| 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 | 83.8 | Confident | 90.4 | Very high | 66 Ų | 66 | 76.8 Ų | 76.8 | 33% | 0.325 | 45% | 0.446 | S | S | . | . | 0 | -57.5 | 0 | -173 | 171 | -70.5 | 0 | 0 | 110.3 | E3 V4 L5 L46 L49 M50 L71 | M1-E3 VanDerWaalsContact C-N 3.34Å; M1-E3 PolarHBondContact O-N 3.29Å; M1-V4 WeakPolarHBondContact O-CB 3.19Å; M1-V4 PolarHBondContact O-N 3.36Å; M1-V4 VanDerWaalsContact O-N 3.07Å; M1-L5 HydrophobicContact CG-CD1 4.3Å; M1-L5 PolarHBondContact O-N 3.26Å; M1-L5 VanDerWaalsContact O-N 3.13Å; M1-L46 HydrophobicContact CE-CD1 3.77Å; M1-L46 HydrophobicContact CG-CD1 4.32Å; M1-L46 HydrophobicContact SD-CD1 3.44Å; M1-L46 WeakPolarHBondContact SD-CD1 3.47Å; M1-L46 HydrophobicContact SD-CG 4.05Å; M1-L49 HydrophobicContact CE-CD2 3.74Å; M1-L49 HydrophobicContact CE-CG 3.88Å; M1-L49 HydrophobicContact SD-CG 4.25Å; M1-M50 HydrophobicContact CB-CG 4.17Å; M1-M50 HydrophobicContact CG-CB 4.22Å; M1-M50 HydrophobicContact CG-CG 4.04Å; M1-M50 HydrophobicContact SD-CB 3.65Å; M1-M50 HydrophobicContact SD-CG 4.11Å; M1-L71 HydrophobicContact CE-CD1 4.32Å; M1-L71 HydrophobicContact CE-CD2 3.93Å; M1-L71 HydrophobicContact CE-CG 4.45Å | |||
| 2 | W | 91.5 | Very high | 90.7 | Very high | 32 Ų | 32 | 74.2 Ų | 74.2 | 12% | 0.121 | 42% | 0.424 | C | S | . | . | H | α-helix | trans | -51.7 | -51.6 | 172.9 | -171.8 | 88.1 | 0 | 0 | 0 | 112.4 | V4 L5 T6 E9 P11 L36 E37 M50 | W2-V4 PolarHBondContact O-N 3.03Å; W2-V4 VanDerWaalsContact O-N 3.13Å; W2-L5 CarbonylContact O-C 3.58Å; W2-L5 WeakPolarHBondContact O-CA 3.35Å; W2-L5 WeakPolarHBondContact O-CB 3.35Å; W2-L5 PolarHBondContact O-N 3.16Å; W2-T6 HydrophobicContact CD2-CG2 3.92Å; W2-T6 HydrophobicContact CE3-CG2 4.14Å; W2-T6 HydrophobicContact CH2-CG2 3.8Å; W2-T6 HydrophobicContact CZ2-CG2 3.58Å; W2-T6 HydrophobicContact CZ3-CG2 4.08Å; W2-T6 WeakPolarHBondContact CZ3-OG1 3.18Å; W2-T6 PolarHBondContact O-N 2.94Å; W2-T6 PolarHBondContact O-OG1 3.31Å; W2-T6 VanDerWaalsContact O-OG1 3.11Å; W2-E9 HydrophobicContact CH2-CB 3.81Å; W2-E9 HydrophobicContact CZ3-CB 3.83Å; W2-E9 WeakPolarHBondContact CZ3-O 3.44Å; W2-P11 HydrophobicContact CE3-CB 4.41Å; W2-P11 HydrophobicContact CZ3-CB 4.39Å; W2-L36 HydrophobicContact CB-CD1 4.18Å; W2-L36 HydrophobicContact CD2-CB 4.48Å; W2-L36 HydrophobicContact CD2-CD1 3.91Å; W2-L36 HydrophobicContact CD2-CD2 4.46Å; W2-L36 HydrophobicContact CD2-CG 4.5Å; W2-L36 HydrophobicContact CE3-CD1 4.24Å; W2-L36 HydrophobicContact CG-CB 4.15Å; W2-L36 HydrophobicContact CG-CD1 3.87Å; W2-L36 HydrophobicContact CZ2-CD2 4.29Å; W2-E37 PolarHBondContact NE1-O 2.96Å; W2-M50 HydrophobicContact CB-SD 3.69Å; W2-M50 HydrophobicContact CG-SD 4.17Å |
| 3 | E | 92.4 | Very high | 90.8 | Very high | 107 Ų | 107 | 72.4 Ų | 72.4 | 50% | 0.5 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -57.4 | -29.8 | 177.6 | -63.3 | 168.5 | 157.4 | 0 | 0 | 113.8 | M1 T6 D7 G8 | M1-E3 VanDerWaalsContact C-N 3.34Å; M1-E3 PolarHBondContact O-N 3.29Å; E3-T6 WeakPolarHBondContact CA-OG1 3.2Å; E3-D7 PolarHBondContact O-N 3.17Å; E3-G8 WeakPolarHBondContact O-CA 3.28Å; E3-G8 PolarHBondContact O-N 3.17Å |
| 4 | V | 89.6 | Confident | 90.8 | Very high | 121 Ų | 121 | 76.6 Ų | 76.6 | 73% | 0.733 | 44% | 0.437 | S | S | * | . | H | α-helix | trans | -76.2 | -34.7 | 176.8 | 176.9 | 0 | 0 | 0 | 0 | 110.5 | M1 W2 | M1-V4 WeakPolarHBondContact O-CB 3.19Å; M1-V4 PolarHBondContact O-N 3.36Å; M1-V4 VanDerWaalsContact O-N 3.07Å; W2-V4 PolarHBondContact O-N 3.03Å; W2-V4 VanDerWaalsContact O-N 3.13Å |
| 5 | L | 87.7 | Confident | 91 | Very high | 59 Ų | 59 | 74.1 Ų | 74.1 | 31% | 0.309 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -78.3 | -20.9 | 178.9 | -66.4 | 170.4 | 0 | 0 | 0 | 113 | M1 W2 P39 T42 L46 M50 | M1-L5 HydrophobicContact CG-CD1 4.3Å; M1-L5 PolarHBondContact O-N 3.26Å; M1-L5 VanDerWaalsContact O-N 3.13Å; W2-L5 CarbonylContact O-C 3.58Å; W2-L5 WeakPolarHBondContact O-CA 3.35Å; W2-L5 WeakPolarHBondContact O-CB 3.35Å; W2-L5 PolarHBondContact O-N 3.16Å; L5-P39 HydrophobicContact CB-CG 3.79Å; L5-T42 HydrophobicContact CD1-CG2 3.67Å; L5-L46 HydrophobicContact CD1-CD2 3.97Å; L5-L46 HydrophobicContact CD1-CG 4.33Å; L5-L46 HydrophobicContact CD2-CD2 3.72Å; L5-L46 HydrophobicContact CG-CD2 4.34Å; L5-M50 HydrophobicContact CD1-SD 4.19Å |
| 6 | T | 89.6 | Confident | 91.1 | Very high | 20 Ų | 20 | 76.6 Ų | 76.6 | 12% | 0.123 | 43% | 0.428 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -101.2 | 10.1 | 175.6 | 54.2 | 0 | 0 | 0 | 0 | 113.7 | W2 E3 G8 E9 P39 | W2-T6 HydrophobicContact CD2-CG2 3.92Å; W2-T6 HydrophobicContact CE3-CG2 4.14Å; W2-T6 HydrophobicContact CH2-CG2 3.8Å; W2-T6 HydrophobicContact CZ2-CG2 3.58Å; W2-T6 HydrophobicContact CZ3-CG2 4.08Å; W2-T6 WeakPolarHBondContact CZ3-OG1 3.18Å; W2-T6 PolarHBondContact O-N 2.94Å; W2-T6 PolarHBondContact O-OG1 3.31Å; W2-T6 VanDerWaalsContact O-OG1 3.11Å; E3-T6 WeakPolarHBondContact CA-OG1 3.2Å; T6-G8 VanDerWaalsContact C-N 3.27Å; T6-G8 PolarHBondContact O-N 3.48Å; T6-E9 WeakPolarHBondContact O-CG 3.29Å; T6-P39 HydrophobicContact CG2-CB 4.3Å; T6-P39 HydrophobicContact CG2-CG 3.33Å |
| 7 | D | 90 | Very high | 91.3 | Very high | 161 Ų | 161 | 81.9 Ų | 81.9 | 86% | 0.861 | 45% | 0.449 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 56.6 | 39 | -179.4 | -156.6 | 31.3 | 0 | 0 | 0 | 113.7 | E3 | E3-D7 PolarHBondContact O-N 3.17Š|
| 8 | G | 90.8 | Very high | 91.3 | Very high | 61 Ų | 61 | 85.9 Ų | 85.9 | 63% | 0.629 | 46% | 0.461 | S | S | * | . | S | Bend | trans | 91.6 | 15.1 | 172.6 | 0 | 0 | 0 | 0 | 0 | 115.7 | E3 T6 | E3-G8 WeakPolarHBondContact O-CA 3.28Å; E3-G8 PolarHBondContact O-N 3.17Å; T6-G8 VanDerWaalsContact C-N 3.27Å; T6-G8 PolarHBondContact O-N 3.48Å |
| 9 | E | 92.6 | Very high | 91.4 | Very high | 118 Ų | 118 | 82.2 Ų | 82.2 | 55% | 0.551 | 44% | 0.443 | S | S | * | . | P | Polyproline II helix | trans | -57.7 | 151.8 | 173.1 | -72.4 | -179.5 | 172.2 | 0 | 0 | 112.6 | W2 T6 | W2-E9 HydrophobicContact CH2-CB 3.81Å; W2-E9 HydrophobicContact CZ3-CB 3.83Å; W2-E9 WeakPolarHBondContact CZ3-O 3.44Å; T6-E9 WeakPolarHBondContact O-CG 3.29Å |
| 10 | A | 92.7 | Very high | 91.3 | Very high | 59 Ų | 59 | 89.2 Ų | 89.2 | 49% | 0.488 | 47% | 0.469 | S | S | . | . | P | Polyproline II helix | trans | -77.9 | 126.7 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.1 | A13 | A10-A13 HydrophobicContact CB-CB 4.36Å; A10-A13 PolarHBondContact O-N 2.72Å |
| 11 | P | 93.1 | Very high | 91.5 | Very high | 41 Ų | 41 | 87.6 Ų | 87.6 | 27% | 0.266 | 47% | 0.468 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -65.6 | 138.2 | 178.5 | 27.1 | -34.3 | 0 | 0 | 0 | 111.3 | W2 A13 L36 | W2-P11 HydrophobicContact CE3-CB 4.41Å; W2-P11 HydrophobicContact CZ3-CB 4.39Å; P11-A13 PolarHBondContact O-N 3.46Å; P11-L36 HydrophobicContact CB-CD1 3.66Å; P11-L36 HydrophobicContact CB-CD2 4.16Å |
| 12 | Y | 94.3 | Very high | 92 | Very high | 45 Ų | 45 | 87.1 Ų | 87.1 | 18% | 0.176 | 47% | 0.465 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 58.4 | 27.1 | 179.1 | -46 | -76.9 | 0 | 0 | 0 | 114.3 | E14 L15 Q16 L26 F29 L30 L36 | Y12-E14 VanDerWaalsContact C-N 3.25Å; Y12-E14 PolarHBondContact O-N 3.25Å; Y12-L15 WeakPolarHBondContact O-CB 3.46Å; Y12-L15 PolarHBondContact O-N 3.5Å; Y12-Q16 PolarHBondContact O-N 2.97Å; Y12-L26 HydrophobicContact CD1-CD1 3.99Å; Y12-L26 HydrophobicContact CD2-CD1 3.73Å; Y12-L26 HydrophobicContact CE1-CD1 4.16Å; Y12-L26 HydrophobicContact CE2-CD1 3.91Å; Y12-L26 HydrophobicContact CG-CD1 3.78Å; Y12-F29 HydrophobicContact CD1-CD1 4.49Å; Y12-F29 HydrophobicContact CD1-CE1 4.17Å; Y12-F29 HydrophobicContact CE1-CD1 4.23Å; Y12-F29 AromaticContact CE1-CE1 3.85Å; Y12-F29 HydrophobicContact CE1-CE1 3.85Å; Y12-L30 HydrophobicContact CE1-CD2 4.45Å; Y12-L30 WeakPolarHBondContact OH-CD2 3.4Å; Y12-L36 HydrophobicContact CD1-CD2 3.68Å; Y12-L36 HydrophobicContact CD1-CG 4.21Å; Y12-L36 HydrophobicContact CD2-CD2 4.24Å; Y12-L36 HydrophobicContact CE1-CD2 3.63Å; Y12-L36 HydrophobicContact CE1-CG 3.64Å; Y12-L36 HydrophobicContact CE2-CD1 4.1Å; Y12-L36 HydrophobicContact CE2-CD2 4.2Å; Y12-L36 HydrophobicContact CE2-CG 4Å; Y12-L36 HydrophobicContact CG-CD2 3.99Å |
| 13 | A | 92.4 | Very high | 92.1 | Very high | 51 Ų | 51 | 87.8 Ų | 87.8 | 42% | 0.421 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -51.5 | -42 | -178.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | A10 P11 L15 Q16 E17 | A10-A13 HydrophobicContact CB-CB 4.36Å; A10-A13 PolarHBondContact O-N 2.72Å; P11-A13 PolarHBondContact O-N 3.46Å; A13-L15 VanDerWaalsContact C-N 3.35Å; A13-L15 PolarHBondContact O-N 3.36Å; A13-Q16 PolarHBondContact O-N 3.33Å; A13-E17 PolarHBondContact O-N 3.37Å |
| 14 | E | 91.3 | Very high | 92.3 | Very high | 132 Ų | 132 | 85.1 Ų | 85.1 | 62% | 0.617 | 48% | 0.478 | S | S | * | . | H | α-helix | trans | -63.6 | -38.1 | 177.4 | -64.5 | -166.9 | -165.2 | 0 | 0 | 113.5 | Y12 K18 | Y12-E14 VanDerWaalsContact C-N 3.25Å; Y12-E14 PolarHBondContact O-N 3.25Å; E14-K18 WeakPolarHBondContact O-CB 3.31Å; E14-K18 WeakPolarHBondContact O-CD 3.46Å; E14-K18 VanDerWaalsContact O-CG 3.28Å; E14-K18 WeakPolarHBondContact O-CG 3.39Å; E14-K18 PolarHBondContact O-N 3.45Å; E14-K18 IonicContact OE2-NZ 3.1Å; E14-K18 PolarHBondContact OE2-NZ 2.86Å; E14-K18 VanDerWaalsContact OE2-NZ 3.1Å |
| 15 | L | 93.1 | Very high | 92.6 | Very high | 39 Ų | 39 | 82.4 Ų | 82.4 | 20% | 0.204 | 46% | 0.459 | C | S | . | . | H | α-helix | trans | -69.8 | -39.9 | 177.5 | -177.2 | 63 | 0 | 0 | 0 | 109.9 | Y12 A13 E17 K18 S19 F22 D25 L26 F29 | Y12-L15 WeakPolarHBondContact O-CB 3.46Å; Y12-L15 PolarHBondContact O-N 3.5Å; A13-L15 VanDerWaalsContact C-N 3.35Å; A13-L15 PolarHBondContact O-N 3.36Å; L15-E17 VanDerWaalsContact C-N 3.33Å; L15-E17 PolarHBondContact O-N 2.93Å; L15-K18 PolarHBondContact O-N 3.35Å; L15-S19 WeakPolarHBondContact O-CB 3.43Å; L15-S19 PolarHBondContact O-N 2.96Å; L15-F22 HydrophobicContact CB-CD2 4.49Å; L15-F22 HydrophobicContact CB-CE2 4.18Å; L15-F22 HydrophobicContact CD2-CD2 4.44Å; L15-F22 HydrophobicContact CD2-CE2 4.16Å; L15-F22 HydrophobicContact CG-CD2 4.12Å; L15-F22 HydrophobicContact CG-CE2 4.1Å; L15-D25 HydrophobicContact CD1-CB 4.3Å; L15-L26 HydrophobicContact CD2-CB 4.15Å; L15-L26 HydrophobicContact CD2-CD1 4.05Å; L15-F29 HydrophobicContact CD2-CB 4.16Å; L15-F29 HydrophobicContact CD2-CG 4.35Å |
| 16 | Q | 92.7 | Very high | 93 | Very high | 113 Ų | 113 | 81.1 Ų | 81.1 | 53% | 0.528 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -63.9 | -37 | 176.1 | -170.1 | 178 | -54.4 | 0 | 0 | 112.3 | Y12 A13 F22 | Y12-Q16 PolarHBondContact O-N 2.97Å; A13-Q16 PolarHBondContact O-N 3.33Å; Q16-F22 VanDerWaalsContact CA-CD2 3.43Å; Q16-F22 HydrophobicContact CB-CD2 3.76Å; Q16-F22 HydrophobicContact CB-CE2 3.74Å; Q16-F22 HydrophobicContact CB-CG 4.21Å; Q16-F22 HydrophobicContact CB-CZ 4.19Å; Q16-F22 HydrophobicContact CG-CD1 4.34Å; Q16-F22 HydrophobicContact CG-CD2 4.2Å; Q16-F22 HydrophobicContact CG-CE2 4.43Å; Q16-F22 HydrophobicContact CG-CG 4.14Å |
| 17 | E | 93.6 | Very high | 93.3 | Very high | 167 Ų | 167 | 84.8 Ų | 84.8 | 78% | 0.78 | 47% | 0.471 | S | S | * | . | H | α-helix | trans | -68.9 | -40.5 | 177.1 | -173.3 | -176.5 | -179.8 | 0 | 0 | 112.2 | A13 L15 | A13-E17 PolarHBondContact O-N 3.37Å; L15-E17 VanDerWaalsContact C-N 3.33Å; L15-E17 PolarHBondContact O-N 2.93Å |
| 18 | K | 92.6 | Very high | 93.6 | Very high | 154 Ų | 154 | 82.3 Ų | 82.3 | 67% | 0.67 | 46% | 0.457 | S | S | * | . | H | α-helix | trans | -84.1 | -25.9 | -174.6 | -65.9 | 167.2 | -169.3 | 163.1 | 0 | 113.1 | E14 L15 | E14-K18 WeakPolarHBondContact O-CB 3.31Å; E14-K18 WeakPolarHBondContact O-CD 3.46Å; E14-K18 VanDerWaalsContact O-CG 3.28Å; E14-K18 WeakPolarHBondContact O-CG 3.39Å; E14-K18 PolarHBondContact O-N 3.45Å; E14-K18 IonicContact OE2-NZ 3.1Å; E14-K18 PolarHBondContact OE2-NZ 2.86Å; E14-K18 VanDerWaalsContact OE2-NZ 3.1Å; L15-K18 PolarHBondContact O-N 3.35Å |
| 19 | S | 92.1 | Very high | 93.8 | Very high | 16 Ų | 16 | 82.9 Ų | 82.9 | 11% | 0.112 | 44% | 0.442 | C | S | . | . | trans | -94.5 | 132 | -172.8 | 179.6 | 0 | 0 | 0 | 0 | 112.9 | L15 A21 F22 D25 | L15-S19 WeakPolarHBondContact O-CB 3.43Å; L15-S19 PolarHBondContact O-N 2.96Å; S19-A21 PolarHBondContact OG-N 3.01Å; S19-F22 WeakPolarHBondContact OG-CA 3.36Å; S19-F22 PolarHBondContact OG-N 3.48Å; S19-F22 VanDerWaalsContact OG-N 3.11Å; S19-D25 WeakPolarHBondContact CB-OD2 3.34Å; S19-D25 PolarHBondContact OG-OD2 3.43Å | ||
| 20 | K | 90.6 | Very high | 94 | Very high | 222 Ų | 222 | 79.4 Ų | 79.4 | 97% | 0.965 | 43% | 0.427 | S | S | * | . | S | Bend | trans | -80.3 | -19.2 | 169 | -65 | -176.6 | -179.4 | -179.9 | 0 | 113 | ||
| 21 | A | 94 | Very high | 94.1 | Very high | 55 Ų | 55 | 82.8 Ų | 82.8 | 46% | 0.455 | 44% | 0.438 | S | S | . | . | S | Bend | trans | -128.9 | 52 | -175.4 | 0 | 0 | 0 | 0 | 0 | 109.7 | S19 G23 A24 D25 | S19-A21 PolarHBondContact OG-N 3.01Å; A21-G23 PolarHBondContact O-N 3.32Å; A21-A24 PolarHBondContact O-N 2.91Å; A21-D25 PolarHBondContact O-N 3.06Å |
| 22 | F | 94.4 | Very high | 94.2 | Very high | 56 Ų | 56 | 84.3 Ų | 84.3 | 25% | 0.246 | 45% | 0.454 | C | S | . | . | H | α-helix | trans | -46.8 | -42.5 | -167.8 | 172.4 | -113.8 | 0 | 0 | 0 | 114.4 | L15 Q16 S19 A24 D25 L26 | L15-F22 HydrophobicContact CB-CD2 4.49Å; L15-F22 HydrophobicContact CB-CE2 4.18Å; L15-F22 HydrophobicContact CD2-CD2 4.44Å; L15-F22 HydrophobicContact CD2-CE2 4.16Å; L15-F22 HydrophobicContact CG-CD2 4.12Å; L15-F22 HydrophobicContact CG-CE2 4.1Å; Q16-F22 VanDerWaalsContact CA-CD2 3.43Å; Q16-F22 HydrophobicContact CB-CD2 3.76Å; Q16-F22 HydrophobicContact CB-CE2 3.74Å; Q16-F22 HydrophobicContact CB-CG 4.21Å; Q16-F22 HydrophobicContact CB-CZ 4.19Å; Q16-F22 HydrophobicContact CG-CD1 4.34Å; Q16-F22 HydrophobicContact CG-CD2 4.2Å; Q16-F22 HydrophobicContact CG-CE2 4.43Å; Q16-F22 HydrophobicContact CG-CG 4.14Å; S19-F22 WeakPolarHBondContact OG-CA 3.36Å; S19-F22 PolarHBondContact OG-N 3.48Å; S19-F22 VanDerWaalsContact OG-N 3.11Å; F22-A24 VanDerWaalsContact C-N 3.34Å; F22-A24 PolarHBondContact O-N 3.12Å; F22-D25 PolarHBondContact O-N 3.13Å; F22-L26 HydrophobicContact CE1-CD2 4.08Å; F22-L26 HydrophobicContact CE2-CB 4.29Å; F22-L26 HydrophobicContact CE2-CD2 4.43Å; F22-L26 HydrophobicContact CZ-CB 4.45Å; F22-L26 HydrophobicContact CZ-CD2 3.82Å; F22-L26 WeakPolarHBondContact O-CB 3.47Å; F22-L26 PolarHBondContact O-N 2.9Å |
| 23 | G | 94.6 | Very high | 94.1 | Very high | 47 Ų | 47 | 84.7 Ų | 84.7 | 49% | 0.485 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -60.6 | -39.9 | 179.6 | 0 | 0 | 0 | 0 | 0 | 113.8 | A21 I27 | A21-G23 PolarHBondContact O-N 3.32Å; G23-I27 WeakPolarHBondContact O-CD1 3.31Å; G23-I27 VanDerWaalsContact O-CG1 3.27Å; G23-I27 WeakPolarHBondContact O-CG1 3.33Å; G23-I27 PolarHBondContact O-N 3.49Å |
| 24 | A | 96.2 | Very high | 94.2 | Very high | 51 Ų | 51 | 85.9 Ų | 85.9 | 42% | 0.421 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -73.7 | -48.4 | 178.6 | 0 | 0 | 0 | 0 | 0 | 110.9 | A21 F22 L26 I27 D28 | A21-A24 PolarHBondContact O-N 2.91Å; F22-A24 VanDerWaalsContact C-N 3.34Å; F22-A24 PolarHBondContact O-N 3.12Å; A24-L26 PolarHBondContact O-N 2.94Å; A24-I27 WeakPolarHBondContact O-CB 3.44Å; A24-I27 PolarHBondContact O-N 3.29Å; A24-D28 PolarHBondContact O-N 2.99Å |
| 25 | D | 95.9 | Very high | 94.4 | Very high | 63 Ų | 63 | 82 Ų | 82 | 34% | 0.337 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -63.4 | -33.3 | 179.9 | -65.5 | 4.8 | 0 | 0 | 0 | 111.8 | L15 S19 A21 F22 D28 F29 | L15-D25 HydrophobicContact CD1-CB 4.3Å; S19-D25 WeakPolarHBondContact CB-OD2 3.34Å; S19-D25 PolarHBondContact OG-OD2 3.43Å; A21-D25 PolarHBondContact O-N 3.06Å; F22-D25 PolarHBondContact O-N 3.13Å; D25-D28 PolarHBondContact O-N 2.99Å; D25-F29 VanDerWaalsContact O-CB 3.24Å; D25-F29 WeakPolarHBondContact O-CB 3.48Å; D25-F29 PolarHBondContact O-N 2.95Å |
| 26 | L | 96.3 | Very high | 94.4 | Very high | 33 Ų | 33 | 81.2 Ų | 81.2 | 17% | 0.173 | 45% | 0.446 | C | S | . | . | H | α-helix | trans | -65.9 | -41.3 | 173.3 | 179.5 | 62.4 | 0 | 0 | 0 | 111.3 | Y12 L15 F22 A24 F29 L30 | Y12-L26 HydrophobicContact CD1-CD1 3.99Å; Y12-L26 HydrophobicContact CD2-CD1 3.73Å; Y12-L26 HydrophobicContact CE1-CD1 4.16Å; Y12-L26 HydrophobicContact CE2-CD1 3.91Å; Y12-L26 HydrophobicContact CG-CD1 3.78Å; L15-L26 HydrophobicContact CD2-CB 4.15Å; L15-L26 HydrophobicContact CD2-CD1 4.05Å; F22-L26 HydrophobicContact CE1-CD2 4.08Å; F22-L26 HydrophobicContact CE2-CB 4.29Å; F22-L26 HydrophobicContact CE2-CD2 4.43Å; F22-L26 HydrophobicContact CZ-CB 4.45Å; F22-L26 HydrophobicContact CZ-CD2 3.82Å; F22-L26 WeakPolarHBondContact O-CB 3.47Å; F22-L26 PolarHBondContact O-N 2.9Å; A24-L26 PolarHBondContact O-N 2.94Å; L26-F29 PolarHBondContact O-N 3.48Å; L26-L30 HydrophobicContact CD1-CD1 4.08Å; L26-L30 HydrophobicContact CD1-CG 4.07Å; L26-L30 HydrophobicContact CG-CD1 3.99Å; L26-L30 HydrophobicContact CG-CG 4.37Å; L26-L30 WeakPolarHBondContact O-CB 3.48Å; L26-L30 WeakPolarHBondContact O-CG 3.41Å; L26-L30 PolarHBondContact O-N 2.82Å |
| 27 | I | 95.8 | Very high | 94.3 | Very high | 97 Ų | 97 | 83.7 Ų | 83.7 | 50% | 0.497 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -61.3 | -49.5 | 175.3 | -70.1 | 164.1 | 0 | 0 | 0 | 109.7 | G23 A24 F29 L30 D31 | G23-I27 WeakPolarHBondContact O-CD1 3.31Å; G23-I27 VanDerWaalsContact O-CG1 3.27Å; G23-I27 WeakPolarHBondContact O-CG1 3.33Å; G23-I27 PolarHBondContact O-N 3.49Å; A24-I27 WeakPolarHBondContact O-CB 3.44Å; A24-I27 PolarHBondContact O-N 3.29Å; I27-F29 VanDerWaalsContact C-N 3.31Å; I27-F29 PolarHBondContact O-N 3.4Å; I27-L30 PolarHBondContact O-N 2.9Å; I27-L30 VanDerWaalsContact O-N 3.13Å; I27-D31 WeakPolarHBondContact O-CB 3.43Å; I27-D31 PolarHBondContact O-N 2.95Å |
| 28 | D | 96 | Very high | 94.1 | Very high | 109 Ų | 109 | 76.8 Ų | 76.8 | 58% | 0.583 | 43% | 0.428 | S | S | * | . | H | α-helix | trans | -60 | -41.4 | 178.9 | -70.9 | -16.7 | 0 | 0 | 0 | 112 | A24 D25 L30 D31 A32 | A24-D28 PolarHBondContact O-N 2.99Å; D25-D28 PolarHBondContact O-N 2.99Å; D28-L30 PolarHBondContact O-N 2.92Å; D28-D31 PolarHBondContact O-N 3.41Å; D28-A32 WeakPolarHBondContact O-CB 3.5Å; D28-A32 PolarHBondContact O-N 3.3Å |
| 29 | F | 95.9 | Very high | 94 | Very high | 72 Ų | 72 | 70.9 Ų | 70.9 | 32% | 0.316 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -60.9 | -44.2 | 175.8 | -178.6 | -93.6 | 0 | 0 | 0 | 112 | Y12 L15 D25 L26 I27 N34 | Y12-F29 HydrophobicContact CD1-CD1 4.49Å; Y12-F29 HydrophobicContact CD1-CE1 4.17Å; Y12-F29 HydrophobicContact CE1-CD1 4.23Å; Y12-F29 AromaticContact CE1-CE1 3.85Å; Y12-F29 HydrophobicContact CE1-CE1 3.85Å; L15-F29 HydrophobicContact CD2-CB 4.16Å; L15-F29 HydrophobicContact CD2-CG 4.35Å; D25-F29 VanDerWaalsContact O-CB 3.24Å; D25-F29 WeakPolarHBondContact O-CB 3.48Å; D25-F29 PolarHBondContact O-N 2.95Å; L26-F29 PolarHBondContact O-N 3.48Å; I27-F29 VanDerWaalsContact C-N 3.31Å; I27-F29 PolarHBondContact O-N 3.4Å; F29-N34 HydrophobicContact CD1-CB 3.7Å; F29-N34 HydrophobicContact CD2-CB 3.95Å; F29-N34 HydrophobicContact CE1-CB 3.29Å; F29-N34 HydrophobicContact CE2-CB 3.58Å; F29-N34 HydrophobicContact CG-CB 4.01Å; F29-N34 HydrophobicContact CZ-CB 3.25Å; F29-N34 WeakPolarHBondContact O-CB 3.43Å; F29-N34 PolarHBondContact O-N 3.19Å; F29-N34 PolarHBondContact O-ND2 2.76Å |
| 30 | L | 96 | Very high | 93.6 | Very high | 45 Ų | 45 | 79.4 Ų | 79.4 | 24% | 0.236 | 44% | 0.441 | C | S | . | . | H | α-helix | trans | -72.3 | -37 | 178.9 | -66.2 | 174.8 | 0 | 0 | 0 | 112.1 | Y12 L26 I27 D28 A32 G33 N34 R35 | Y12-L30 HydrophobicContact CE1-CD2 4.45Å; Y12-L30 WeakPolarHBondContact OH-CD2 3.4Å; L26-L30 HydrophobicContact CD1-CD1 4.08Å; L26-L30 HydrophobicContact CD1-CG 4.07Å; L26-L30 HydrophobicContact CG-CD1 3.99Å; L26-L30 HydrophobicContact CG-CG 4.37Å; L26-L30 WeakPolarHBondContact O-CB 3.48Å; L26-L30 WeakPolarHBondContact O-CG 3.41Å; L26-L30 PolarHBondContact O-N 2.82Å; I27-L30 PolarHBondContact O-N 2.9Å; I27-L30 VanDerWaalsContact O-N 3.13Å; D28-L30 PolarHBondContact O-N 2.92Å; L30-A32 VanDerWaalsContact C-N 3.29Å; L30-A32 PolarHBondContact O-N 3.14Å; L30-G33 WeakPolarHBondContact O-CA 3.5Å; L30-G33 PolarHBondContact O-N 2.96Å; L30-N34 WeakPolarHBondContact CD2-O 3.35Å; L30-R35 PolarHBondContact O-NH1 3.17Å |
| 31 | D | 94.5 | Very high | 93.4 | Very high | 131 Ų | 131 | 76.6 Ų | 76.6 | 70% | 0.701 | 44% | 0.437 | S | S | * | . | H | α-helix | trans | -69.7 | -29.2 | 178.1 | -78.1 | -10.8 | 0 | 0 | 0 | 111.6 | I27 D28 G33 | I27-D31 WeakPolarHBondContact O-CB 3.43Å; I27-D31 PolarHBondContact O-N 2.95Å; D28-D31 PolarHBondContact O-N 3.41Å; D31-G33 PolarHBondContact O-N 3.47Å; D31-G33 VanDerWaalsContact O-N 3.15Å |
| 32 | A | 95.1 | Very high | 93.2 | Very high | 73 Ų | 73 | 75 Ų | 75 | 60% | 0.603 | 42% | 0.421 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -69.1 | -1.4 | 167.8 | 0 | 0 | 0 | 0 | 0 | 113.9 | D28 L30 | D28-A32 WeakPolarHBondContact O-CB 3.5Å; D28-A32 PolarHBondContact O-N 3.3Å; L30-A32 VanDerWaalsContact C-N 3.29Å; L30-A32 PolarHBondContact O-N 3.14Å |
| 33 | G | 92.7 | Very high | 93 | Very high | 52 Ų | 52 | 74.2 Ų | 74.2 | 54% | 0.536 | 42% | 0.422 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 87.4 | -0 | 178.1 | 0 | 0 | 0 | 0 | 0 | 114.5 | L30 D31 | L30-G33 WeakPolarHBondContact O-CA 3.5Å; L30-G33 PolarHBondContact O-N 2.96Å; D31-G33 PolarHBondContact O-N 3.47Å; D31-G33 VanDerWaalsContact O-N 3.15Å |
| 34 | N | 95 | Very high | 92.9 | Very high | 76 Ų | 76 | 76.5 Ų | 76.5 | 41% | 0.406 | 43% | 0.428 | S | S | . | . | trans | -73.9 | 144.1 | 178.8 | -53.9 | -63.2 | 0 | 0 | 0 | 110.6 | F29 L30 | F29-N34 HydrophobicContact CD1-CB 3.7Å; F29-N34 HydrophobicContact CD2-CB 3.95Å; F29-N34 HydrophobicContact CE1-CB 3.29Å; F29-N34 HydrophobicContact CE2-CB 3.58Å; F29-N34 HydrophobicContact CG-CB 4.01Å; F29-N34 HydrophobicContact CZ-CB 3.25Å; F29-N34 WeakPolarHBondContact O-CB 3.43Å; F29-N34 PolarHBondContact O-N 3.19Å; F29-N34 PolarHBondContact O-ND2 2.76Å; L30-N34 WeakPolarHBondContact CD2-O 3.35Å | ||
| 35 | R | 95.1 | Very high | 92.7 | Very high | 52 Ų | 52 | 78.8 Ų | 78.8 | 20% | 0.196 | 43% | 0.43 | C | S | . | . | trans | -138.9 | 169.7 | 177.5 | -64.6 | -63.3 | -178.1 | -87 | 4.4 | 109.3 | L30 E37 M54 | L30-R35 PolarHBondContact O-NH1 3.17Å; R35-E37 PolarHBondContact O-N 3.22Å; R35-M54 HydrophobicContact CB-CE 4.23Å; R35-M54 HydrophobicContact CG-CB 4.41Å; R35-M54 PolarHBondContact NE-O 2.78Å | ||
| 36 | L | 93.8 | Very high | 92.5 | Very high | 22 Ų | 22 | 76.9 Ų | 76.9 | 12% | 0.115 | 42% | 0.42 | C | S | . | . | P | Polyproline II helix | trans | -55.1 | 132.7 | 169.3 | -67.1 | 165.4 | 0 | 0 | 0 | 110.5 | W2 P11 Y12 M54 | W2-L36 HydrophobicContact CB-CD1 4.18Å; W2-L36 HydrophobicContact CD2-CB 4.48Å; W2-L36 HydrophobicContact CD2-CD1 3.91Å; W2-L36 HydrophobicContact CD2-CD2 4.46Å; W2-L36 HydrophobicContact CD2-CG 4.5Å; W2-L36 HydrophobicContact CE3-CD1 4.24Å; W2-L36 HydrophobicContact CG-CB 4.15Å; W2-L36 HydrophobicContact CG-CD1 3.87Å; W2-L36 HydrophobicContact CZ2-CD2 4.29Å; P11-L36 HydrophobicContact CB-CD1 3.66Å; P11-L36 HydrophobicContact CB-CD2 4.16Å; Y12-L36 HydrophobicContact CD1-CD2 3.68Å; Y12-L36 HydrophobicContact CD1-CG 4.21Å; Y12-L36 HydrophobicContact CD2-CD2 4.24Å; Y12-L36 HydrophobicContact CE1-CD2 3.63Å; Y12-L36 HydrophobicContact CE1-CG 3.64Å; Y12-L36 HydrophobicContact CE2-CD1 4.1Å; Y12-L36 HydrophobicContact CE2-CD2 4.2Å; Y12-L36 HydrophobicContact CE2-CG 4Å; Y12-L36 HydrophobicContact CG-CD2 3.99Å; L36-M54 HydrophobicContact CB-CE 4.4Å; L36-M54 HydrophobicContact CB-SD 4.29Å; L36-M54 HydrophobicContact CD1-SD 4.35Å |
| 37 | E | 90.7 | Very high | 92.4 | Very high | 165 Ų | 165 | 80 Ų | 80 | 77% | 0.771 | 43% | 0.432 | S | S | * | . | P | Polyproline II helix | trans | -74.7 | 142.3 | 172.4 | -63.7 | -168.5 | 171.6 | 0 | 0 | 110.4 | W2 R35 | W2-E37 PolarHBondContact NE1-O 2.96Å; R35-E37 PolarHBondContact O-N 3.22Å |
| 38 | A | 89.8 | Confident | 92.3 | Very high | 21 Ų | 21 | 81.2 Ų | 81.2 | 17% | 0.174 | 43% | 0.433 | C | S | . | . | P | Polyproline II helix | trans | -66 | 136.8 | 172.5 | 0 | 0 | 0 | 0 | 0 | 110 | T42 K47 M50 | A38-T42 HydrophobicContact CB-CG2 4.22Å; A38-K47 HydrophobicContact CB-CB 4.06Å; A38-K47 HydrophobicContact CB-CD 3.81Å; A38-K47 HydrophobicContact CB-CG 3.74Å; A38-M50 HydrophobicContact CB-CE 3.62Å |
| 39 | P | 89.1 | Confident | 92.3 | Very high | 31 Ų | 31 | 76.3 Ų | 76.3 | 20% | 0.201 | 41% | 0.407 | C | S | . | . | P | Polyproline II helix | trans | -54.8 | 157.3 | 174.1 | -28.5 | 38.6 | 0 | 0 | 0 | 112.2 | L5 T6 T42 | L5-P39 HydrophobicContact CB-CG 3.79Å; T6-P39 HydrophobicContact CG2-CB 4.3Å; T6-P39 HydrophobicContact CG2-CG 3.33Å; P39-T42 WeakPolarHBondContact CD-OG1 3.42Å; P39-T42 WeakPolarHBondContact O-CB 3.47Å; P39-T42 PolarHBondContact O-N 3.46Å; P39-T42 PolarHBondContact O-OG1 3.35Å |
| 40 | K | 85.3 | Confident | 92.2 | Very high | 195 Ų | 195 | 73 Ų | 73 | 85% | 0.848 | 39% | 0.393 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -54.6 | 144 | 171.4 | -66.1 | 179.4 | -177.2 | 173.9 | 0 | 109.1 | T42 | K40-T42 PolarHBondContact O-N 3.46Š|
| 41 | D | 85.2 | Confident | 92.1 | Very high | 163 Ų | 163 | 74.2 Ų | 74.2 | 87% | 0.872 | 40% | 0.399 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 68.7 | 6.3 | 180 | -45.9 | -48.4 | 0 | 0 | 0 | 116.2 | P43 | D41-P43 WeakPolarHBondContact O-CD 3.36Š|
| 42 | T | 89.6 | Confident | 92.1 | Very high | 20 Ų | 20 | 69.9 Ų | 69.9 | 12% | 0.123 | 38% | 0.381 | C | S | . | . | trans | -62.7 | 123.6 | 171.3 | -57.5 | 0 | 0 | 0 | 0 | 110.2 | L5 A38 P39 K40 L46 K47 | L5-T42 HydrophobicContact CD1-CG2 3.67Å; A38-T42 HydrophobicContact CB-CG2 4.22Å; P39-T42 WeakPolarHBondContact CD-OG1 3.42Å; P39-T42 WeakPolarHBondContact O-CB 3.47Å; P39-T42 PolarHBondContact O-N 3.46Å; P39-T42 PolarHBondContact O-OG1 3.35Å; K40-T42 PolarHBondContact O-N 3.46Å; T42-L46 HydrophobicContact CG2-CB 4.1Å; T42-L46 HydrophobicContact CG2-CD2 4.31Å; T42-L46 HydrophobicContact CG2-CG 4.26Å; T42-K47 HydrophobicContact CG2-CB 4.12Å | ||
| 43 | P | 90.3 | Very high | 92.2 | Very high | 40 Ų | 40 | 68.3 Ų | 68.3 | 26% | 0.26 | 37% | 0.366 | S | S | . | . | trans | -54.5 | 138.8 | 177.2 | -27.6 | 35.4 | 0 | 0 | 0 | 111.8 | D41 E45 L46 K47 M78 | D41-P43 WeakPolarHBondContact O-CD 3.36Å; P43-E45 VanDerWaalsContact C-N 3.25Å; P43-E45 PolarHBondContact O-N 3.05Å; P43-E45 VanDerWaalsContact O-N 3.13Å; P43-L46 HydrophobicContact CB-CB 4.23Å; P43-L46 WeakPolarHBondContact O-CA 3.38Å; P43-L46 WeakPolarHBondContact O-CB 3.45Å; P43-L46 PolarHBondContact O-N 3.28Å; P43-K47 PolarHBondContact O-N 3.29Å; P43-M78 HydrophobicContact CG-CE 4.43Å; P43-M78 HydrophobicContact CG-SD 4.41Å | ||
| 44 | P | 92 | Very high | 92.3 | Very high | 95 Ų | 95 | 67.4 Ų | 67.4 | 62% | 0.617 | 35% | 0.348 | S | S | * | . | H | α-helix | trans | -54.8 | -37.9 | -174.4 | -28.9 | 35 | 0 | 0 | 0 | 114.2 | K47 K48 | P44-K47 PolarHBondContact O-N 3.31Å; P44-K48 WeakPolarHBondContact O-CG 3.46Å; P44-K48 PolarHBondContact O-N 3.38Å |
| 45 | E | 92.4 | Very high | 92.3 | Very high | 99 Ų | 99 | 66.4 Ų | 66.4 | 46% | 0.463 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -70.1 | -35.6 | 177.7 | -63.9 | -52.4 | 134.2 | 0 | 0 | 112.5 | P43 K48 L49 I74 | P43-E45 VanDerWaalsContact C-N 3.25Å; P43-E45 PolarHBondContact O-N 3.05Å; P43-E45 VanDerWaalsContact O-N 3.13Å; E45-K48 PolarHBondContact O-N 2.96Å; E45-K48 IonicContact OE1-NZ 2.72Å; E45-K48 PolarHBondContact OE1-NZ 3Å; E45-K48 IonicContact OE2-NZ 3.64Å; E45-L49 PolarHBondContact O-N 2.77Å; E45-I74 HydrophobicContact CB-CD1 3.88Å; E45-I74 HydrophobicContact CB-CG1 3.76Å |
| 46 | L | 92.9 | Very high | 92.2 | Very high | 23 Ų | 23 | 67.5 Ų | 67.5 | 12% | 0.12 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -69.9 | -39.2 | 174.5 | -169.9 | 61 | 0 | 0 | 0 | 111.1 | M1 L5 T42 P43 K48 L49 M50 L71 I74 | M1-L46 HydrophobicContact CE-CD1 3.77Å; M1-L46 HydrophobicContact CG-CD1 4.32Å; M1-L46 HydrophobicContact SD-CD1 3.44Å; M1-L46 WeakPolarHBondContact SD-CD1 3.47Å; M1-L46 HydrophobicContact SD-CG 4.05Å; L5-L46 HydrophobicContact CD1-CD2 3.97Å; L5-L46 HydrophobicContact CD1-CG 4.33Å; L5-L46 HydrophobicContact CD2-CD2 3.72Å; L5-L46 HydrophobicContact CG-CD2 4.34Å; T42-L46 HydrophobicContact CG2-CB 4.1Å; T42-L46 HydrophobicContact CG2-CD2 4.31Å; T42-L46 HydrophobicContact CG2-CG 4.26Å; P43-L46 HydrophobicContact CB-CB 4.23Å; P43-L46 WeakPolarHBondContact O-CA 3.38Å; P43-L46 WeakPolarHBondContact O-CB 3.45Å; P43-L46 PolarHBondContact O-N 3.28Å; L46-K48 PolarHBondContact O-N 3.37Å; L46-L49 HydrophobicContact CD1-CD2 4.43Å; L46-L49 PolarHBondContact O-N 3.48Å; L46-M50 WeakPolarHBondContact O-CB 3.43Å; L46-M50 PolarHBondContact O-N 3.34Å; L46-L71 HydrophobicContact CD1-CD2 3.55Å; L46-I74 HydrophobicContact CD1-CD1 4.49Å |
| 47 | K | 93.1 | Very high | 92.2 | Very high | 100 Ų | 100 | 68.9 Ų | 68.9 | 44% | 0.435 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -58.1 | -46.6 | 171.6 | 173.3 | 172.4 | -176.8 | 175 | 0 | 111.3 | A38 T42 P43 P44 L49 M50 L51 | A38-K47 HydrophobicContact CB-CB 4.06Å; A38-K47 HydrophobicContact CB-CD 3.81Å; A38-K47 HydrophobicContact CB-CG 3.74Å; T42-K47 HydrophobicContact CG2-CB 4.12Å; P43-K47 PolarHBondContact O-N 3.29Å; P44-K47 PolarHBondContact O-N 3.31Å; K47-L49 PolarHBondContact O-N 2.74Å; K47-M50 PolarHBondContact O-N 3.34Å; K47-L51 HydrophobicContact CG-CD1 4.15Å; K47-L51 WeakPolarHBondContact O-CG 3.46Å; K47-L51 PolarHBondContact O-N 3.13Å |
| 48 | K | 93.6 | Very high | 92.4 | Very high | 121 Ų | 121 | 70.6 Ų | 70.6 | 53% | 0.526 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -59.7 | -45.8 | 176.4 | -72.8 | 171.7 | -172.6 | 168.6 | 0 | 111.7 | P44 E45 L46 L51 A52 | P44-K48 WeakPolarHBondContact O-CG 3.46Å; P44-K48 PolarHBondContact O-N 3.38Å; E45-K48 PolarHBondContact O-N 2.96Å; E45-K48 IonicContact OE1-NZ 2.72Å; E45-K48 PolarHBondContact OE1-NZ 3Å; E45-K48 IonicContact OE2-NZ 3.64Å; L46-K48 PolarHBondContact O-N 3.37Å; K48-L51 PolarHBondContact O-N 3.31Å; K48-A52 WeakPolarHBondContact O-CB 3.47Å; K48-A52 PolarHBondContact O-N 3.4Å |
| 49 | L | 95.6 | Very high | 92.7 | Very high | 7 Ų | 7 | 73.6 Ų | 73.6 | 4% | 0.037 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -61.9 | -44.6 | 177 | 178.3 | 55.3 | 0 | 0 | 0 | 111.6 | M1 E45 L46 K47 L51 A52 C53 P62 I67 K70 L71 I74 | M1-L49 HydrophobicContact CE-CD2 3.74Å; M1-L49 HydrophobicContact CE-CG 3.88Å; M1-L49 HydrophobicContact SD-CG 4.25Å; E45-L49 PolarHBondContact O-N 2.77Å; L46-L49 HydrophobicContact CD1-CD2 4.43Å; L46-L49 PolarHBondContact O-N 3.48Å; K47-L49 PolarHBondContact O-N 2.74Å; L49-L51 PolarHBondContact O-N 3.13Å; L49-A52 PolarHBondContact O-N 3.11Å; L49-C53 PolarHBondContact O-N 3.44Å; L49-C53 PolarHBondContact O-SG 3.37Å; L49-P62 HydrophobicContact CD1-CG 4.36Å; L49-I67 HydrophobicContact CD1-CG1 4.25Å; L49-I67 HydrophobicContact CD2-CG2 4.35Å; L49-K70 HydrophobicContact CD1-CB 4.44Å; L49-K70 HydrophobicContact CD1-CD 3.82Å; L49-K70 HydrophobicContact CD2-CB 4Å; L49-L71 HydrophobicContact CD2-CD2 3.81Å; L49-L71 HydrophobicContact CD2-CG 3.82Å; L49-I74 HydrophobicContact CD2-CD1 4.34Å |
| 50 | M | 94.9 | Very high | 93.1 | Very high | 3 Ų | 3 | 77 Ų | 77 | 2% | 0.015 | 42% | 0.415 | C | S | . | . | H | α-helix | trans | -59.2 | -46.5 | 177.7 | -166.5 | -174.3 | 70 | 0 | 0 | 111.6 | M1 W2 L5 A38 L46 K47 C53 M54 | M1-M50 HydrophobicContact CB-CG 4.17Å; M1-M50 HydrophobicContact CG-CB 4.22Å; M1-M50 HydrophobicContact CG-CG 4.04Å; M1-M50 HydrophobicContact SD-CB 3.65Å; M1-M50 HydrophobicContact SD-CG 4.11Å; W2-M50 HydrophobicContact CB-SD 3.69Å; W2-M50 HydrophobicContact CG-SD 4.17Å; L5-M50 HydrophobicContact CD1-SD 4.19Å; A38-M50 HydrophobicContact CB-CE 3.62Å; L46-M50 WeakPolarHBondContact O-CB 3.43Å; L46-M50 PolarHBondContact O-N 3.34Å; K47-M50 PolarHBondContact O-N 3.34Å; M50-C53 WeakPolarHBondContact O-CB 3.45Å; M50-C53 PolarHBondContact O-N 2.97Å; M50-M54 HydrophobicContact CE-CE 4.05Å; M50-M54 HydrophobicContact CG-CE 4.14Å; M50-M54 PolarHBondContact O-N 2.92Å |
| 51 | L | 93.3 | Very high | 93.7 | Very high | 69 Ų | 69 | 72.3 Ų | 72.3 | 36% | 0.361 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -65.9 | -39.8 | 177.6 | -68.1 | 175.6 | 0 | 0 | 0 | 112.2 | K47 K48 L49 C53 M54 D55 | K47-L51 HydrophobicContact CG-CD1 4.15Å; K47-L51 WeakPolarHBondContact O-CG 3.46Å; K47-L51 PolarHBondContact O-N 3.13Å; K48-L51 PolarHBondContact O-N 3.31Å; L49-L51 PolarHBondContact O-N 3.13Å; L51-C53 VanDerWaalsContact C-N 3.29Å; L51-C53 PolarHBondContact O-N 2.82Å; L51-M54 HydrophobicContact CD2-CE 3.82Å; L51-M54 CarbonylContact O-C 3.48Å; L51-M54 WeakPolarHBondContact O-CA 3.47Å; L51-M54 PolarHBondContact O-N 3.07Å; L51-D55 PolarHBondContact O-N 2.78Å |
| 52 | A | 95.3 | Very high | 94.2 | Very high | 40 Ų | 40 | 66 Ų | 66 | 33% | 0.331 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -61.6 | -36.1 | 176 | 0 | 0 | 0 | 0 | 0 | 112.6 | K48 L49 M54 D55 P62 | K48-A52 WeakPolarHBondContact O-CB 3.47Å; K48-A52 PolarHBondContact O-N 3.4Å; L49-A52 PolarHBondContact O-N 3.11Å; A52-M54 PolarHBondContact O-N 3.41Å; A52-D55 PolarHBondContact O-N 2.89Å; A52-P62 WeakPolarHBondContact O-CD 3.49Å |
| 53 | C | 95.9 | Very high | 94.6 | Very high | 40 Ų | 40 | 71.4 Ų | 71.4 | 27% | 0.27 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -64.3 | -22.6 | 173 | -69.1 | 0 | 0 | 0 | 0 | 113.2 | L49 M50 L51 R61 | L49-C53 PolarHBondContact O-N 3.44Å; L49-C53 PolarHBondContact O-SG 3.37Å; M50-C53 WeakPolarHBondContact O-CB 3.45Å; M50-C53 PolarHBondContact O-N 2.97Å; L51-C53 VanDerWaalsContact C-N 3.29Å; L51-C53 PolarHBondContact O-N 2.82Å; C53-R61 WeakPolarHBondContact O-CD 3.35Å |
| 54 | M | 94.8 | Very high | 94.9 | Very high | 34 Ų | 34 | 78.3 Ų | 78.3 | 17% | 0.167 | 41% | 0.407 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -102.7 | 16.1 | -178.5 | -60.7 | -174.3 | -65.1 | 0 | 0 | 113 | R35 L36 M50 L51 A52 | R35-M54 HydrophobicContact CB-CE 4.23Å; R35-M54 HydrophobicContact CG-CB 4.41Å; R35-M54 PolarHBondContact NE-O 2.78Å; L36-M54 HydrophobicContact CB-CE 4.4Å; L36-M54 HydrophobicContact CB-SD 4.29Å; L36-M54 HydrophobicContact CD1-SD 4.35Å; M50-M54 HydrophobicContact CE-CE 4.05Å; M50-M54 HydrophobicContact CG-CE 4.14Å; M50-M54 PolarHBondContact O-N 2.92Å; L51-M54 HydrophobicContact CD2-CE 3.82Å; L51-M54 CarbonylContact O-C 3.48Å; L51-M54 WeakPolarHBondContact O-CA 3.47Å; L51-M54 PolarHBondContact O-N 3.07Å; A52-M54 PolarHBondContact O-N 3.41Å |
| 55 | D | 95.3 | Very high | 95.2 | Very high | 55 Ų | 55 | 77.3 Ų | 77.3 | 29% | 0.294 | 41% | 0.407 | S | S | . | . | trans | -55.1 | 141.9 | 178.4 | -164.2 | -71.9 | 0 | 0 | 0 | 111.6 | L51 A52 S57 N60 R61 | L51-D55 PolarHBondContact O-N 2.78Å; A52-D55 PolarHBondContact O-N 2.89Å; D55-S57 VanDerWaalsContact C-N 3.29Å; D55-S57 PolarHBondContact O-N 3.43Å; D55-S57 WeakPolarHBondContact OD1-CA 3.47Å; D55-S57 WeakPolarHBondContact OD1-CB 3.34Å; D55-S57 PolarHBondContact OD1-N 3.31Å; D55-N60 HydrophobicContact CB-CB 4.12Å; D55-N60 PolarHBondContact OD1-ND2 3Å; D55-R61 HydrophobicContact CB-CG 4.03Å; D55-R61 VanDerWaalsContact O-CZ 3.29Å; D55-R61 PolarHBondContact O-NE 3.42Å; D55-R61 PolarHBondContact O-NH2 3.1Å | ||
| 56 | A | 93.5 | Very high | 95.4 | Very high | 74 Ų | 74 | 76.2 Ų | 76.2 | 61% | 0.612 | 41% | 0.405 | S | S | * | . | S | Bend | trans | -58.9 | -42.9 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.3 | R58 | A56-R58 PolarHBondContact O-N 3.15Š|
| 57 | S | 94.5 | Very high | 95.6 | Very high | 51 Ų | 51 | 76.4 Ų | 76.4 | 36% | 0.357 | 41% | 0.405 | S | S | . | . | S | Bend | trans | -80.6 | 115.6 | 174.4 | 178 | 0 | 0 | 0 | 0 | 110.4 | D55 A59 N60 | D55-S57 VanDerWaalsContact C-N 3.29Å; D55-S57 PolarHBondContact O-N 3.43Å; D55-S57 WeakPolarHBondContact OD1-CA 3.47Å; D55-S57 WeakPolarHBondContact OD1-CB 3.34Å; D55-S57 PolarHBondContact OD1-N 3.31Å; S57-A59 PolarHBondContact O-N 3.24Å; S57-A59 VanDerWaalsContact O-N 3.1Å; S57-A59 PolarHBondContact OG-N 3.23Å; S57-N60 WeakPolarHBondContact CB-ND2 3.41Å; S57-N60 PolarHBondContact O-N 2.98Å |
| 58 | R | 94.1 | Very high | 95.7 | Very high | 202 Ų | 202 | 76.3 Ų | 76.3 | 76% | 0.762 | 41% | 0.409 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -55.7 | -28.8 | 173.6 | -67.1 | -169.4 | -68.4 | 174.1 | -2.8 | 113.1 | A56 N60 R61 | A56-R58 PolarHBondContact O-N 3.15Å; R58-N60 VanDerWaalsContact C-N 3.31Å; R58-R61 PolarHBondContact O-N 3.48Å |
| 59 | A | 96.5 | Very high | 95.8 | Very high | 83 Ų | 83 | 76.6 Ų | 76.6 | 69% | 0.686 | 41% | 0.41 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -71.1 | -27.1 | 179.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | S57 | S57-A59 PolarHBondContact O-N 3.24Å; S57-A59 VanDerWaalsContact O-N 3.1Å; S57-A59 PolarHBondContact OG-N 3.23Å |
| 60 | N | 96.5 | Very high | 95.8 | Very high | 103 Ų | 103 | 81 Ų | 81 | 55% | 0.551 | 43% | 0.43 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -83.8 | -15.7 | 179.3 | -66.3 | -11.6 | 0 | 0 | 0 | 112.9 | D55 S57 R58 | D55-N60 HydrophobicContact CB-CB 4.12Å; D55-N60 PolarHBondContact OD1-ND2 3Å; S57-N60 WeakPolarHBondContact CB-ND2 3.41Å; S57-N60 PolarHBondContact O-N 2.98Å; R58-N60 VanDerWaalsContact C-N 3.31Å |
| 61 | R | 97.8 | Very high | 95.8 | Very high | 96 Ų | 96 | 84 Ų | 84 | 36% | 0.362 | 45% | 0.445 | S | S | . | . | S | Bend | trans | -67 | 131.9 | 179 | -62.1 | 178.6 | -167.3 | 172.5 | 3.4 | 109.8 | C53 D55 R58 | C53-R61 WeakPolarHBondContact O-CD 3.35Å; D55-R61 HydrophobicContact CB-CG 4.03Å; D55-R61 VanDerWaalsContact O-CZ 3.29Å; D55-R61 PolarHBondContact O-NE 3.42Å; D55-R61 PolarHBondContact O-NH2 3.1Å; R58-R61 PolarHBondContact O-N 3.48Å |
| 62 | P | 97.3 | Very high | 95.8 | Very high | 31 Ų | 31 | 85 Ų | 85 | 20% | 0.201 | 45% | 0.448 | C | S | . | . | P | Polyproline II helix | trans | -62.7 | 150.9 | -178.7 | 27.2 | -35.1 | 0 | 0 | 0 | 111.1 | L49 A52 D66 I67 | L49-P62 HydrophobicContact CD1-CG 4.36Å; A52-P62 WeakPolarHBondContact O-CD 3.49Å; P62-D66 HydrophobicContact CB-CB 4.17Å; P62-I67 HydrophobicContact CB-CG1 3.97Å; P62-I67 HydrophobicContact CG-CD1 4.14Å; P62-I67 HydrophobicContact CG-CG1 3.75Å |
| 63 | K | 97.6 | Very high | 95.7 | Very high | 133 Ų | 133 | 88 Ų | 88 | 58% | 0.578 | 46% | 0.455 | S | S | * | . | P | Polyproline II helix | trans | -77.3 | 158.9 | 172.4 | -54.2 | -54.8 | 179.6 | -169 | 0 | 109.5 | A65 D66 I67 | K63-A65 PolarHBondContact O-N 2.7Å; K63-D66 WeakPolarHBondContact CB-OD2 3.4Å; K63-D66 PolarHBondContact N-OD2 3.19Å; K63-D66 VanDerWaalsContact N-OD2 3.14Å; K63-D66 WeakPolarHBondContact O-CA 3.44Å; K63-D66 WeakPolarHBondContact O-CB 3.42Å; K63-D66 PolarHBondContact O-N 2.79Å; K63-I67 WeakPolarHBondContact O-CG1 3.43Å; K63-I67 PolarHBondContact O-N 3.25Å |
| 64 | F | 96.5 | Very high | 95.5 | Very high | 185 Ų | 185 | 87.5 Ų | 87.5 | 81% | 0.811 | 45% | 0.449 | S | S | * | . | H | α-helix | trans | -55.7 | -36.6 | 178.8 | -75.2 | -72.6 | 0 | 0 | 0 | 113.4 | D66 I67 L68 | F64-D66 VanDerWaalsContact C-N 3.34Å; F64-D66 PolarHBondContact O-N 3.1Å; F64-I67 HydrophobicContact CD1-CD1 4.25Å; F64-I67 PolarHBondContact O-N 3.46Å; F64-L68 WeakPolarHBondContact O-CB 3.48Å; F64-L68 PolarHBondContact O-N 2.99Å |
| 65 | A | 97.5 | Very high | 95.2 | Very high | 74 Ų | 74 | 90.8 Ų | 90.8 | 61% | 0.612 | 46% | 0.461 | S | S | * | . | H | α-helix | trans | -60.8 | -42 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | K63 K69 | K63-A65 PolarHBondContact O-N 2.7Å; A65-K69 WeakPolarHBondContact O-CB 3.24Å; A65-K69 PolarHBondContact O-N 3.49Å |
| 66 | D | 96.6 | Very high | 94.9 | Very high | 77 Ų | 77 | 95.3 Ų | 95.3 | 41% | 0.412 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -69.2 | -38.5 | 177.2 | -52.9 | -50.9 | 0 | 0 | 0 | 111.5 | P62 K63 F64 K70 | P62-D66 HydrophobicContact CB-CB 4.17Å; K63-D66 WeakPolarHBondContact CB-OD2 3.4Å; K63-D66 PolarHBondContact N-OD2 3.19Å; K63-D66 VanDerWaalsContact N-OD2 3.14Å; K63-D66 WeakPolarHBondContact O-CA 3.44Å; K63-D66 WeakPolarHBondContact O-CB 3.42Å; K63-D66 PolarHBondContact O-N 2.79Å; F64-D66 VanDerWaalsContact C-N 3.34Å; F64-D66 PolarHBondContact O-N 3.1Å; D66-K70 WeakPolarHBondContact O-CB 3.15Å; D66-K70 VanDerWaalsContact O-CG 3.31Å; D66-K70 WeakPolarHBondContact O-CG 3.12Å; D66-K70 PolarHBondContact O-N 2.97Å |
| 67 | I | 97.1 | Very high | 94.6 | Very high | 26 Ų | 26 | 95 Ų | 95 | 13% | 0.133 | 48% | 0.482 | C | S | . | . | H | α-helix | trans | -61.4 | -49.8 | 176.4 | -64.4 | 168.4 | 0 | 0 | 0 | 109.8 | L49 P62 K63 F64 K70 L71 | L49-I67 HydrophobicContact CD1-CG1 4.25Å; L49-I67 HydrophobicContact CD2-CG2 4.35Å; P62-I67 HydrophobicContact CB-CG1 3.97Å; P62-I67 HydrophobicContact CG-CD1 4.14Å; P62-I67 HydrophobicContact CG-CG1 3.75Å; K63-I67 WeakPolarHBondContact O-CG1 3.43Å; K63-I67 PolarHBondContact O-N 3.25Å; F64-I67 HydrophobicContact CD1-CD1 4.25Å; F64-I67 PolarHBondContact O-N 3.46Å; I67-K70 PolarHBondContact O-N 3.35Å; I67-L71 HydrophobicContact CG2-CD1 3.9Å; I67-L71 HydrophobicContact CG2-CG 4.41Å; I67-L71 WeakPolarHBondContact O-CB 3.39Å; I67-L71 VanDerWaalsContact O-CG 3.31Å; I67-L71 WeakPolarHBondContact O-CG 3.43Å; I67-L71 PolarHBondContact O-N 3.42Å |
| 68 | L | 96.1 | Very high | 94 | Very high | 98 Ų | 98 | 98.5 Ų | 98.5 | 51% | 0.513 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -59.9 | -49.2 | 179.2 | 178.3 | 61.2 | 0 | 0 | 0 | 111 | F64 K70 L71 E72 | F64-L68 WeakPolarHBondContact O-CB 3.48Å; F64-L68 PolarHBondContact O-N 2.99Å; L68-K70 VanDerWaalsContact C-N 3.33Å; L68-K70 PolarHBondContact O-N 3.42Å; L68-L71 PolarHBondContact O-N 2.97Å; L68-L71 VanDerWaalsContact O-N 3.12Å; L68-E72 HydrophobicContact CD1-CG 4.44Å; L68-E72 WeakPolarHBondContact O-CG 3.49Å; L68-E72 PolarHBondContact O-N 3.48Å |
| 69 | K | 96.1 | Very high | 93 | Very high | 127 Ų | 127 | 91.8 Ų | 91.8 | 55% | 0.552 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -56.3 | -47.1 | 177.7 | -177.4 | -178.4 | 175.6 | -176.4 | 0 | 111.8 | A65 L71 E72 E73 | A65-K69 WeakPolarHBondContact O-CB 3.24Å; A65-K69 PolarHBondContact O-N 3.49Å; K69-L71 VanDerWaalsContact C-N 3.35Å; K69-L71 PolarHBondContact O-N 3.13Å; K69-E72 PolarHBondContact O-N 2.99Å; K69-E73 WeakPolarHBondContact CE-OE1 3.28Å; K69-E73 WeakPolarHBondContact O-CG 3.42Å; K69-E73 PolarHBondContact O-N 3.27Å |
| 70 | K | 95.4 | Very high | 91.4 | Very high | 101 Ų | 101 | 90.7 Ų | 90.7 | 44% | 0.439 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -63.1 | -39.9 | 177.1 | -76.4 | 175.7 | 174.5 | -71.8 | 0 | 112.2 | L49 D66 I67 L68 E73 I74 | L49-K70 HydrophobicContact CD1-CB 4.44Å; L49-K70 HydrophobicContact CD1-CD 3.82Å; L49-K70 HydrophobicContact CD2-CB 4Å; D66-K70 WeakPolarHBondContact O-CB 3.15Å; D66-K70 VanDerWaalsContact O-CG 3.31Å; D66-K70 WeakPolarHBondContact O-CG 3.12Å; D66-K70 PolarHBondContact O-N 2.97Å; I67-K70 PolarHBondContact O-N 3.35Å; L68-K70 VanDerWaalsContact C-N 3.33Å; L68-K70 PolarHBondContact O-N 3.42Å; K70-E73 PolarHBondContact O-N 2.89Å; K70-I74 WeakPolarHBondContact O-CD1 3.41Å; K70-I74 WeakPolarHBondContact O-CG1 3.49Å; K70-I74 PolarHBondContact O-N 3.02Å |
| 71 | L | 93.9 | Very high | 89.6 | Confident | 64 Ų | 64 | 91.6 Ų | 91.6 | 34% | 0.335 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -64 | -41.6 | 176.5 | -74.6 | 171.7 | 0 | 0 | 0 | 111.8 | M1 L46 L49 I67 L68 K69 I74 Y75 | M1-L71 HydrophobicContact CE-CD1 4.32Å; M1-L71 HydrophobicContact CE-CD2 3.93Å; M1-L71 HydrophobicContact CE-CG 4.45Å; L46-L71 HydrophobicContact CD1-CD2 3.55Å; L49-L71 HydrophobicContact CD2-CD2 3.81Å; L49-L71 HydrophobicContact CD2-CG 3.82Å; I67-L71 HydrophobicContact CG2-CD1 3.9Å; I67-L71 HydrophobicContact CG2-CG 4.41Å; I67-L71 WeakPolarHBondContact O-CB 3.39Å; I67-L71 VanDerWaalsContact O-CG 3.31Å; I67-L71 WeakPolarHBondContact O-CG 3.43Å; I67-L71 PolarHBondContact O-N 3.42Å; L68-L71 PolarHBondContact O-N 2.97Å; L68-L71 VanDerWaalsContact O-N 3.12Å; K69-L71 VanDerWaalsContact C-N 3.35Å; K69-L71 PolarHBondContact O-N 3.13Å; L71-I74 PolarHBondContact O-N 3.17Å; L71-Y75 VanDerWaalsContact O-CB 3.29Å; L71-Y75 WeakPolarHBondContact O-CB 3.27Å; L71-Y75 PolarHBondContact O-N 3.4Å |
| 72 | E | 93.6 | Very high | 87.8 | Confident | 91 Ų | 91 | 95.5 Ų | 95.5 | 43% | 0.425 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -62.5 | -41.5 | 174.5 | -70.8 | 176.4 | -173.8 | 0 | 0 | 112.2 | L68 K69 Y75 K76 | L68-E72 HydrophobicContact CD1-CG 4.44Å; L68-E72 WeakPolarHBondContact O-CG 3.49Å; L68-E72 PolarHBondContact O-N 3.48Å; K69-E72 PolarHBondContact O-N 2.99Å; E72-Y75 PolarHBondContact O-N 3.48Å; E72-K76 WeakPolarHBondContact O-CB 3.08Å; E72-K76 VanDerWaalsContact O-CG 3.28Å; E72-K76 WeakPolarHBondContact O-CG 3.19Å; E72-K76 PolarHBondContact O-N 2.91Å |
| 73 | E | 93 | Very high | 87.3 | Confident | 104 Ų | 104 | 98.7 Ų | 98.7 | 49% | 0.486 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -62.1 | -45.9 | 175.2 | -72.6 | 168.9 | -178.9 | 0 | 0 | 111.4 | K69 K70 K76 G77 | K69-E73 WeakPolarHBondContact CE-OE1 3.28Å; K69-E73 WeakPolarHBondContact O-CG 3.42Å; K69-E73 PolarHBondContact O-N 3.27Å; K70-E73 PolarHBondContact O-N 2.89Å; E73-K76 PolarHBondContact O-N 3.26Å; E73-G77 PolarHBondContact O-N 3.43Å |
| 74 | I | 91.3 | Very high | 86.8 | Confident | 28 Ų | 28 | 96.9 Ų | 96.9 | 14% | 0.144 | 54% | 0.535 | C | S | . | . | H | α-helix | trans | -61.2 | -48 | 176.4 | -68.2 | 164.5 | 0 | 0 | 0 | 110.3 | E45 L46 L49 K70 L71 K76 G77 M78 | E45-I74 HydrophobicContact CB-CD1 3.88Å; E45-I74 HydrophobicContact CB-CG1 3.76Å; L46-I74 HydrophobicContact CD1-CD1 4.49Å; L49-I74 HydrophobicContact CD2-CD1 4.34Å; K70-I74 WeakPolarHBondContact O-CD1 3.41Å; K70-I74 WeakPolarHBondContact O-CG1 3.49Å; K70-I74 PolarHBondContact O-N 3.02Å; L71-I74 PolarHBondContact O-N 3.17Å; I74-K76 PolarHBondContact O-N 2.93Å; I74-G77 PolarHBondContact O-N 2.83Å; I74-G77 VanDerWaalsContact O-N 3.16Å; I74-M78 HydrophobicContact CG2-SD 4.01Å; I74-M78 WeakPolarHBondContact O-CG 3.35Å; I74-M78 PolarHBondContact O-N 2.5Å |
| 75 | Y | 89.2 | Confident | 86.2 | Confident | 104 Ų | 104 | 92 Ų | 92 | 41% | 0.408 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -60.3 | -45.5 | -179.1 | 178 | -105.3 | 0 | 0 | 0 | 112.2 | L71 E72 G77 M78 C80 P82 | L71-Y75 VanDerWaalsContact O-CB 3.29Å; L71-Y75 WeakPolarHBondContact O-CB 3.27Å; L71-Y75 PolarHBondContact O-N 3.4Å; E72-Y75 PolarHBondContact O-N 3.48Å; Y75-G77 VanDerWaalsContact C-N 3.34Å; Y75-G77 PolarHBondContact O-N 3.28Å; Y75-M78 PolarHBondContact O-N 3.47Å; Y75-C80 HydrophobicContact CD2-CB 4.12Å; Y75-C80 HydrophobicContact CE1-CB 4.32Å; Y75-C80 WeakPolarHBondContact CE1-O 3.4Å; Y75-C80 HydrophobicContact CE2-CB 3.53Å; Y75-C80 PolarHBondContact OH-SG 3.07Å; Y75-P82 HydrophobicContact CE1-CG 4.33Å |
| 76 | K | 89.5 | Confident | 85.6 | Confident | 149 Ų | 149 | 93.1 Ų | 93.1 | 65% | 0.648 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -63.6 | -39.6 | 174.6 | -71.7 | 171 | -174.7 | 170.4 | 0 | 112 | E72 E73 I74 M78 G79 | E72-K76 WeakPolarHBondContact O-CB 3.08Å; E72-K76 VanDerWaalsContact O-CG 3.28Å; E72-K76 WeakPolarHBondContact O-CG 3.19Å; E72-K76 PolarHBondContact O-N 2.91Å; E73-K76 PolarHBondContact O-N 3.26Å; I74-K76 PolarHBondContact O-N 2.93Å; K76-M78 PolarHBondContact O-N 3.2Å; K76-G79 PolarHBondContact O-N 3.11Å |
| 77 | G | 86.3 | Confident | 84.9 | Confident | 69 Ų | 69 | 94.1 Ų | 94.1 | 71% | 0.711 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -64.8 | -25.9 | 177.3 | 0 | 0 | 0 | 0 | 0 | 113.9 | E73 I74 Y75 G79 | E73-G77 PolarHBondContact O-N 3.43Å; I74-G77 PolarHBondContact O-N 2.83Å; I74-G77 VanDerWaalsContact O-N 3.16Å; Y75-G77 VanDerWaalsContact C-N 3.34Å; Y75-G77 PolarHBondContact O-N 3.28Å; G77-G79 PolarHBondContact O-N 2.9Å |
| 78 | M | 81.3 | Confident | 84.1 | Confident | 124 Ų | 124 | 98.6 Ų | 98.6 | 61% | 0.611 | 55% | 0.547 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77.3 | 3.1 | 175.7 | -69 | 172.7 | 68.1 | 0 | 0 | 113.5 | P43 I74 Y75 K76 C80 | P43-M78 HydrophobicContact CG-CE 4.43Å; P43-M78 HydrophobicContact CG-SD 4.41Å; I74-M78 HydrophobicContact CG2-SD 4.01Å; I74-M78 WeakPolarHBondContact O-CG 3.35Å; I74-M78 PolarHBondContact O-N 2.5Å; Y75-M78 PolarHBondContact O-N 3.47Å; K76-M78 PolarHBondContact O-N 3.2Å; M78-C80 PolarHBondContact O-N 3.39Å |
| 79 | G | 74.1 | Confident | 83.2 | Confident | 61 Ų | 61 | 98.6 Ų | 98.6 | 63% | 0.629 | 55% | 0.549 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 74 | 10.3 | 178.5 | 0 | 0 | 0 | 0 | 0 | 114 | K76 G77 T81 | K76-G79 PolarHBondContact O-N 3.11Å; G77-G79 PolarHBondContact O-N 2.9Å; G79-T81 PolarHBondContact O-N 3Å |
| 80 | C | 63.6 | Low | 82.2 | Confident | 60 Ų | 60 | 96.5 Ų | 96.5 | 41% | 0.405 | 55% | 0.549 | S | S | . | . | trans | -85.2 | 86.3 | 173.4 | -151.2 | 0 | 0 | 0 | 0 | 107.8 | Y75 M78 | Y75-C80 HydrophobicContact CD2-CB 4.12Å; Y75-C80 HydrophobicContact CE1-CB 4.32Å; Y75-C80 WeakPolarHBondContact CE1-O 3.4Å; Y75-C80 HydrophobicContact CE2-CB 3.53Å; Y75-C80 PolarHBondContact OH-SG 3.07Å; M78-C80 PolarHBondContact O-N 3.39Å | ||
| 81 | T | 57.7 | Low | 81.1 | Confident | 122 Ų | 122 | 96.1 Ų | 96.1 | 75% | 0.748 | 56% | 0.558 | S | S | * | * | trans | -75.3 | 132.2 | 160.1 | 50.5 | 0 | 0 | 0 | 0 | 107.5 | G79 | G79-T81 PolarHBondContact O-N 3Š| ||
| 82 | P | 59.8 | Low | 79.9 | Confident | 177 Ų | 177 | 99 Ų | 99 | 100% | 1.149 | 58% | 0.579 | S | S | * | * | trans | -52.3 | 0 | 172.7 | -23.5 | 32.5 | 0 | 0 | 0 | 113.1 | Y75 | Y75-P82 HydrophobicContact CE1-CG 4.33Š|
Retrieved 82 of 82 residues in 41.8 ms
(Link to these results)