CD2-OG 3.49Å; L246-A298 HydrophobicContact CD1-CB 4.2Å |
| 247 | W | 79.8 | Confident | 73.5 | Confident | 143 Ų | 143 | 59 Ų | 59 | 54% | 0.542 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -60.6 | -42.8 | 178 | -178.7 | 70.6 | 0 | 0 | 0 | 112.6 | S245 N251 | S245-W247 PolarHBondContact O-N 3.34Å; W247-N251 VanDerWaalsContact CD2-ND2 3.32Å; W247-N251 VanDerWaalsContact CZ2-ND2 3.27Å; W247-N251 WeakPolarHBondContact CZ2-ND2 3.3Å; W247-N251 PolarHBondContact NE1-ND2 3.26Å; W247-N251 WeakPolarHBondContact O-CB 3.42Å; W247-N251 PolarHBondContact O-N 3.02Å; W247-N251 PolarHBondContact O-ND2 3.41Å |
| 248 | Q | 80.7 | Confident | 75.2 | Confident | 23 Ų | 23 | 58 Ų | 58 | 11% | 0.107 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -67.1 | -40.3 | 174.2 | -72.4 | -166.8 | -3.4 | 0 | 0 | 112 | Y242 S245 L246 I250 N251 A252 W302 | Y242-Q248 VanDerWaalsContact C-CD 3.47Å; Y242-Q248 VanDerWaalsContact C-NE2 3.27Å; Y242-Q248 WeakPolarHBondContact O-CG 3.4Å; Y242-Q248 PolarHBondContact O-NE2 3.14Å; Y242-Q248 VanDerWaalsContact O-NE2 3.15Å; Y242-Q248 PolarHBondContact O-OE1 3.39Å; S245-Q248 PolarHBondContact O-N 2.92Å; S245-Q248 WeakPolarHBondContact OG-CG 3.42Å; S245-Q248 PolarHBondContact OG-N 3.24Å; L246-Q248 PolarHBondContact O-N 3.35Å; Q248-I250 VanDerWaalsContact C-N 3.33Å; Q248-I250 PolarHBondContact O-N 2.86Å; Q248-N251 PolarHBondContact O-N 3.38Å; Q248-N251 VanDerWaalsContact O-N 3.16Å; Q248-A252 WeakPolarHBondContact O-CB 3.26Å; Q248-A252 PolarHBondContact O-N 3.08Å; Q248-W302 HydrophobicContact CB-CE3 4.42Å; Q248-W302 HydrophobicContact CB-CH2 3.48Å; Q248-W302 VanDerWaalsContact CB-CH2 3.48Å; Q248-W302 HydrophobicContact CB-CZ2 4.18Å; Q248-W302 HydrophobicContact CB-CZ3 3.62Å; Q248-W302 HydrophobicContact CG-CH2 4.3Å; Q248-W302 WeakPolarHBondContact O-CZ3 3.23Å; Q248-W302 VanDerWaalsContact OE1-CZ2 3.26Å |
| 249 | A | 84 | Confident | 76.7 | Confident | 0 Ų | 0 | 57.7 Ų | 57.7 | 0% | 0 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -57 | -45.7 | 176 | 0 | 0 | 0 | 0 | 0 | 112.5 | S245 L246 S253 A298 W302 | S245-A249 PolarHBondContact O-N 2.9Å; S245-A249 VanDerWaalsContact O-N 3.11Å; L246-A249 WeakPolarHBondContact O-CB 3.31Å; L246-A249 PolarHBondContact O-N 2.88Å; A249-S253 PolarHBondContact O-N 3.27Å; A249-S253 PolarHBondContact O-OG 2.93Å; A249-A298 HydrophobicContact CB-CB 4.25Å; A249-W302 VanDerWaalsContact CA-CE3 3.48Å; A249-W302 HydrophobicContact CB-CB 4.04Å; A249-W302 HydrophobicContact CB-CD2 4.43Å; A249-W302 HydrophobicContact CB-CE3 4.27Å; A249-W302 HydrophobicContact CB-CG 4.39Å |
| 250 | I | 85.2 | Confident | 78.3 | Confident | 41 Ų | 41 | 53.3 Ų | 53.3 | 21% | 0.21 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -64.4 | -47.5 | 174.1 | -66.2 | 169.3 | 0 | 0 | 0 | 110.3 | L246 Q248 A252 S253 G254 Y257 A298 | L246-I250 HydrophobicContact CD1-CD1 4.08Å; L246-I250 HydrophobicContact CD1-CG1 4.17Å; L246-I250 HydrophobicContact CD2-CD1 4.44Å; L246-I250 HydrophobicContact CG-CD1 3.86Å; L246-I250 HydrophobicContact CG-CG1 4.38Å; L246-I250 WeakPolarHBondContact O-CG1 3.49Å; L246-I250 PolarHBondContact O-N 2.98Å; Q248-I250 VanDerWaalsContact C-N 3.33Å; Q248-I250 PolarHBondContact O-N 2.86Å; I250-A252 VanDerWaalsContact C-N 3.32Å; I250-A252 PolarHBondContact O-N 3.08Å; I250-S253 CarbonylContact O-C 3.47Å; I250-S253 PolarHBondContact O-N 3.06Å; I250-S253 VanDerWaalsContact O-N 3.15Å; I250-G254 WeakPolarHBondContact O-CA 3.4Å; I250-G254 PolarHBondContact O-N 2.82Å; I250-Y257 HydrophobicContact CD1-CE2 4.18Å; I250-Y257 HydrophobicContact CG1-CD2 4.13Å; I250-Y257 HydrophobicContact CG1-CE2 3.93Å; I250-Y257 HydrophobicContact CG1-CG 4.49Å; I250-Y257 HydrophobicContact CG2-CD1 3.86Å; I250-Y257 HydrophobicContact CG2-CE1 4.11Å; I250-Y257 HydrophobicContact CG2-CG 4.12Å; I250-A298 HydrophobicContact CG1-CB 3.72Å |
| 251 | N | 82.8 | Confident | 79.9 | Confident | 95 Ų | 95 | 50.3 Ų | 50.3 | 51% | 0.508 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -61.9 | -36.5 | -178.5 | -78.3 | -23.3 | 0 | 0 | 0 | 113.5 | W247 Q248 S253 | W247-N251 VanDerWaalsContact CD2-ND2 3.32Å; W247-N251 VanDerWaalsContact CZ2-ND2 3.27Å; W247-N251 WeakPolarHBondContact CZ2-ND2 3.3Å; W247-N251 PolarHBondContact NE1-ND2 3.26Å; W247-N251 WeakPolarHBondContact O-CB 3.42Å; W247-N251 PolarHBondContact O-N 3.02Å; W247-N251 PolarHBondContact O-ND2 3.41Å; Q248-N251 PolarHBondContact O-N 3.38Å; Q248-N251 VanDerWaalsContact O-N 3.16Å; N251-S253 VanDerWaalsContact C-N 3.3Å; N251-S253 PolarHBondContact O-N 3.24Å |
| 252 | A | 80.9 | Confident | 81.1 | Confident | 45 Ų | 45 | 50.6 Ų | 50.6 | 37% | 0.372 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -70.1 | -28.6 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | Q248 I250 W302 L305 | Q248-A252 WeakPolarHBondContact O-CB 3.26Å; Q248-A252 PolarHBondContact O-N 3.08Å; I250-A252 VanDerWaalsContact C-N 3.32Å; I250-A252 PolarHBondContact O-N 3.08Å; A252-W302 HydrophobicContact CB-CE3 3.78Å; A252-W302 HydrophobicContact CB-CZ3 3.62Å; A252-L305 HydrophobicContact CB-CD1 3.75Å |
| 253 | S | 81.1 | Confident | 82.3 | Confident | 8 Ų | 8 | 51.5 Ų | 51.5 | 6% | 0.056 | 29% | 0.289 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -117.5 | 25.5 | -177.1 | 64 | 0 | 0 | 0 | 0 | 113.4 | A249 I250 N251 L255 S256 Y257 | A249-S253 PolarHBondContact O-N 3.27Å; A249-S253 PolarHBondContact O-OG 2.93Å; I250-S253 CarbonylContact O-C 3.47Å; I250-S253 PolarHBondContact O-N 3.06Å; I250-S253 VanDerWaalsContact O-N 3.15Å; N251-S253 VanDerWaalsContact C-N 3.3Å; N251-S253 PolarHBondContact O-N 3.24Å; S253-L255 VanDerWaalsContact C-N 3.34Å; S253-L255 PolarHBondContact O-N 3.49Å; S253-L255 VanDerWaalsContact O-N 3.11Å; S253-S256 PolarHBondContact O-N 3.37Å; S253-Y257 PolarHBondContact O-N 2.92Å |
| 254 | G | 82.9 | Confident | 83.5 | Confident | 32 Ų | 32 | 51 Ų | 51 | 33% | 0.33 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -55.3 | -39.4 | -163.9 | 0 | 0 | 0 | 0 | 0 | 115.7 | I250 F258 | I250-G254 WeakPolarHBondContact O-CA 3.4Å; I250-G254 PolarHBondContact O-N 2.82Å; G254-F258 VanDerWaalsContact O-CB 3.22Å; G254-F258 WeakPolarHBondContact O-CB 3.4Å; G254-F258 PolarHBondContact O-N 3.03Å |
| 255 | L | 82.1 | Confident | 84.5 | Confident | 83 Ų | 83 | 52.4 Ų | 52.4 | 44% | 0.435 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -67.8 | -45.5 | 176.3 | -179.2 | 62.4 | 0 | 0 | 0 | 111.8 | L39 S253 F258 L259 | L39-L255 HydrophobicContact CD1-CD1 3.88Å; L39-L255 HydrophobicContact CD1-CD2 4.36Å; S253-L255 VanDerWaalsContact C-N 3.34Å; S253-L255 PolarHBondContact O-N 3.49Å; S253-L255 VanDerWaalsContact O-N 3.11Å; L255-F258 PolarHBondContact O-N 3.24Å; L255-L259 HydrophobicContact CD1-CD1 4.34Å; L255-L259 HydrophobicContact CD1-CG 4.4Å; L255-L259 HydrophobicContact CG-CD1 4.17Å; L255-L259 WeakPolarHBondContact O-CG 3.25Å; L255-L259 PolarHBondContact O-N 3.01Å |
| 256 | S | 85 | Confident | 84.7 | Confident | 63 Ų | 63 | 51.3 Ų | 51.3 | 44% | 0.441 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -64.8 | -44.5 | 179 | -52.6 | 0 | 0 | 0 | 0 | 111.1 | S253 F258 L259 L260 | S253-S256 PolarHBondContact O-N 3.37Å; S256-F258 VanDerWaalsContact C-N 3.34Å; S256-F258 PolarHBondContact O-N 3.43Å; S256-L259 PolarHBondContact O-N 2.89Å; S256-L260 WeakPolarHBondContact O-CB 3.3Å; S256-L260 PolarHBondContact O-N 3.02Å |
| 257 | Y | 87.4 | Confident | 84.8 | Confident | 47 Ų | 47 | 52.1 Ų | 52.1 | 18% | 0.184 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -57.8 | -46.6 | 174 | -179 | -93.7 | 0 | 0 | 0 | 111.3 | I250 S253 L260 C261 T294 A298 | I250-Y257 HydrophobicContact CD1-CE2 4.18Å; I250-Y257 HydrophobicContact CG1-CD2 4.13Å; I250-Y257 HydrophobicContact CG1-CE2 3.93Å; I250-Y257 HydrophobicContact CG1-CG 4.49Å; I250-Y257 HydrophobicContact CG2-CD1 3.86Å; I250-Y257 HydrophobicContact CG2-CE1 4.11Å; I250-Y257 HydrophobicContact CG2-CG 4.12Å; S253-Y257 PolarHBondContact O-N 2.92Å; Y257-L260 PolarHBondContact O-N 2.66Å; Y257-C261 WeakPolarHBondContact CE1-SG 3.41Å; Y257-C261 WeakPolarHBondContact O-CB 3.47Å; Y257-C261 PolarHBondContact O-N 2.87Å; Y257-C261 PolarHBondContact O-SG 3.44Å; Y257-T294 WeakPolarHBondContact CE2-O 3.41Å; Y257-A298 HydrophobicContact CD2-CB 3.87Å; Y257-A298 HydrophobicContact CE2-CB 4.15Å |
| 258 | F | 85.5 | Confident | 85 | Confident | 47 Ų | 47 | 47.4 Ų | 47.4 | 21% | 0.206 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -62.4 | -43.2 | 177.6 | -179.3 | -104 | 0 | 0 | 0 | 112.7 | I8 F65 F66 G254 L255 S256 C261 N262 | I8-F258 HydrophobicContact CD1-CD2 4.28Å; I8-F258 HydrophobicContact CD1-CE2 3.88Å; F65-F258 HydrophobicContact CD1-CE1 4.2Å; F65-F258 AromaticContact CD1-CZ 3.68Å; F65-F258 HydrophobicContact CD1-CZ 3.68Å; F65-F258 HydrophobicContact CE1-CE1 4.3Å; F65-F258 HydrophobicContact CE1-CE2 4.39Å; F65-F258 AromaticContact CE1-CZ 3.76Å; F65-F258 HydrophobicContact CE1-CZ 3.76Å; F66-F258 HydrophobicContact CD1-CE1 4.48Å; F66-F258 AromaticContact CE1-CD1 3.97Å; F66-F258 HydrophobicContact CE1-CD1 3.97Å; F66-F258 AromaticContact CE1-CE1 3.53Å; F66-F258 HydrophobicContact CE1-CE1 3.53Å; F66-F258 HydrophobicContact CE2-CE1 4.39Å; F66-F258 HydrophobicContact CZ-CD1 4.01Å; F66-F258 AromaticContact CZ-CE1 3.47Å; F66-F258 HydrophobicContact CZ-CE1 3.47Å; F66-F258 VanDerWaalsContact CZ-CE1 3.47Å; G254-F258 VanDerWaalsContact O-CB 3.22Å; G254-F258 WeakPolarHBondContact O-CB 3.4Å; G254-F258 PolarHBondContact O-N 3.03Å; L255-F258 PolarHBondContact O-N 3.24Å; S256-F258 VanDerWaalsContact C-N 3.34Å; S256-F258 PolarHBondContact O-N 3.43Å; F258-C261 WeakPolarHBondContact O-CB 3.36Å; F258-C261 PolarHBondContact O-N 3.44Å; F258-N262 WeakPolarHBondContact CD1-ND2 3.16Å; F258-N262 WeakPolarHBondContact CE1-ND2 3.5Å; F258-N262 WeakPolarHBondContact CZ-ND2 3.32Å; F258-N262 PolarHBondContact O-N 3.34Å; F258-N262 PolarHBondContact O-ND2 2.88Å |
| 259 | L | 87 | Confident | 85 | Confident | 56 Ų | 56 | 51 Ų | 51 | 29% | 0.293 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -64.8 | -44 | 177.1 | -71.8 | 171.6 | 0 | 0 | 0 | 111.5 | L39 F66 L255 S256 C261 N262 V263 | L39-L259 HydrophobicContact CD1-CD1 4.41Å; L39-L259 HydrophobicContact CD1-CD2 4.44Å; L39-L259 HydrophobicContact CD2-CD1 4.12Å; L39-L259 HydrophobicContact CD2-CD2 4.13Å; F66-L259 HydrophobicContact CE1-CD2 4.33Å; F66-L259 HydrophobicContact CZ-CD2 3.74Å; L255-L259 HydrophobicContact CD1-CD1 4.34Å; L255-L259 HydrophobicContact CD1-CG 4.4Å; L255-L259 HydrophobicContact CG-CD1 4.17Å; L255-L259 WeakPolarHBondContact O-CG 3.25Å; L255-L259 PolarHBondContact O-N 3.01Å; S256-L259 PolarHBondContact O-N 2.89Å; L259-C261 VanDerWaalsContact C-N 3.32Å; L259-C261 PolarHBondContact O-N 3.15Å; L259-N262 PolarHBondContact O-N 3.44Å; L259-V263 WeakPolarHBondContact O-CG2 3.27Å; L259-V263 PolarHBondContact O-N 3.21Å |
| 260 | L | 89.4 | Confident | 84.9 | Confident | 35 Ų | 35 | 56.2 Ų | 56.2 | 18% | 0.183 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -58.8 | -45.7 | 175.2 | -176.8 | 69 | 0 | 0 | 0 | 111.4 | S256 Y257 N262 V263 F264 T294 F297 | S256-L260 WeakPolarHBondContact O-CB 3.3Å; S256-L260 PolarHBondContact O-N 3.02Å; Y257-L260 PolarHBondContact O-N 2.66Å; L260-N262 VanDerWaalsContact C-N 3.32Å; L260-N262 PolarHBondContact O-N 3.49Å; L260-V263 PolarHBondContact O-N 3.29Å; L260-F264 HydrophobicContact CD1-CD1 4.1Å; L260-F264 HydrophobicContact CD1-CE1 3.6Å; L260-F264 HydrophobicContact CD1-CE2 4.19Å; L260-F264 HydrophobicContact CD1-CZ 3.66Å; L260-F264 HydrophobicContact CD2-CE2 4.22Å; L260-F264 HydrophobicContact CD2-CZ 4.33Å; L260-F264 HydrophobicContact CG-CD2 4.34Å; L260-F264 HydrophobicContact CG-CE1 4.3Å; L260-F264 HydrophobicContact CG-CE2 4.08Å; L260-F264 HydrophobicContact CG-CZ 4.07Å; L260-F264 PolarHBondContact O-N 3.4Å; L260-T294 HydrophobicContact CD2-CG2 4.48Å; L260-F297 HydrophobicContact CD2-CB 3.64Å; L260-F297 HydrophobicContact CD2-CD1 3.38Å; L260-F297 HydrophobicContact CD2-CD2 3.94Å; L260-F297 HydrophobicContact CD2-CE1 3.97Å; L260-F297 HydrophobicContact CD2-CE2 4.46Å; L260-F297 HydrophobicContact CD2-CG 3.36Å; L260-F297 HydrophobicContact CD2-CZ 4.47Å |
| 261 | C | 89.7 | Confident | 84.7 | Confident | 14 Ų | 14 | 58.6 Ų | 58.6 | 10% | 0.095 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -56.9 | -44.4 | 176.1 | -73.7 | 0 | 0 | 0 | 0 | 111.7 | Y257 F258 L259 T265 Y290 | Y257-C261 WeakPolarHBondContact CE1-SG 3.41Å; Y257-C261 WeakPolarHBondContact O-CB 3.47Å; Y257-C261 PolarHBondContact O-N 2.87Å; Y257-C261 PolarHBondContact O-SG 3.44Å; F258-C261 WeakPolarHBondContact O-CB 3.36Å; F258-C261 PolarHBondContact O-N 3.44Å; L259-C261 VanDerWaalsContact C-N 3.32Å; L259-C261 PolarHBondContact O-N 3.15Å; C261-T265 WeakPolarHBondContact O-CB 3.39Å; C261-T265 PolarHBondContact O-N 2.96Å; C261-T265 PolarHBondContact O-OG1 3.15Å; C261-Y290 VanDerWaalsContact CA-OH 3.26Å; C261-Y290 WeakPolarHBondContact CA-OH 3.5Å; C261-Y290 WeakPolarHBondContact CB-OH 3.4Å; C261-Y290 PolarHBondContact O-OH 3.42Å |
| 262 | N | 86 | Confident | 84.2 | Confident | 55 Ų | 55 | 55.9 Ų | 55.9 | 29% | 0.294 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -65.4 | -41.3 | 177 | -76.6 | -69.1 | 0 | 0 | 0 | 112.4 | F258 L259 L260 T265 G266 | F258-N262 WeakPolarHBondContact CD1-ND2 3.16Å; F258-N262 WeakPolarHBondContact CE1-ND2 3.5Å; F258-N262 WeakPolarHBondContact CZ-ND2 3.32Å; F258-N262 PolarHBondContact O-N 3.34Å; F258-N262 PolarHBondContact O-ND2 2.88Å; L259-N262 PolarHBondContact O-N 3.44Å; L260-N262 VanDerWaalsContact C-N 3.32Å; L260-N262 PolarHBondContact O-N 3.49Å; N262-T265 PolarHBondContact O-N 2.97Å; N262-G266 PolarHBondContact O-N 3.2Å |
| 263 | V | 87.7 | Confident | 83.4 | Confident | 84 Ų | 84 | 59.6 Ų | 59.6 | 51% | 0.509 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -62.9 | -48.6 | 177.1 | 171.2 | 0 | 0 | 0 | 0 | 110.5 | L259 L260 T265 G266 I267 | L259-V263 WeakPolarHBondContact O-CG2 3.27Å; L259-V263 PolarHBondContact O-N 3.21Å; L260-V263 PolarHBondContact O-N 3.29Å; V263-T265 VanDerWaalsContact C-N 3.34Å; V263-T265 PolarHBondContact O-N 3.19Å; V263-G266 PolarHBondContact O-N 2.75Å; V263-G266 VanDerWaalsContact O-N 3.15Å; V263-I267 HydrophobicContact CG1-CD1 3.8Å; V263-I267 HydrophobicContact CG1-CG1 4.39Å; V263-I267 WeakPolarHBondContact O-CG1 3.38Å; V263-I267 PolarHBondContact O-N 3.44Å |
| 264 | F | 88.3 | Confident | 82.5 | Confident | 64 Ų | 64 | 61.7 Ų | 61.7 | 28% | 0.281 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -62 | -41.1 | 177.8 | -76.9 | 2.5 | 0 | 0 | 0 | 112.2 | L260 G266 I267 V268 Y290 A293 T294 | L260-F264 HydrophobicContact CD1-CD1 4.1Å; L260-F264 HydrophobicContact CD1-CE1 3.6Å; L260-F264 HydrophobicContact CD1-CE2 4.19Å; L260-F264 HydrophobicContact CD1-CZ 3.66Å; L260-F264 HydrophobicContact CD2-CE2 4.22Å; L260-F264 HydrophobicContact CD2-CZ 4.33Å; L260-F264 HydrophobicContact CG-CD2 4.34Å; L260-F264 HydrophobicContact CG-CE1 4.3Å; L260-F264 HydrophobicContact CG-CE2 4.08Å; L260-F264 HydrophobicContact CG-CZ 4.07Å; L260-F264 PolarHBondContact O-N 3.4Å; F264-G266 VanDerWaalsContact C-N 3.31Å; F264-G266 PolarHBondContact O-N 3.45Å; F264-I267 HydrophobicContact CD1-CD1 4.37Å; F264-I267 PolarHBondContact O-N 3.07Å; F264-V268 WeakPolarHBondContact O-CB 3.36Å; F264-V268 VanDerWaalsContact O-CG2 3.32Å; F264-V268 WeakPolarHBondContact O-CG2 3.43Å; F264-V268 PolarHBondContact O-N 2.86Å; F264-Y290 HydrophobicContact CB-CD2 3.82Å; F264-Y290 HydrophobicContact CB-CE2 3.55Å; F264-Y290 HydrophobicContact CD2-CD2 4.42Å; F264-A293 HydrophobicContact CE2-CB 3.97Å; F264-T294 HydrophobicContact CD2-CG2 3.78Å; F264-T294 HydrophobicContact CE2-CG2 4.11Å |
| 265 | T | 85.9 | Confident | 81.7 | Confident | 54 Ų | 54 | 63.8 Ų | 63.8 | 33% | 0.331 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -60.9 | -42.5 | 174.4 | -59.6 | 0 | 0 | 0 | 0 | 111.2 | C261 N262 V263 K269 Y290 | C261-T265 WeakPolarHBondContact O-CB 3.39Å; C261-T265 PolarHBondContact O-N 2.96Å; C261-T265 PolarHBondContact O-OG1 3.15Å; N262-T265 PolarHBondContact O-N 2.97Å; V263-T265 VanDerWaalsContact C-N 3.34Å; V263-T265 PolarHBondContact O-N 3.19Å; T265-K269 HydrophobicContact CG2-CD 4.26Å; T265-K269 WeakPolarHBondContact O-CB 3.44Å; T265-K269 WeakPolarHBondContact O-CG 3.38Å; T265-K269 PolarHBondContact O-N 3.1Å; T265-Y290 PolarHBondContact OG1-OH 2.99Å |
| 266 | G | 84.3 | Confident | 81.1 | Confident | 15 Ų | 15 | 69.1 Ų | 69.1 | 16% | 0.155 | 39% | 0.385 | C | S | . | . | H | α-helix | trans | -61.3 | -46.7 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | N262 V263 F264 V268 K269 M270 | N262-G266 PolarHBondContact O-N 3.2Å; V263-G266 PolarHBondContact O-N 2.75Å; V263-G266 VanDerWaalsContact O-N 3.15Å; F264-G266 VanDerWaalsContact C-N 3.31Å; F264-G266 PolarHBondContact O-N 3.45Å; G266-V268 PolarHBondContact O-N 3.29Å; G266-K269 PolarHBondContact O-N 3.01Å; G266-M270 WeakPolarHBondContact O-CB 3.28Å; G266-M270 WeakPolarHBondContact O-CG 3.36Å; G266-M270 PolarHBondContact O-N 3.44Å |
| 267 | I | 85.2 | Confident | 80.5 | Confident | 90 Ų | 90 | 76.1 Ų | 76.1 | 46% | 0.462 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -60.3 | -47.8 | 177.9 | -68.7 | 168.5 | 0 | 0 | 0 | 110.9 | V263 F264 K269 M270 S271 | V263-I267 HydrophobicContact CG1-CD1 3.8Å; V263-I267 HydrophobicContact CG1-CG1 4.39Å; V263-I267 WeakPolarHBondContact O-CG1 3.38Å; V263-I267 PolarHBondContact O-N 3.44Å; F264-I267 HydrophobicContact CD1-CD1 4.37Å; F264-I267 PolarHBondContact O-N 3.07Å; I267-K269 PolarHBondContact O-N 3.1Å; I267-M270 PolarHBondContact O-N 3Å; I267-S271 VanDerWaalsContact O-CB 3.26Å; I267-S271 WeakPolarHBondContact O-CB 3.47Å; I267-S271 PolarHBondContact O-N 3.42Å; I267-S271 PolarHBondContact O-OG 3.13Å |
| 268 | V | 83.6 | Confident | 80.1 | Confident | 44 Ų | 44 | 75.9 Ų | 75.9 | 27% | 0.267 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -60 | -48.3 | 178.9 | 169.8 | 0 | 0 | 0 | 0 | 110.1 | F264 G266 M270 S271 T272 V286 | F264-V268 WeakPolarHBondContact O-CB 3.36Å; F264-V268 VanDerWaalsContact O-CG2 3.32Å; F264-V268 WeakPolarHBondContact O-CG2 3.43Å; F264-V268 PolarHBondContact O-N 2.86Å; G266-V268 PolarHBondContact O-N 3.29Å; V268-M270 PolarHBondContact O-N 3.43Å; V268-S271 PolarHBondContact O-N 3.44Å; V268-T272 PolarHBondContact O-N 3.44Å; V268-T272 PolarHBondContact O-OG1 3.41Å; V268-V286 HydrophobicContact CG1-CG1 3.75Å; V268-V286 HydrophobicContact CG2-CG1 4.18Å |
| 269 | K | 81.3 | Confident | 80.2 | Confident | 98 Ų | 98 | 76.1 Ų | 76.1 | 43% | 0.426 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -62.1 | -38.3 | 178.9 | -78.1 | -176.8 | 168.1 | -162.9 | 0 | 112.9 | Y52 T265 G266 I267 T272 V275 | Y52-K269 HydrophobicContact CE2-CB 4.48Å; Y52-K269 VanDerWaalsContact OH-CB 3.27Å; Y52-K269 WeakPolarHBondContact OH-CB 2.94Å; Y52-K269 WeakPolarHBondContact OH-CD 3.24Å; T265-K269 HydrophobicContact CG2-CD 4.26Å; T265-K269 WeakPolarHBondContact O-CB 3.44Å; T265-K269 WeakPolarHBondContact O-CG 3.38Å; T265-K269 PolarHBondContact O-N 3.1Å; G266-K269 PolarHBondContact O-N 3.01Å; I267-K269 PolarHBondContact O-N 3.1Å; K269-T272 VanDerWaalsContact O-O 3.14Å; K269-V275 HydrophobicContact CG-CG2 4.44Å |
| 270 | M | 80.8 | Confident | 80.3 | Confident | 110 Ų | 110 | 78.3 Ų | 78.3 | 54% | 0.542 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -73.9 | -33.4 | 175.9 | -69.5 | 178.2 | 75.2 | 0 | 0 | 112.9 | F50 Y52 G266 I267 V268 T272 | F50-M270 HydrophobicContact CD1-CE 4.46Å; Y52-M270 HydrophobicContact CD2-CG 3.8Å; Y52-M270 HydrophobicContact CD2-SD 3.92Å; Y52-M270 HydrophobicContact CE2-CG 3.69Å; Y52-M270 HydrophobicContact CE2-SD 4.19Å; G266-M270 WeakPolarHBondContact O-CB 3.28Å; G266-M270 WeakPolarHBondContact O-CG 3.36Å; G266-M270 PolarHBondContact O-N 3.44Å; I267-M270 PolarHBondContact O-N 3Å; V268-M270 PolarHBondContact O-N 3.43Å; M270-T272 VanDerWaalsContact C-N 3.32Å |
| 271 | S | 81.7 | Confident | 80.4 | Confident | 92 Ų | 92 | 83 Ų | 83 | 64% | 0.643 | 45% | 0.447 | S | S | * | . | H | α-helix | trans | -77.2 | -21.6 | -178.6 | -55.7 | 0 | 0 | 0 | 0 | 112.7 | I267 V268 | I267-S271 VanDerWaalsContact O-CB 3.26Å; I267-S271 WeakPolarHBondContact O-CB 3.47Å; I267-S271 PolarHBondContact O-N 3.42Å; I267-S271 PolarHBondContact O-OG 3.13Å; V268-S271 PolarHBondContact O-N 3.44Å |
| 272 | T | 72.8 | Confident | 80.3 | Confident | 37 Ų | 37 | 85.4 Ų | 85.4 | 23% | 0.227 | 46% | 0.461 | C | S | . | . | trans | -115.1 | 99 | -179.1 | 52.1 | 0 | 0 | 0 | 0 | 109.2 | V268 K269 M270 T274 V275 M278 | V268-T272 PolarHBondContact O-N 3.44Å; V268-T272 PolarHBondContact O-OG1 3.41Å; K269-T272 VanDerWaalsContact O-O 3.14Å; M270-T272 VanDerWaalsContact C-N 3.32Å; T272-T274 PolarHBondContact O-N 2.9Å; T272-V275 WeakPolarHBondContact OG1-CG2 3.46Å; T272-M278 HydrophobicContact CG2-SD 4Å | ||
| 273 | S | 63.3 | Low | 80.3 | Confident | 123 Ų | 123 | 84.5 Ų | 84.5 | 86% | 0.86 | 46% | 0.46 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.6 | -3 | 174.7 | 53.8 | 0 | 0 | 0 | 0 | 113.9 | ||
| 274 | T | 62 | Low | 80.5 | Confident | 53 Ų | 53 | 85.7 Ų | 85.7 | 33% | 0.325 | 46% | 0.462 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -145.5 | 45.5 | -168.9 | 52.2 | 0 | 0 | 0 | 0 | 111.8 | T272 E276 R277 M278 | T272-T274 PolarHBondContact O-N 2.9Å; T274-E276 PolarHBondContact O-N 2.85Å; T274-R277 HydrophobicContact CG2-CB 4.4Å; T274-R277 HydrophobicContact CG2-CG 4.21Å; T274-R277 CarbonylContact O-C 3.58Å; T274-R277 WeakPolarHBondContact O-CA 3.49Å; T274-R277 PolarHBondContact O-N 2.99Å; T274-M278 WeakPolarHBondContact O-CG 3.13Å; T274-M278 PolarHBondContact O-N 2.63Å; T274-M278 VanDerWaalsContact O-N 3.1Å |
| 275 | V | 67.1 | Low | 80.6 | Confident | 76 Ų | 76 | 85.1 Ų | 85.1 | 46% | 0.461 | 47% | 0.469 | S | S | . | . | G | 310 helix | trans | -47.9 | -36.2 | 171.4 | 178.5 | 0 | 0 | 0 | 0 | 111 | K269 T272 R277 | K269-V275 HydrophobicContact CG-CG2 4.44Å; T272-V275 WeakPolarHBondContact OG1-CG2 3.46Å; V275-R277 VanDerWaalsContact C-N 3.33Å; V275-R277 PolarHBondContact O-N 2.91Å |
| 276 | E | 69.5 | Low | 80.8 | Confident | 194 Ų | 194 | 84.9 Ų | 84.9 | 91% | 0.907 | 47% | 0.468 | S | S | * | . | G | 310 helix | trans | -70.4 | -20.4 | 176.6 | -61.3 | -177.9 | 170.1 | 0 | 0 | 115 | T274 | T274-E276 PolarHBondContact O-N 2.85Š|
| 277 | R | 71.2 | Confident | 81 | Confident | 211 Ų | 211 | 89.2 Ų | 89.2 | 80% | 0.796 | 49% | 0.486 | S | S | * | . | G | 310 helix | trans | -110.5 | 7.1 | -179.4 | -42.9 | -177.8 | 178 | 171.3 | -2 | 113.3 | T274 V275 | T274-R277 HydrophobicContact CG2-CB 4.4Å; T274-R277 HydrophobicContact CG2-CG 4.21Å; T274-R277 CarbonylContact O-C 3.58Å; T274-R277 WeakPolarHBondContact O-CA 3.49Å; T274-R277 PolarHBondContact O-N 2.99Å; V275-R277 VanDerWaalsContact C-N 3.33Å; V275-R277 PolarHBondContact O-N 2.91Å |
| 278 | M | 80.1 | Confident | 81.4 | Confident | 42 Ų | 42 | 91.5 Ų | 91.5 | 21% | 0.207 | 49% | 0.493 | C | S | . | . | trans | -65.5 | 138.2 | 175.3 | -73.2 | -176.5 | 67.8 | 0 | 0 | 110.1 | T272 T274 S283 V286 | T272-M278 HydrophobicContact CG2-SD 4Å; T274-M278 WeakPolarHBondContact O-CG 3.13Å; T274-M278 PolarHBondContact O-N 2.63Å; T274-M278 VanDerWaalsContact O-N 3.1Å; M278-S283 WeakPolarHBondContact CB-OG 3.36Å; M278-V286 HydrophobicContact CE-CB 4.45Å; M278-V286 HydrophobicContact CE-CG2 3.78Å | ||
| 279 | S | 87.3 | Confident | 81.8 | Confident | 51 Ų | 51 | 93.2 Ų | 93.2 | 36% | 0.357 | 51% | 0.506 | S | S | . | . | trans | -63.7 | 159.5 | 171.9 | 87.1 | 0 | 0 | 0 | 0 | 110.7 | E281 T282 S283 | S279-E281 WeakPolarHBondContact CB-OE2 3.37Å; S279-E281 PolarHBondContact O-N 3.13Å; S279-E281 PolarHBondContact OG-N 3.32Å; S279-E281 PolarHBondContact OG-OE2 2.89Å; S279-T282 PolarHBondContact N-OG1 2.78Å; S279-T282 PolarHBondContact O-N 3.01Å; S279-T282 PolarHBondContact O-OG1 2.84Å; S279-T282 WeakPolarHBondContact OG-CG2 3.39Å; S279-T282 PolarHBondContact OG-N 2.87Å; S279-T282 PolarHBondContact OG-OG1 2.77Å; S279-T282 VanDerWaalsContact OG-OG1 3.11Å; S279-S283 WeakPolarHBondContact O-CB 3.17Å; S279-S283 PolarHBondContact O-N 2.85Å; S279-S283 PolarHBondContact O-OG 3.3Å | ||
| 280 | V | 89.2 | Confident | 82.2 | Confident | 103 Ų | 103 | 91.6 Ų | 91.6 | 62% | 0.624 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -60.4 | -39.7 | 178.1 | 177.3 | 0 | 0 | 0 | 0 | 110.6 | S283 L284 | V280-S283 PolarHBondContact O-N 2.83Å; V280-L284 HydrophobicContact CG1-CD1 4.02Å; V280-L284 HydrophobicContact CG1-CG 4.37Å; V280-L284 WeakPolarHBondContact O-CB 3.32Å; V280-L284 VanDerWaalsContact O-CG 3.32Å; V280-L284 WeakPolarHBondContact O-CG 3.46Å; V280-L284 PolarHBondContact O-N 3.31Å |
| 281 | E | 90.7 | Very high | 82.7 | Confident | 134 Ų | 134 | 88.5 Ų | 88.5 | 63% | 0.626 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -65.4 | -44.6 | -179.4 | -52.5 | 73.7 | -157.4 | 0 | 0 | 111.4 | S279 S283 L284 A285 | S279-E281 WeakPolarHBondContact CB-OE2 3.37Å; S279-E281 PolarHBondContact O-N 3.13Å; S279-E281 PolarHBondContact OG-N 3.32Å; S279-E281 PolarHBondContact OG-OE2 2.89Å; E281-S283 VanDerWaalsContact C-N 3.35Å; E281-L284 PolarHBondContact O-N 3.44Å; E281-A285 WeakPolarHBondContact O-CB 3.29Å; E281-A285 PolarHBondContact O-N 3.38Å |
| 282 | T | 87.8 | Confident | 83.2 | Confident | 63 Ų | 63 | 88.2 Ų | 88.2 | 39% | 0.387 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -66.7 | -38.9 | 177.6 | 54.1 | 0 | 0 | 0 | 0 | 111.4 | S279 A285 V286 | S279-T282 PolarHBondContact N-OG1 2.78Å; S279-T282 PolarHBondContact O-N 3.01Å; S279-T282 PolarHBondContact O-OG1 2.84Å; S279-T282 WeakPolarHBondContact OG-CG2 3.39Å; S279-T282 PolarHBondContact OG-N 2.87Å; S279-T282 PolarHBondContact OG-OG1 2.77Å; S279-T282 VanDerWaalsContact OG-OG1 3.11Å; T282-A285 PolarHBondContact O-N 3.08Å; T282-V286 WeakPolarHBondContact O-CG2 3.31Å; T282-V286 PolarHBondContact O-N 2.85Å |
| 283 | S | 87.6 | Confident | 84.1 | Confident | 37 Ų | 37 | 88.4 Ų | 88.4 | 26% | 0.259 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -63.3 | -45.1 | 175.8 | -59.3 | 0 | 0 | 0 | 0 | 111.7 | M278 S279 V280 E281 V286 I287 | M278-S283 WeakPolarHBondContact CB-OG 3.36Å; S279-S283 WeakPolarHBondContact O-CB 3.17Å; S279-S283 PolarHBondContact O-N 2.85Å; S279-S283 PolarHBondContact O-OG 3.3Å; V280-S283 PolarHBondContact O-N 2.83Å; E281-S283 VanDerWaalsContact C-N 3.35Å; S283-V286 PolarHBondContact O-N 3.09Å; S283-I287 VanDerWaalsContact O-CG1 3.27Å; S283-I287 WeakPolarHBondContact O-CG1 3.29Å; S283-I287 PolarHBondContact O-N 2.86Å |
| 284 | L | 90.6 | Very high | 85.5 | Confident | 109 Ų | 109 | 82.5 Ų | 82.5 | 57% | 0.571 | 44% | 0.444 | S | S | * | . | H | α-helix | trans | -63.2 | -41.8 | 175.3 | -73.4 | 173.8 | 0 | 0 | 0 | 111.9 | V280 E281 I287 F288 | V280-L284 HydrophobicContact CG1-CD1 4.02Å; V280-L284 HydrophobicContact CG1-CG 4.37Å; V280-L284 WeakPolarHBondContact O-CB 3.32Å; V280-L284 VanDerWaalsContact O-CG 3.32Å; V280-L284 WeakPolarHBondContact O-CG 3.46Å; V280-L284 PolarHBondContact O-N 3.31Å; E281-L284 PolarHBondContact O-N 3.44Å; L284-I287 PolarHBondContact O-N 3.39Å; L284-F288 VanDerWaalsContact O-CB 3.31Å; L284-F288 WeakPolarHBondContact O-CB 3.46Å; L284-F288 PolarHBondContact O-N 2.97Å |
| 285 | A | 90.8 | Very high | 86.8 | Confident | 51 Ų | 51 | 81.3 Ų | 81.3 | 42% | 0.421 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -62 | -43.7 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | E281 T282 F288 C289 | E281-A285 WeakPolarHBondContact O-CB 3.29Å; E281-A285 PolarHBondContact O-N 3.38Å; T282-A285 PolarHBondContact O-N 3.08Å; A285-F288 PolarHBondContact O-N 3.31Å; A285-C289 WeakPolarHBondContact O-CB 3.37Å; A285-C289 PolarHBondContact O-N 3.19Å; A285-C289 PolarHBondContact O-SG 3.44Å; A285-C289 VanDerWaalsContact O-SG 3.34Å |
| 286 | V | 89.1 | Confident | 87.9 | Confident | 50 Ų | 50 | 82.9 Ų | 82.9 | 30% | 0.303 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -63 | -46.1 | 175.8 | 168.1 | 0 | 0 | 0 | 0 | 111.3 | V268 M278 T282 S283 F288 C289 Y290 | V268-V286 HydrophobicContact CG1-CG1 3.75Å; V268-V286 HydrophobicContact CG2-CG1 4.18Å; M278-V286 HydrophobicContact CE-CB 4.45Å; M278-V286 HydrophobicContact CE-CG2 3.78Å; T282-V286 WeakPolarHBondContact O-CG2 3.31Å; T282-V286 PolarHBondContact O-N 2.85Å; S283-V286 PolarHBondContact O-N 3.09Å; V286-F288 VanDerWaalsContact C-N 3.33Å; V286-F288 PolarHBondContact O-N 2.85Å; V286-C289 PolarHBondContact O-N 3.08Å; V286-Y290 WeakPolarHBondContact O-CB 3.26Å; V286-Y290 PolarHBondContact O-N 3.3Å |
| 287 | I | 89.9 | Confident | 88.8 | Confident | 105 Ų | 105 | 76.7 Ų | 76.7 | 54% | 0.538 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -62.4 | -41.5 | 177.7 | -68.4 | 166.3 | 0 | 0 | 0 | 110.9 | S283 L284 Y290 A291 | S283-I287 VanDerWaalsContact O-CG1 3.27Å; S283-I287 WeakPolarHBondContact O-CG1 3.29Å; S283-I287 PolarHBondContact O-N 2.86Å; L284-I287 PolarHBondContact O-N 3.39Å; I287-Y290 PolarHBondContact O-N 3.24Å; I287-A291 VanDerWaalsContact O-CB 3.3Å; I287-A291 WeakPolarHBondContact O-CB 3.41Å; I287-A291 PolarHBondContact O-N 2.69Å |
| 288 | F | 92.6 | Very high | 89.6 | Confident | 139 Ų | 139 | 66.6 Ų | 66.6 | 61% | 0.61 | 38% | 0.376 | S | S | * | . | H | α-helix | trans | -63.7 | -49.8 | 177.5 | -178.7 | -94.6 | 0 | 0 | 0 | 111.7 | L284 A285 V286 Y290 A291 L292 | L284-F288 VanDerWaalsContact O-CB 3.31Å; L284-F288 WeakPolarHBondContact O-CB 3.46Å; L284-F288 PolarHBondContact O-N 2.97Å; A285-F288 PolarHBondContact O-N 3.31Å; V286-F288 VanDerWaalsContact C-N 3.33Å; V286-F288 PolarHBondContact O-N 2.85Å; F288-Y290 VanDerWaalsContact C-N 3.32Å; F288-Y290 PolarHBondContact O-N 3.33Å; F288-A291 PolarHBondContact O-N 3.49Å; F288-L292 HydrophobicContact CE1-CD2 4.11Å; F288-L292 VanDerWaalsContact O-CB 3.29Å; F288-L292 WeakPolarHBondContact O-CB 3.3Å; F288-L292 PolarHBondContact O-N 2.9Å |
| 289 | C | 91.7 | Very high | 89.8 | Confident | 79 Ų | 79 | 70.2 Ų | 70.2 | 53% | 0.534 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -60.2 | -42.4 | 176.6 | -73.1 | 0 | 0 | 0 | 0 | 111.7 | A285 V286 L292 A293 | A285-C289 WeakPolarHBondContact O-CB 3.37Å; A285-C289 PolarHBondContact O-N 3.19Å; A285-C289 PolarHBondContact O-SG 3.44Å; A285-C289 VanDerWaalsContact O-SG 3.34Å; V286-C289 PolarHBondContact O-N 3.08Å; C289-L292 PolarHBondContact O-N 2.97Å; C289-A293 VanDerWaalsContact O-CB 3.23Å; C289-A293 WeakPolarHBondContact O-CB 3.38Å; C289-A293 PolarHBondContact O-N 3.01Å |
| 290 | Y | 90.9 | Very high | 89.8 | Confident | 65 Ų | 65 | 71.4 Ų | 71.4 | 26% | 0.255 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -59.1 | -51.2 | 175.2 | 177.9 | -86 | 0 | 0 | 0 | 111.7 | C261 F264 T265 V286 I287 F288 T294 | C261-Y290 VanDerWaalsContact CA-OH 3.26Å; C261-Y290 WeakPolarHBondContact CA-OH 3.5Å; C261-Y290 WeakPolarHBondContact CB-OH 3.4Å; C261-Y290 PolarHBondContact O-OH 3.42Å; F264-Y290 HydrophobicContact CB-CD2 3.82Å; F264-Y290 HydrophobicContact CB-CE2 3.55Å; F264-Y290 HydrophobicContact CD2-CD2 4.42Å; T265-Y290 PolarHBondContact OG1-OH 2.99Å; V286-Y290 WeakPolarHBondContact O-CB 3.26Å; V286-Y290 PolarHBondContact O-N 3.3Å; I287-Y290 PolarHBondContact O-N 3.24Å; F288-Y290 VanDerWaalsContact C-N 3.32Å; F288-Y290 PolarHBondContact O-N 3.33Å; Y290-T294 HydrophobicContact CE1-CG2 4.33Å; Y290-T294 WeakPolarHBondContact O-CB 3.28Å; Y290-T294 VanDerWaalsContact O-CG2 3.3Å; Y290-T294 WeakPolarHBondContact O-CG2 3.33Å; Y290-T294 PolarHBondContact O-N 3.16Å; Y290-T294 PolarHBondContact O-OG1 3.24Å |
| 291 | A | 91.1 | Very high | 89.5 | Confident | 44 Ų | 44 | 69.9 Ų | 69.9 | 36% | 0.364 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -64.7 | -41 | -179.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | I287 F288 T294 S295 | I287-A291 VanDerWaalsContact O-CB 3.3Å; I287-A291 WeakPolarHBondContact O-CB 3.41Å; I287-A291 PolarHBondContact O-N 2.69Å; F288-A291 PolarHBondContact O-N 3.49Å; A291-T294 PolarHBondContact O-OG1 2.86Å; A291-T294 VanDerWaalsContact O-OG1 3.11Å; A291-S295 WeakPolarHBondContact O-CB 3.16Å; A291-S295 PolarHBondContact O-N 2.94Å; A291-S295 PolarHBondContact O-OG 3.39Å |
| 292 | L | 92.4 | Very high | 88.9 | Confident | 86 Ų | 86 | 63.8 Ų | 63.8 | 45% | 0.45 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -65.2 | -50.3 | 178 | -177 | 64.3 | 0 | 0 | 0 | 111.2 | F288 C289 T294 S295 L296 | F288-L292 HydrophobicContact CE1-CD2 4.11Å; F288-L292 VanDerWaalsContact O-CB 3.29Å; F288-L292 WeakPolarHBondContact O-CB 3.3Å; F288-L292 PolarHBondContact O-N 2.9Å; C289-L292 PolarHBondContact O-N 2.97Å; L292-T294 PolarHBondContact O-N 3.32Å; L292-S295 PolarHBondContact O-N 2.85Å; L292-L296 HydrophobicContact CD1-CD1 4.26Å; L292-L296 HydrophobicContact CD1-CG 4.33Å; L292-L296 HydrophobicContact CG-CD1 4.06Å; L292-L296 WeakPolarHBondContact O-CB 3.42Å; L292-L296 VanDerWaalsContact O-CG 3.29Å; L292-L296 WeakPolarHBondContact O-CG 3.14Å; L292-L296 PolarHBondContact O-N 2.85Å |
| 293 | A | 92.2 | Very high | 88.2 | Confident | 41 Ų | 41 | 62.8 Ų | 62.8 | 34% | 0.339 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -62.1 | -45.1 | -178.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | F264 C289 L296 F297 | F264-A293 HydrophobicContact CE2-CB 3.97Å; C289-A293 VanDerWaalsContact O-CB 3.23Å; C289-A293 WeakPolarHBondContact O-CB 3.38Å; C289-A293 PolarHBondContact O-N 3.01Å; A293-L296 PolarHBondContact O-N 2.88Å; A293-F297 WeakPolarHBondContact O-CB 3.38Å; A293-F297 PolarHBondContact O-N 3.49Å |
| 294 | T | 91 | Very high | 87.6 | Confident | 0 Ų | 0 | 66.5 Ų | 66.5 | 0% | 0 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -66.1 | -38.2 | 177.5 | 52.6 | 0 | 0 | 0 | 0 | 111.8 | Y257 L260 F264 Y290 A291 L292 F297 A298 | Y257-T294 WeakPolarHBondContact CE2-O 3.41Å; L260-T294 HydrophobicContact CD2-CG2 4.48Å; F264-T294 HydrophobicContact CD2-CG2 3.78Å; F264-T294 HydrophobicContact CE2-CG2 4.11Å; Y290-T294 HydrophobicContact CE1-CG2 4.33Å; Y290-T294 WeakPolarHBondContact O-CB 3.28Å; Y290-T294 VanDerWaalsContact O-CG2 3.3Å; Y290-T294 WeakPolarHBondContact O-CG2 3.33Å; Y290-T294 PolarHBondContact O-N 3.16Å; Y290-T294 PolarHBondContact O-OG1 3.24Å; A291-T294 PolarHBondContact O-OG1 2.86Å; A291-T294 VanDerWaalsContact O-OG1 3.11Å; L292-T294 PolarHBondContact O-N 3.32Å; T294-F297 PolarHBondContact O-N 2.93Å; T294-A298 PolarHBondContact O-N 2.96Å |
| 295 | S | 89.7 | Confident | 86.7 | Confident | 28 Ų | 28 | 63.9 Ų | 63.9 | 20% | 0.196 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -66.9 | -42.5 | 176.5 | -61.8 | 0 | 0 | 0 | 0 | 112.7 | L246 A291 L292 F297 A298 R299 | L246-S295 WeakPolarHBondContact CD2-OG 3.49Å; A291-S295 WeakPolarHBondContact O-CB 3.16Å; A291-S295 PolarHBondContact O-N 2.94Å; A291-S295 PolarHBondContact O-OG 3.39Å; L292-S295 PolarHBondContact O-N 2.85Å; S295-F297 VanDerWaalsContact C-N 3.33Å; S295-A298 PolarHBondContact O-N 3.15Å; S295-R299 WeakPolarHBondContact O-CB 3.37Å; S295-R299 PolarHBondContact O-N 3.14Å |
| 296 | L | 90.1 | Very high | 85.8 | Confident | 109 Ų | 109 | 63.9 Ų | 63.9 | 57% | 0.571 | 35% | 0.345 | S | S | * | . | H | α-helix | trans | -63 | -41 | 174.8 | -72.1 | 173.6 | 0 | 0 | 0 | 111.3 | L292 A293 R299 S300 | L292-L296 HydrophobicContact CD1-CD1 4.26Å; L292-L296 HydrophobicContact CD1-CG 4.33Å; L292-L296 HydrophobicContact CG-CD1 4.06Å; L292-L296 WeakPolarHBondContact O-CB 3.42Å; L292-L296 VanDerWaalsContact O-CG 3.29Å; L292-L296 WeakPolarHBondContact O-CG 3.14Å; L292-L296 PolarHBondContact O-N 2.85Å; A293-L296 PolarHBondContact O-N 2.88Å; L296-R299 PolarHBondContact O-N 3.45Å; L296-S300 PolarHBondContact O-N 3.47Å |
| 297 | F | 89.9 | Confident | 84.9 | Confident | 63 Ų | 63 | 63.5 Ų | 63.5 | 28% | 0.276 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -61.4 | -47.6 | 173.7 | 177.6 | -94.5 | 0 | 0 | 0 | 111.8 | L260 A293 T294 S295 R299 S300 Q301 | L260-F297 HydrophobicContact CD2-CB 3.64Å; L260-F297 HydrophobicContact CD2-CD1 3.38Å; L260-F297 HydrophobicContact CD2-CD2 3.94Å; L260-F297 HydrophobicContact CD2-CE1 3.97Å; L260-F297 HydrophobicContact CD2-CE2 4.46Å; L260-F297 HydrophobicContact CD2-CG 3.36Å; L260-F297 HydrophobicContact CD2-CZ 4.47Å; A293-F297 WeakPolarHBondContact O-CB 3.38Å; A293-F297 PolarHBondContact O-N 3.49Å; T294-F297 PolarHBondContact O-N 2.93Å; S295-F297 VanDerWaalsContact C-N 3.33Å; F297-R299 VanDerWaalsContact C-N 3.25Å; F297-R299 PolarHBondContact O-N 3.04Å; F297-S300 PolarHBondContact O-N 2.82Å; F297-S300 PolarHBondContact O-OG 3.31Å; F297-Q301 HydrophobicContact CD1-CG 4.45Å; F297-Q301 HydrophobicContact CE1-CG 4.02Å; F297-Q301 HydrophobicContact CE2-CG 4.39Å; F297-Q301 HydrophobicContact CZ-CG 3.98Å; F297-Q301 WeakPolarHBondContact O-CG 3.5Å; F297-Q301 PolarHBondContact O-N 3.36Å |
| 298 | A | 86.8 | Confident | 84.1 | Confident | 0 Ų | 0 | 60.9 Ų | 60.9 | 0% | 0 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -56.3 | -44.3 | 176.3 | 0 | 0 | 0 | 0 | 0 | 111 | L246 A249 I250 Y257 T294 S295 Q301 W302 | L246-A298 HydrophobicContact CD1-CB 4.2Å; A249-A298 HydrophobicContact CB-CB 4.25Å; I250-A298 HydrophobicContact CG1-CB 3.72Å; Y257-A298 HydrophobicContact CD2-CB 3.87Å; Y257-A298 HydrophobicContact CE2-CB 4.15Å; T294-A298 PolarHBondContact O-N 2.96Å; S295-A298 PolarHBondContact O-N 3.15Å; A298-Q301 PolarHBondContact O-N 3.29Å; A298-W302 PolarHBondContact O-N 2.86Å |
| 299 | R | 85.1 | Confident | 83.1 | Confident | 117 Ų | 117 | 60 Ų | 60 | 44% | 0.442 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -68.5 | -33.8 | -179.3 | -166.4 | 62.9 | 176.7 | 90 | -7.8 | 113.3 | G244 S295 L296 F297 Q301 W302 | G244-R299 PolarHBondContact O-NE 2.97Å; S295-R299 WeakPolarHBondContact O-CB 3.37Å; S295-R299 PolarHBondContact O-N 3.14Å; L296-R299 PolarHBondContact O-N 3.45Å; F297-R299 VanDerWaalsContact C-N 3.25Å; F297-R299 PolarHBondContact O-N 3.04Å; R299-Q301 VanDerWaalsContact C-N 3.35Å; R299-W302 WeakPolarHBondContact O-CB 3.49Å; R299-W302 PolarHBondContact O-N 2.8Å |
| 300 | S | 86.8 | Confident | 82 | Confident | 76 Ų | 76 | 62.8 Ų | 62.8 | 53% | 0.531 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -68.1 | -35.1 | 177.7 | 75.2 | 0 | 0 | 0 | 0 | 112.2 | L296 F297 W302 | L296-S300 PolarHBondContact O-N 3.47Å; F297-S300 PolarHBondContact O-N 2.82Å; F297-S300 PolarHBondContact O-OG 3.31Å; S300-W302 VanDerWaalsContact C-N 3.3Å; S300-W302 PolarHBondContact O-N 2.87Å |
| 301 | Q | 81.9 | Confident | 81.1 | Confident | 71 Ų | 71 | 67.4 Ų | 67.4 | 33% | 0.332 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -71.1 | -26.5 | 176 | -62.5 | -56.2 | -62.1 | 0 | 0 | 112.9 | F297 A298 R299 G303 H304 L305 | F297-Q301 HydrophobicContact CD1-CG 4.45Å; F297-Q301 HydrophobicContact CE1-CG 4.02Å; F297-Q301 HydrophobicContact CE2-CG 4.39Å; F297-Q301 HydrophobicContact CZ-CG 3.98Å; F297-Q301 WeakPolarHBondContact O-CG 3.5Å; F297-Q301 PolarHBondContact O-N 3.36Å; A298-Q301 PolarHBondContact O-N 3.29Å; R299-Q301 VanDerWaalsContact C-N 3.35Å; Q301-G303 PolarHBondContact O-N 3.29Å; Q301-H304 PolarHBondContact O-N 3.38Å; Q301-L305 HydrophobicContact CB-CD1 4.31Å; Q301-L305 WeakPolarHBondContact O-CG 3.32Å; Q301-L305 PolarHBondContact O-N 2.9Å; Q301-L305 VanDerWaalsContact O-N 3.17Å |
| 302 | W | 78.1 | Confident | 80.2 | Confident | 7 Ų | 7 | 74.7 Ų | 74.7 | 3% | 0.027 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -57.4 | -49.2 | -174.1 | 179.7 | -98 | 0 | 0 | 0 | 113.1 | D243 Q248 A249 A252 A298 R299 S300 H304 L305 E306 | D243-W302 WeakPolarHBondContact OD1-CZ2 3.17Å; Q248-W302 HydrophobicContact CB-CE3 4.42Å; Q248-W302 HydrophobicContact CB-CH2 3.48Å; Q248-W302 VanDerWaalsContact CB-CH2 3.48Å; Q248-W302 HydrophobicContact CB-CZ2 4.18Å; Q248-W302 HydrophobicContact CB-CZ3 3.62Å; Q248-W302 HydrophobicContact CG-CH2 4.3Å; Q248-W302 WeakPolarHBondContact O-CZ3 3.23Å; Q248-W302 VanDerWaalsContact OE1-CZ2 3.26Å; A249-W302 VanDerWaalsContact CA-CE3 3.48Å; A249-W302 HydrophobicContact CB-CB 4.04Å; A249-W302 HydrophobicContact CB-CD2 4.43Å; A249-W302 HydrophobicContact CB-CE3 4.27Å; A249-W302 HydrophobicContact CB-CG 4.39Å; A252-W302 HydrophobicContact CB-CE3 3.78Å; A252-W302 HydrophobicContact CB-CZ3 3.62Å; A298-W302 PolarHBondContact O-N 2.86Å; R299-W302 WeakPolarHBondContact O-CB 3.49Å; R299-W302 PolarHBondContact O-N 2.8Å; S300-W302 VanDerWaalsContact C-N 3.3Å; S300-W302 PolarHBondContact O-N 2.87Å; W302-H304 VanDerWaalsContact C-N 3.29Å; W302-H304 PolarHBondContact O-N 3.32Å; W302-L305 PolarHBondContact O-N 3.34Å; W302-L305 VanDerWaalsContact O-N 3.08Å; W302-E306 HydrophobicContact CZ2-CG 4.46Å; W302-E306 PolarHBondContact NE1-OE2 2.94Å; W302-E306 WeakPolarHBondContact O-CB 3.31Å; W302-E306 PolarHBondContact O-N 3.24Å |
| 303 | G | 73.6 | Confident | 78.7 | Confident | 41 Ų | 41 | 76.4 Ų | 76.4 | 42% | 0.423 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -59.4 | -39.1 | -175.9 | 0 | 0 | 0 | 0 | 0 | 113.1 | Q301 A307 | Q301-G303 PolarHBondContact O-N 3.29Å; G303-A307 WeakPolarHBondContact O-CB 3.41Å; G303-A307 PolarHBondContact O-N 3Å |
| 304 | H | 75.8 | Confident | 76.7 | Confident | 115 Ų | 115 | 83.2 Ų | 83.2 | 53% | 0.532 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -68.7 | -41.6 | 176.1 | -177.6 | -96.2 | 0 | 0 | 0 | 112.2 | Q301 W302 A307 I308 | Q301-H304 PolarHBondContact O-N 3.38Å; W302-H304 VanDerWaalsContact C-N 3.29Å; W302-H304 PolarHBondContact O-N 3.32Å; H304-A307 PolarHBondContact O-N 3.09Å; H304-I308 WeakPolarHBondContact CE1-CD1 3.26Å; H304-I308 WeakPolarHBondContact O-CG1 3.45Å; H304-I308 PolarHBondContact O-N 3.24Å; H304-I308 VanDerWaalsContact O-N 3.09Å |
| 305 | L | 72.1 | Confident | 76 | Confident | 54 Ų | 54 | 87.4 Ų | 87.4 | 28% | 0.283 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -68.6 | -37 | 178.9 | -69.8 | 169.9 | 0 | 0 | 0 | 112.2 | A252 Q301 W302 I308 R309 | A252-L305 HydrophobicContact CB-CD1 3.75Å; Q301-L305 HydrophobicContact CB-CD1 4.31Å; Q301-L305 WeakPolarHBondContact O-CG 3.32Å; Q301-L305 PolarHBondContact O-N 2.9Å; Q301-L305 VanDerWaalsContact O-N 3.17Å; W302-L305 PolarHBondContact O-N 3.34Å; W302-L305 VanDerWaalsContact O-N 3.08Å; L305-I308 PolarHBondContact O-N 2.92Å; L305-R309 PolarHBondContact O-N 3.2Å |
| 306 | E | 71.2 | Confident | 75.2 | Confident | 52 Ų | 52 | 90.5 Ų | 90.5 | 24% | 0.243 | 43% | 0.43 | C | S | . | . | H | α-helix | trans | -65.6 | -46.2 | 175.4 | -155.2 | -169.9 | 148.4 | 0 | 0 | 110.6 | W302 I308 R309 W310 | W302-E306 HydrophobicContact CZ2-CG 4.46Å; W302-E306 PolarHBondContact NE1-OE2 2.94Å; W302-E306 WeakPolarHBondContact O-CB 3.31Å; W302-E306 PolarHBondContact O-N 3.24Å; E306-I308 PolarHBondContact O-N 3.43Å; E306-R309 WeakPolarHBondContact O-CA 3.24Å; E306-R309 WeakPolarHBondContact O-CB 3.28Å; E306-R309 PolarHBondContact O-N 3.41Å; E306-W310 PolarHBondContact O-N 2.93Å; E306-W310 PolarHBondContact OE1-NE1 3.07Å |
| 307 | A | 69.9 | Low | 74.4 | Confident | 41 Ų | 41 | 89.4 Ų | 89.4 | 34% | 0.339 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -60.2 | -31.2 | 174.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | G303 H304 R311 | G303-A307 WeakPolarHBondContact O-CB 3.41Å; G303-A307 PolarHBondContact O-N 3Å; H304-A307 PolarHBondContact O-N 3.09Å; A307-R311 WeakPolarHBondContact O-CB 3.28Å; A307-R311 WeakPolarHBondContact O-CG 3.46Å; A307-R311 PolarHBondContact O-N 3.38Å; A307-R311 PolarHBondContact O-NE 3.03Å; A307-R311 VanDerWaalsContact O-NE 3.14Å |
| 308 | I | 74.4 | Confident | 73.5 | Confident | 50 Ų | 50 | 91 Ų | 91 | 26% | 0.256 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -73.3 | -33.8 | 172 | -70 | 167.8 | 0 | 0 | 0 | 111.6 | H304 L305 E306 R312 | H304-I308 WeakPolarHBondContact CE1-CD1 3.26Å; H304-I308 WeakPolarHBondContact O-CG1 3.45Å; H304-I308 PolarHBondContact O-N 3.24Å; H304-I308 VanDerWaalsContact O-N 3.09Å; L305-I308 PolarHBondContact O-N 2.92Å; E306-I308 PolarHBondContact O-N 3.43Å; I308-R312 PolarHBondContact O-N 2.88Å |
| 309 | R | 71 | Confident | 72.7 | Confident | 120 Ų | 120 | 96.7 Ų | 96.7 | 45% | 0.453 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -67.9 | -47.1 | 178.1 | -177.1 | -174.4 | -81.2 | -175.4 | -2 | 110.6 | L305 E306 R311 R312 M313 | L305-R309 PolarHBondContact O-N 3.2Å; E306-R309 WeakPolarHBondContact O-CA 3.24Å; E306-R309 WeakPolarHBondContact O-CB 3.28Å; E306-R309 PolarHBondContact O-N 3.41Å; R309-R311 PolarHBondContact O-N 2.89Å; R309-R312 PolarHBondContact O-N 3.03Å; R309-R312 VanDerWaalsContact O-N 3.07Å; R309-M313 HydrophobicContact CG-CE 4.26Å; R309-M313 PolarHBondContact O-N 3.38Å |
| 310 | W | 68.2 | Low | 71.9 | Confident | 139 Ų | 139 | 95.3 Ų | 95.3 | 53% | 0.527 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -57.9 | -46.8 | 176.4 | -73.7 | 110.6 | 0 | 0 | 0 | 111.6 | E306 R312 M313 D314 | E306-W310 PolarHBondContact O-N 2.93Å; E306-W310 PolarHBondContact OE1-NE1 3.07Å; W310-R312 PolarHBondContact O-N 3.36Å; W310-M313 HydrophobicContact CD2-CE 4.25Å; W310-M313 HydrophobicContact CE3-CE 3.86Å; W310-M313 HydrophobicContact CZ3-CE 4.01Å; W310-M313 PolarHBondContact O-N 3.38Å; W310-D314 PolarHBondContact O-N 2.91Å |
| 311 | R | 71.1 | Confident | 70.8 | Confident | 162 Ų | 162 | 96.7 Ų | 96.7 | 61% | 0.611 | 45% | 0.454 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61.6 | -10.9 | 174.5 | -78.8 | -173.8 | -79 | -164.8 | -2.9 | 116.3 | A307 R309 | A307-R311 WeakPolarHBondContact O-CB 3.28Å; A307-R311 WeakPolarHBondContact O-CG 3.46Å; A307-R311 PolarHBondContact O-N 3.38Å; A307-R311 PolarHBondContact O-NE 3.03Å; A307-R311 VanDerWaalsContact O-NE 3.14Å; R309-R311 PolarHBondContact O-N 2.89Å |
| 312 | R | 72.7 | Confident | 69.9 | Low | 196 Ų | 196 | 98.7 Ų | 98.7 | 74% | 0.74 | 46% | 0.463 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -99.9 | -11.7 | 174.9 | -90.1 | -169.9 | -84.2 | -171.8 | -8.5 | 113.2 | I308 R309 W310 | I308-R312 PolarHBondContact O-N 2.88Å; R309-R312 PolarHBondContact O-N 3.03Å; R309-R312 VanDerWaalsContact O-N 3.07Å; W310-R312 PolarHBondContact O-N 3.36Å |
| 313 | M | 61.1 | Low | 69.2 | Low | 123 Ų | 123 | 106.3 Ų | 106.3 | 61% | 0.606 | 50% | 0.499 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -93.4 | -24.8 | 175.7 | -65.2 | -161.3 | -75.4 | 0 | 0 | 111.7 | R309 W310 | R309-M313 HydrophobicContact CG-CE 4.26Å; R309-M313 PolarHBondContact O-N 3.38Å; W310-M313 HydrophobicContact CD2-CE 4.25Å; W310-M313 HydrophobicContact CE3-CE 3.86Å; W310-M313 HydrophobicContact CZ3-CE 4.01Å; W310-M313 PolarHBondContact O-N 3.38Å |
| 314 | D | 50 | Low | 68.9 | Low | 183 Ų | 183 | 112.3 Ų | 112.3 | 98% | 0.979 | 51% | 0.506 | S | S | * | . | trans | -75.4 | 0 | 163.1 | -55.7 | -31.7 | 0 | 0 | 0 | 111.7 | W310 | W310-D314 PolarHBondContact O-N 2.91Š|
Retrieved 314 of 314 residues in 453.4 ms
(Link to these results)