| 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 | 63.4 | Low | 87.7 | Confident | 225 Ų | 225 | 103.7 Ų | 103.7 | 100% | 1.108 | 56% | 0.56 | S | S | * | * | 0 | 139.3 | 0 | -75.7 | 175.1 | 170.1 | 0 | 0 | 107.3 | |||||
| 2 | D | 85.9 | Confident | 88.2 | Confident | 78 Ų | 78 | 105.8 Ų | 105.8 | 42% | 0.417 | 56% | 0.563 | S | S | . | * | trans | -64.9 | 125.4 | 173.5 | -175.1 | -13.8 | 0 | 0 | 0 | 108.8 | E4 K5 A6 | D2-E4 PolarHBondContact O-N 3.25Å; D2-E4 PolarHBondContact OD1-N 3.28Å; D2-K5 HydrophobicContact CB-CB 4.35Å; D2-K5 HydrophobicContact CB-CD 4.18Å; D2-K5 HydrophobicContact CB-CG 4.15Å; D2-K5 PolarHBondContact O-N 2.91Å; D2-K5 VanDerWaalsContact O-N 3.09Å; D2-A6 PolarHBondContact O-N 3.44Å | ||
| 3 | P | 84.8 | Confident | 88.7 | Confident | 98 Ų | 98 | 104.1 Ų | 104.1 | 64% | 0.636 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -55.6 | -30.6 | -178.4 | 19.5 | -32.1 | 0 | 0 | 0 | 113.6 | A6 Q7 | P3-A6 PolarHBondContact O-N 2.95Å; P3-Q7 PolarHBondContact O-N 3.31Å; P3-Q7 VanDerWaalsContact O-N 3.15Å |
| 4 | E | 88.6 | Confident | 89.1 | Confident | 119 Ų | 119 | 105.4 Ų | 105.4 | 56% | 0.556 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -66.8 | -41.1 | 177.5 | -167.5 | -179.6 | 155.3 | 0 | 0 | 111.7 | D2 A6 Q7 Q8 | D2-E4 PolarHBondContact O-N 3.25Å; D2-E4 PolarHBondContact OD1-N 3.28Å; E4-A6 VanDerWaalsContact C-N 3.32Å; E4-A6 PolarHBondContact O-N 2.93Å; E4-Q7 PolarHBondContact O-N 3.46Å; E4-Q8 WeakPolarHBondContact O-CG 3.27Å; E4-Q8 PolarHBondContact O-N 3.23Å |
| 5 | K | 90.1 | Very high | 89.5 | Confident | 138 Ų | 138 | 105.2 Ų | 105.2 | 60% | 0.6 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -68 | -32.9 | 176.4 | -67.6 | -177.4 | -179.1 | 178.8 | 0 | 112.4 | D2 L9 | D2-K5 HydrophobicContact CB-CB 4.35Å; D2-K5 HydrophobicContact CB-CD 4.18Å; D2-K5 HydrophobicContact CB-CG 4.15Å; D2-K5 PolarHBondContact O-N 2.91Å; D2-K5 VanDerWaalsContact O-N 3.09Å; K5-L9 WeakPolarHBondContact O-CB 3.27Å; K5-L9 PolarHBondContact O-N 3.45Å |
| 6 | A | 90.1 | Very high | 89.9 | Confident | 49 Ų | 49 | 107.1 Ų | 107.1 | 41% | 0.405 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -67.3 | -39.6 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | D2 P3 E4 A10 | D2-A6 PolarHBondContact O-N 3.44Å; P3-A6 PolarHBondContact O-N 2.95Å; E4-A6 VanDerWaalsContact C-N 3.32Å; E4-A6 PolarHBondContact O-N 2.93Å; A6-A10 PolarHBondContact O-N 3.44Å |
| 7 | Q | 90.6 | Very high | 90.2 | Very high | 146 Ų | 146 | 108.1 Ų | 108.1 | 68% | 0.682 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -67.5 | -42.5 | 175 | -72.1 | 177.8 | -19.5 | 0 | 0 | 112.2 | P3 E4 L9 A10 A11 | P3-Q7 PolarHBondContact O-N 3.31Å; P3-Q7 VanDerWaalsContact O-N 3.15Å; E4-Q7 PolarHBondContact O-N 3.46Å; Q7-L9 PolarHBondContact O-N 3.32Å; Q7-A10 PolarHBondContact O-N 3.45Å; Q7-A11 PolarHBondContact O-N 3.32Å |
| 8 | Q | 92.3 | Very high | 90.5 | Very high | 98 Ų | 98 | 109.4 Ų | 109.4 | 46% | 0.458 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -59.2 | -47.2 | 175.2 | -73.7 | 170.8 | 2.4 | 0 | 0 | 111.3 | E4 A10 A11 E12 | E4-Q8 WeakPolarHBondContact O-CG 3.27Å; E4-Q8 PolarHBondContact O-N 3.23Å; Q8-A10 VanDerWaalsContact C-N 3.34Å; Q8-A10 PolarHBondContact O-N 3.45Å; Q8-A11 PolarHBondContact O-N 3.19Å; Q8-E12 WeakPolarHBondContact O-CG 3.41Å; Q8-E12 PolarHBondContact O-N 3.49Å |
| 9 | L | 92.8 | Very high | 90.8 | Very high | 92 Ų | 92 | 106.2 Ų | 106.2 | 48% | 0.482 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -61.5 | -41 | 177.4 | -179.5 | 62.3 | 0 | 0 | 0 | 112.2 | K5 Q7 A11 E12 L13 | K5-L9 WeakPolarHBondContact O-CB 3.27Å; K5-L9 PolarHBondContact O-N 3.45Å; Q7-L9 PolarHBondContact O-N 3.32Å; L9-A11 VanDerWaalsContact C-N 3.35Å; L9-A11 PolarHBondContact O-N 3.11Å; L9-E12 PolarHBondContact O-N 3.41Å; L9-L13 HydrophobicContact CD1-CD1 4.38Å; L9-L13 HydrophobicContact CD1-CG 4.39Å; L9-L13 HydrophobicContact CG-CD1 4.14Å; L9-L13 WeakPolarHBondContact O-CB 3.45Å; L9-L13 VanDerWaalsContact O-CG 3.28Å; L9-L13 WeakPolarHBondContact O-CG 3.43Å; L9-L13 PolarHBondContact O-N 2.99Å |
| 10 | A | 92.7 | Very high | 91.1 | Very high | 48 Ų | 48 | 104.6 Ų | 104.6 | 40% | 0.397 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -61.1 | -43.8 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | A6 Q7 Q8 L13 E14 | A6-A10 PolarHBondContact O-N 3.44Å; Q7-A10 PolarHBondContact O-N 3.45Å; Q8-A10 VanDerWaalsContact C-N 3.34Å; Q8-A10 PolarHBondContact O-N 3.45Å; A10-L13 PolarHBondContact O-N 3.2Å; A10-E14 WeakPolarHBondContact O-CG 3.34Å; A10-E14 PolarHBondContact O-N 3.48Å |
| 11 | A | 93.3 | Very high | 91.4 | Very high | 50 Ų | 50 | 101.4 Ų | 101.4 | 41% | 0.413 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -65.2 | -40.3 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | Q7 Q8 L9 L13 E14 V15 | Q7-A11 PolarHBondContact O-N 3.32Å; Q8-A11 PolarHBondContact O-N 3.19Å; L9-A11 VanDerWaalsContact C-N 3.35Å; L9-A11 PolarHBondContact O-N 3.11Å; A11-L13 VanDerWaalsContact C-N 3.34Å; A11-E14 PolarHBondContact O-N 3.44Å; A11-V15 WeakPolarHBondContact O-CG2 3.3Å; A11-V15 PolarHBondContact O-N 2.91Å; A11-V15 VanDerWaalsContact O-N 3.14Å |
| 12 | E | 94 | Very high | 93.1 | Very high | 128 Ų | 128 | 97.4 Ų | 97.4 | 60% | 0.598 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -61.4 | -44 | 175.3 | -73.9 | 174.6 | -177 | 0 | 0 | 111.6 | Q8 L9 V15 E16 | Q8-E12 WeakPolarHBondContact O-CG 3.41Å; Q8-E12 PolarHBondContact O-N 3.49Å; L9-E12 PolarHBondContact O-N 3.41Å; E12-V15 PolarHBondContact O-N 3.35Å; E12-E16 PolarHBondContact O-N 3.04Å |
| 13 | L | 95.2 | Very high | 93.6 | Very high | 84 Ų | 84 | 97.8 Ų | 97.8 | 44% | 0.44 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -63.4 | -41.3 | 176.7 | -72 | 170 | 0 | 0 | 0 | 111.9 | L9 A10 A11 V15 E16 M17 | L9-L13 HydrophobicContact CD1-CD1 4.38Å; L9-L13 HydrophobicContact CD1-CG 4.39Å; L9-L13 HydrophobicContact CG-CD1 4.14Å; L9-L13 WeakPolarHBondContact O-CB 3.45Å; L9-L13 VanDerWaalsContact O-CG 3.28Å; L9-L13 WeakPolarHBondContact O-CG 3.43Å; L9-L13 PolarHBondContact O-N 2.99Å; A10-L13 PolarHBondContact O-N 3.2Å; A11-L13 VanDerWaalsContact C-N 3.34Å; L13-V15 VanDerWaalsContact C-N 3.32Å; L13-V15 PolarHBondContact O-N 2.95Å; L13-E16 PolarHBondContact O-N 3.5Å; L13-M17 WeakPolarHBondContact O-CB 3.38Å; L13-M17 VanDerWaalsContact O-CG 3.26Å; L13-M17 WeakPolarHBondContact O-CG 3.35Å; L13-M17 PolarHBondContact O-N 3.15Å |
| 14 | E | 93.8 | Very high | 94.3 | Very high | 123 Ų | 123 | 100.2 Ų | 100.2 | 58% | 0.575 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -57.5 | -45.2 | 175 | -76.4 | 178.3 | -178.2 | 0 | 0 | 111.8 | A10 A11 M17 M18 | A10-E14 WeakPolarHBondContact O-CG 3.34Å; A10-E14 PolarHBondContact O-N 3.48Å; A11-E14 PolarHBondContact O-N 3.44Å; E14-M17 PolarHBondContact O-N 3.34Å; E14-M18 VanDerWaalsContact O-CG 3.31Å; E14-M18 WeakPolarHBondContact O-CG 3.5Å; E14-M18 PolarHBondContact O-N 3.09Å |
| 15 | V | 95.4 | Very high | 94.8 | Very high | 102 Ų | 102 | 95.4 Ų | 95.4 | 62% | 0.618 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -63.9 | -45 | 177.8 | 173.5 | 0 | 0 | 0 | 0 | 111.4 | A11 E12 L13 M17 M18 A19 | A11-V15 WeakPolarHBondContact O-CG2 3.3Å; A11-V15 PolarHBondContact O-N 2.91Å; A11-V15 VanDerWaalsContact O-N 3.14Å; E12-V15 PolarHBondContact O-N 3.35Å; L13-V15 VanDerWaalsContact C-N 3.32Å; L13-V15 PolarHBondContact O-N 2.95Å; V15-M17 PolarHBondContact O-N 3.36Å; V15-M18 PolarHBondContact O-N 3.18Å; V15-A19 WeakPolarHBondContact O-CB 3.45Å; V15-A19 PolarHBondContact O-N 3.02Å |
| 16 | E | 95.8 | Very high | 95.1 | Very high | 135 Ų | 135 | 91.8 Ų | 91.8 | 63% | 0.631 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -61.6 | -44.7 | 179.3 | -173.3 | 178.6 | -179 | 0 | 0 | 111.7 | E12 L13 M18 A19 D20 | E12-E16 PolarHBondContact O-N 3.04Å; L13-E16 PolarHBondContact O-N 3.5Å; E16-M18 PolarHBondContact O-N 2.84Å; E16-A19 WeakPolarHBondContact O-CB 3.37Å; E16-A19 PolarHBondContact O-N 3.43Å; E16-D20 PolarHBondContact O-N 2.86Å |
| 17 | M | 94.5 | Very high | 95.5 | Very high | 125 Ų | 125 | 94.3 Ų | 94.3 | 62% | 0.616 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -62.9 | -42.9 | 177 | -69.5 | -169.8 | -45.3 | 0 | 0 | 112 | L13 E14 V15 A19 D20 M21 | L13-M17 WeakPolarHBondContact O-CB 3.38Å; L13-M17 VanDerWaalsContact O-CG 3.26Å; L13-M17 WeakPolarHBondContact O-CG 3.35Å; L13-M17 PolarHBondContact O-N 3.15Å; E14-M17 PolarHBondContact O-N 3.34Å; V15-M17 PolarHBondContact O-N 3.36Å; M17-A19 VanDerWaalsContact C-N 3.29Å; M17-A19 PolarHBondContact O-N 3.46Å; M17-D20 PolarHBondContact O-N 3.19Å; M17-M21 PolarHBondContact O-N 3.21Å |
| 18 | M | 95.3 | Very high | 95.9 | Very high | 132 Ų | 132 | 88.6 Ų | 88.6 | 65% | 0.65 | 46% | 0.46 | S | S | * | . | H | α-helix | trans | -63.4 | -36.6 | 176.7 | -73.3 | -173.1 | 74.4 | 0 | 0 | 111.8 | E14 V15 E16 M21 Y22 | E14-M18 VanDerWaalsContact O-CG 3.31Å; E14-M18 WeakPolarHBondContact O-CG 3.5Å; E14-M18 PolarHBondContact O-N 3.09Å; V15-M18 PolarHBondContact O-N 3.18Å; E16-M18 PolarHBondContact O-N 2.84Å; M18-M21 PolarHBondContact O-N 3.34Å; M18-Y22 WeakPolarHBondContact O-CB 3.25Å; M18-Y22 PolarHBondContact O-N 3.45Å |
| 19 | A | 96.9 | Very high | 96.2 | Very high | 48 Ų | 48 | 84.1 Ų | 84.1 | 40% | 0.397 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -66 | -44.2 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | V15 E16 M17 Y22 N23 | V15-A19 WeakPolarHBondContact O-CB 3.45Å; V15-A19 PolarHBondContact O-N 3.02Å; E16-A19 WeakPolarHBondContact O-CB 3.37Å; E16-A19 PolarHBondContact O-N 3.43Å; M17-A19 VanDerWaalsContact C-N 3.29Å; M17-A19 PolarHBondContact O-N 3.46Å; A19-Y22 PolarHBondContact O-N 3.39Å; A19-N23 PolarHBondContact O-N 3.2Å; A19-N23 PolarHBondContact O-ND2 2.9Å; A19-N23 VanDerWaalsContact O-ND2 3.13Å |
| 20 | D | 97.3 | Very high | 96.5 | Very high | 73 Ų | 73 | 83.8 Ų | 83.8 | 39% | 0.39 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -61.6 | -44.8 | 174.8 | -176.6 | 47.5 | 0 | 0 | 0 | 111.3 | E16 M17 Y22 N23 R24 | E16-D20 PolarHBondContact O-N 2.86Å; M17-D20 PolarHBondContact O-N 3.19Å; D20-Y22 VanDerWaalsContact C-N 3.34Å; D20-Y22 PolarHBondContact O-N 3.1Å; D20-N23 PolarHBondContact O-N 2.81Å; D20-R24 VanDerWaalsContact CG-NE 3.27Å; D20-R24 WeakPolarHBondContact O-CG 3.3Å; D20-R24 PolarHBondContact O-N 3.03Å; D20-R24 IonicContact OD1-CZ 3.74Å; D20-R24 IonicContact OD1-NE 3.3Å; D20-R24 PolarHBondContact OD1-NE 3.46Å; D20-R24 IonicContact OD1-NH2 2.64Å; D20-R24 IonicContact OD2-CZ 3.89Å; D20-R24 VanDerWaalsContact OD2-CZ 3.26Å; D20-R24 IonicContact OD2-NE 3.83Å; D20-R24 PolarHBondContact OD2-NE 3.08Å; D20-R24 IonicContact OD2-NH2 3.21Å; D20-R24 PolarHBondContact OD2-NH2 3.3Å |
| 21 | M | 97.1 | Very high | 96.8 | Very high | 38 Ų | 38 | 91.7 Ų | 91.7 | 19% | 0.187 | 46% | 0.455 | C | S | . | . | H | α-helix | trans | -57.5 | -46.8 | 175.6 | -172 | -143.9 | 74 | 0 | 0 | 111.4 | M17 M18 N23 R24 M25 Y58 L59 | M17-M21 PolarHBondContact O-N 3.21Å; M18-M21 PolarHBondContact O-N 3.34Å; M21-N23 PolarHBondContact O-N 3.31Å; M21-R24 PolarHBondContact O-N 3Å; M21-M25 VanDerWaalsContact O-CB 3.28Å; M21-M25 WeakPolarHBondContact O-CB 3.38Å; M21-M25 PolarHBondContact O-N 2.9Å; M21-Y58 HydrophobicContact CG-CE1 4.18Å; M21-L59 HydrophobicContact CE-CD2 3.94Å; M21-L59 HydrophobicContact SD-CD2 4.07Å |
| 22 | Y | 98 | Very high | 97 | Very high | 142 Ų | 142 | 97 Ų | 97 | 56% | 0.557 | 47% | 0.469 | S | S | * | . | H | α-helix | trans | -59.9 | -44.7 | 178.5 | 178.6 | -95.5 | 0 | 0 | 0 | 112.1 | M18 A19 D20 M25 T26 | M18-Y22 WeakPolarHBondContact O-CB 3.25Å; M18-Y22 PolarHBondContact O-N 3.45Å; A19-Y22 PolarHBondContact O-N 3.39Å; D20-Y22 VanDerWaalsContact C-N 3.34Å; D20-Y22 PolarHBondContact O-N 3.1Å; Y22-M25 HydrophobicContact CD2-CE 4.16Å; Y22-M25 PolarHBondContact O-N 3.23Å; Y22-T26 VanDerWaalsContact O-CB 3.3Å; Y22-T26 WeakPolarHBondContact O-CB 3.16Å; Y22-T26 PolarHBondContact O-N 2.87Å; Y22-T26 PolarHBondContact O-OG1 3.41Å |
| 23 | N | 98.2 | Very high | 97.2 | Very high | 86 Ų | 86 | 91.5 Ų | 91.5 | 46% | 0.46 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -64 | -43.8 | 178.5 | -72.6 | -34.9 | 0 | 0 | 0 | 111.9 | A19 D20 M21 N27 | A19-N23 PolarHBondContact O-N 3.2Å; A19-N23 PolarHBondContact O-ND2 2.9Å; A19-N23 VanDerWaalsContact O-ND2 3.13Å; D20-N23 PolarHBondContact O-N 2.81Å; M21-N23 PolarHBondContact O-N 3.31Å; N23-N27 WeakPolarHBondContact O-CB 3.44Å; N23-N27 PolarHBondContact O-N 3.02Å; N23-N27 PolarHBondContact O-ND2 3.42Å |
| 24 | R | 98.2 | Very high | 97.3 | Very high | 149 Ų | 149 | 88.2 Ų | 88.2 | 56% | 0.562 | 43% | 0.427 | S | S | * | . | H | α-helix | trans | -65.7 | -43.4 | 177.2 | -69.9 | 176.2 | -172.4 | -125.6 | 9.1 | 112.1 | D20 M21 A28 Y58 | D20-R24 VanDerWaalsContact CG-NE 3.27Å; D20-R24 WeakPolarHBondContact O-CG 3.3Å; D20-R24 PolarHBondContact O-N 3.03Å; D20-R24 IonicContact OD1-CZ 3.74Å; D20-R24 IonicContact OD1-NE 3.3Å; D20-R24 PolarHBondContact OD1-NE 3.46Å; D20-R24 IonicContact OD1-NH2 2.64Å; D20-R24 IonicContact OD2-CZ 3.89Å; D20-R24 VanDerWaalsContact OD2-CZ 3.26Å; D20-R24 IonicContact OD2-NE 3.83Å; D20-R24 PolarHBondContact OD2-NE 3.08Å; D20-R24 IonicContact OD2-NH2 3.21Å; D20-R24 PolarHBondContact OD2-NH2 3.3Å; M21-R24 PolarHBondContact O-N 3Å; R24-A28 VanDerWaalsContact O-CB 3.27Å; R24-A28 WeakPolarHBondContact O-CB 3.45Å; R24-A28 PolarHBondContact O-N 2.92Å; R24-Y58 WeakPolarHBondContact CB-OH 3.1Å |
| 25 | M | 98.6 | Very high | 97.4 | Very high | 18 Ų | 18 | 85.5 Ų | 85.5 | 9% | 0.089 | 42% | 0.42 | C | S | . | . | H | α-helix | trans | -61.1 | -49.3 | 177 | -178.9 | 178.2 | 67.3 | 0 | 0 | 111 | M21 Y22 N27 A28 C29 V55 Y58 L59 | M21-M25 VanDerWaalsContact O-CB 3.28Å; M21-M25 WeakPolarHBondContact O-CB 3.38Å; M21-M25 PolarHBondContact O-N 2.9Å; Y22-M25 HydrophobicContact CD2-CE 4.16Å; Y22-M25 PolarHBondContact O-N 3.23Å; M25-N27 PolarHBondContact O-N 3.39Å; M25-A28 PolarHBondContact O-N 2.86Å; M25-C29 WeakPolarHBondContact O-CB 3.42Å; M25-C29 PolarHBondContact O-N 3.33Å; M25-V55 HydrophobicContact CE-CG1 4.17Å; M25-V55 HydrophobicContact SD-CB 4.31Å; M25-V55 HydrophobicContact SD-CG1 3.73Å; M25-V55 HydrophobicContact SD-CG2 4.28Å; M25-Y58 HydrophobicContact CB-CD1 3.72Å; M25-Y58 HydrophobicContact CB-CD2 4.31Å; M25-Y58 HydrophobicContact CB-CE1 3.63Å; M25-Y58 HydrophobicContact CB-CE2 4.23Å; M25-Y58 HydrophobicContact CB-CG 4.08Å; M25-Y58 HydrophobicContact CG-CD1 3.61Å; M25-Y58 HydrophobicContact CG-CD2 4.18Å; M25-Y58 HydrophobicContact CG-CE1 4.08Å; M25-Y58 HydrophobicContact CG-CG 3.67Å; M25-Y58 HydrophobicContact SD-CD1 3.91Å; M25-Y58 HydrophobicContact SD-CG 4.31Å; M25-L59 HydrophobicContact SD-CD2 4.2Å; M25-L59 HydrophobicContact SD-CG 4.26Å |
| 26 | T | 98.4 | Very high | 97.3 | Very high | 61 Ų | 61 | 86.6 Ų | 86.6 | 37% | 0.374 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -58.3 | -49.1 | 179.9 | -61.2 | 0 | 0 | 0 | 0 | 110.7 | Y22 A28 C29 H30 | Y22-T26 VanDerWaalsContact O-CB 3.3Å; Y22-T26 WeakPolarHBondContact O-CB 3.16Å; Y22-T26 PolarHBondContact O-N 2.87Å; Y22-T26 PolarHBondContact O-OG1 3.41Å; T26-A28 PolarHBondContact O-N 2.64Å; T26-C29 PolarHBondContact O-N 3.13Å; T26-H30 VanDerWaalsContact O-CB 3.24Å; T26-H30 WeakPolarHBondContact O-CB 3.38Å; T26-H30 PolarHBondContact O-N 3.3Å |
| 27 | N | 98.4 | Very high | 97.3 | Very high | 102 Ų | 102 | 86.9 Ų | 86.9 | 55% | 0.545 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -62.1 | -41 | 177.4 | -76.9 | -42.2 | 0 | 0 | 0 | 112.7 | N23 M25 R31 | N23-N27 WeakPolarHBondContact O-CB 3.44Å; N23-N27 PolarHBondContact O-N 3.02Å; N23-N27 PolarHBondContact O-ND2 3.42Å; M25-N27 PolarHBondContact O-N 3.39Å; N27-R31 WeakPolarHBondContact O-CB 3.45Å; N27-R31 WeakPolarHBondContact O-CG 3.44Å; N27-R31 PolarHBondContact O-N 3.18Å; N27-R31 VanDerWaalsContact O-N 3.1Å |
| 28 | A | 98.6 | Very high | 97.3 | Very high | 27 Ų | 27 | 87.3 Ų | 87.3 | 22% | 0.223 | 43% | 0.426 | C | S | . | . | H | α-helix | trans | -66.1 | -45.8 | 178.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | R24 M25 T26 R31 K32 Y58 | R24-A28 VanDerWaalsContact O-CB 3.27Å; R24-A28 WeakPolarHBondContact O-CB 3.45Å; R24-A28 PolarHBondContact O-N 2.92Å; M25-A28 PolarHBondContact O-N 2.86Å; T26-A28 PolarHBondContact O-N 2.64Å; A28-R31 PolarHBondContact O-N 3.04Å; A28-K32 WeakPolarHBondContact O-CB 3.39Å; A28-K32 VanDerWaalsContact O-CG 3.23Å; A28-K32 WeakPolarHBondContact O-CG 3.49Å; A28-K32 PolarHBondContact O-N 3.11Å; A28-Y58 HydrophobicContact CB-CD2 4.36Å; A28-Y58 HydrophobicContact CB-CE2 4.16Å |
| 29 | C | 98.7 | Very high | 97.2 | Very high | 3 Ų | 3 | 90.2 Ų | 90.2 | 2% | 0.02 | 44% | 0.435 | C | S | . | . | H | α-helix | trans | -72 | -38 | -179.1 | -70.3 | 0 | 0 | 0 | 0 | 112.6 | M25 T26 R31 K32 C33 L51 C54 | M25-C29 WeakPolarHBondContact O-CB 3.42Å; M25-C29 PolarHBondContact O-N 3.33Å; T26-C29 PolarHBondContact O-N 3.13Å; C29-R31 PolarHBondContact O-N 3.46Å; C29-K32 PolarHBondContact O-N 3.35Å; C29-C33 VanDerWaalsContact O-CB 3.3Å; C29-C33 WeakPolarHBondContact O-CB 3.43Å; C29-C33 PolarHBondContact O-N 3.36Å; C29-L51 HydrophobicContact CB-CD2 4.09Å; C29-C54 WeakPolarHBondContact CA-SG 3.4Å; C29-C54 HydrophobicContact CB-CB 3.81Å; C29-C54 WeakPolarHBondContact CB-SG 3.49Å; C29-C54 WeakPolarHBondContact SG-CB 3.43Å; C29-C54 CovalentContact SG-SG 2.05Å; C29-C54 PolarHBondContact SG-SG 3.42Å |
| 30 | H | 98.1 | Very high | 97 | Very high | 86 Ų | 86 | 94 Ų | 94 | 40% | 0.398 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -56.4 | -52.2 | 170.8 | -176.4 | -83.7 | 0 | 0 | 0 | 111 | T26 K32 C33 V34 Y38 | T26-H30 VanDerWaalsContact O-CB 3.24Å; T26-H30 WeakPolarHBondContact O-CB 3.38Å; T26-H30 PolarHBondContact O-N 3.3Å; H30-K32 VanDerWaalsContact C-N 3.27Å; H30-K32 PolarHBondContact O-N 2.99Å; H30-C33 PolarHBondContact O-N 3.41Å; H30-V34 WeakPolarHBondContact O-CB 3.23Å; H30-V34 PolarHBondContact O-N 3.29Å; H30-Y38 PolarHBondContact CE1-OH 2.97Å; H30-Y38 PolarHBondContact NE2-OH 2.97Å |
| 31 | R | 98.2 | Very high | 96.9 | Very high | 213 Ų | 213 | 95.8 Ų | 95.8 | 80% | 0.804 | 47% | 0.47 | S | S | * | . | H | α-helix | trans | -61.6 | -31.3 | 178.7 | -74.4 | -178.8 | -178.7 | -157.9 | 1.6 | 114.1 | N27 A28 C29 | N27-R31 WeakPolarHBondContact O-CB 3.45Å; N27-R31 WeakPolarHBondContact O-CG 3.44Å; N27-R31 PolarHBondContact O-N 3.18Å; N27-R31 VanDerWaalsContact O-N 3.1Å; A28-R31 PolarHBondContact O-N 3.04Å; C29-R31 PolarHBondContact O-N 3.46Å |
| 32 | K | 98.3 | Very high | 96.9 | Very high | 162 Ų | 162 | 101.6 Ų | 101.6 | 70% | 0.704 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -83 | -33.5 | -178.1 | -75.7 | 173.5 | -175 | -68 | 0 | 113.1 | A28 C29 H30 | A28-K32 WeakPolarHBondContact O-CB 3.39Å; A28-K32 VanDerWaalsContact O-CG 3.23Å; A28-K32 WeakPolarHBondContact O-CG 3.49Å; A28-K32 PolarHBondContact O-N 3.11Å; C29-K32 PolarHBondContact O-N 3.35Å; H30-K32 VanDerWaalsContact C-N 3.27Å; H30-K32 PolarHBondContact O-N 2.99Å |
| 33 | C | 98.4 | Very high | 96.9 | Very high | 12 Ų | 12 | 99.6 Ų | 99.6 | 8% | 0.081 | 50% | 0.495 | C | S | . | . | H | α-helix | trans | -112.8 | -24.2 | -167.2 | -68.7 | 0 | 0 | 0 | 0 | 114.2 | C29 H30 E47 C50 L51 | C29-C33 VanDerWaalsContact O-CB 3.3Å; C29-C33 WeakPolarHBondContact O-CB 3.43Å; C29-C33 PolarHBondContact O-N 3.36Å; H30-C33 PolarHBondContact O-N 3.41Å; C33-E47 WeakPolarHBondContact O-CG 3.46Å; C33-C50 WeakPolarHBondContact CA-SG 3.26Å; C33-C50 HydrophobicContact CB-CB 3.6Å; C33-C50 WeakPolarHBondContact CB-SG 3.23Å; C33-C50 WeakPolarHBondContact SG-CB 3.28Å; C33-C50 PolarHBondContact SG-O 3.38Å; C33-C50 CovalentContact SG-SG 2.05Å; C33-C50 PolarHBondContact SG-SG 2.89Å; C33-L51 HydrophobicContact CB-CD2 3.88Å; C33-L51 HydrophobicContact CB-CG 4.01Å |
| 34 | V | 97.4 | Very high | 96.8 | Very high | 15 Ų | 15 | 97.4 Ų | 97.4 | 9% | 0.091 | 49% | 0.487 | C | S | . | . | S | Bend | trans | -109.4 | 109.8 | -177.5 | -174.5 | 0 | 0 | 0 | 0 | 109 | H30 Y38 L43 | H30-V34 WeakPolarHBondContact O-CB 3.23Å; H30-V34 PolarHBondContact O-N 3.29Å; V34-Y38 HydrophobicContact CG1-CD1 4.26Å; V34-Y38 HydrophobicContact CG1-CE1 3.43Å; V34-Y38 VanDerWaalsContact CG1-CE1 3.43Å; V34-L43 HydrophobicContact CG2-CD2 4.38Å |
| 35 | P | 95.4 | Very high | 96.8 | Very high | 66 Ų | 66 | 99 Ų | 99 | 43% | 0.429 | 50% | 0.498 | S | S | . | . | trans | -62.6 | 150.8 | 179 | -20.4 | 33.1 | 0 | 0 | 0 | 111.7 | H37 E47 | P35-H37 PolarHBondContact O-N 3.04Å; P35-E47 VanDerWaalsContact CD-OE1 3.24Å; P35-E47 WeakPolarHBondContact CD-OE1 3.31Å | ||
| 36 | P | 94.6 | Very high | 96.7 | Very high | 125 Ų | 125 | 100.6 Ų | 100.6 | 81% | 0.812 | 52% | 0.518 | S | S | * | . | S | Bend | trans | -66.4 | -19.2 | 178 | 27.8 | -35.1 | 0 | 0 | 0 | 113.1 | ||
| 37 | H | 95 | Very high | 96.7 | Very high | 141 Ų | 141 | 99.1 Ų | 99.1 | 65% | 0.653 | 51% | 0.508 | S | S | * | . | S | Bend | trans | -96.7 | 101.2 | 174.6 | -175.9 | -59.1 | 0 | 0 | 0 | 110.3 | P35 K39 | P35-H37 PolarHBondContact O-N 3.04Å; H37-K39 PolarHBondContact O-N 3.38Å |
| 38 | Y | 94.2 | Very high | 96.7 | Very high | 135 Ų | 135 | 96 Ų | 96 | 53% | 0.529 | 50% | 0.496 | S | S | . | . | trans | -76.8 | 114.6 | 175 | -56.8 | -83.9 | 0 | 0 | 0 | 110.3 | H30 V34 | H30-Y38 PolarHBondContact CE1-OH 2.97Å; H30-Y38 PolarHBondContact NE2-OH 2.97Å; V34-Y38 HydrophobicContact CG1-CD1 4.26Å; V34-Y38 HydrophobicContact CG1-CE1 3.43Å; V34-Y38 VanDerWaalsContact CG1-CE1 3.43Å | ||
| 39 | K | 92.5 | Very high | 96.7 | Very high | 193 Ų | 193 | 97.4 Ų | 97.4 | 84% | 0.839 | 50% | 0.501 | S | S | * | . | S | Bend | trans | -80.8 | -31.9 | 173.9 | -67.6 | -175.8 | 179.6 | 179.4 | 0 | 111.9 | H37 | H37-K39 PolarHBondContact O-N 3.38Š|
| 40 | E | 94.4 | Very high | 96.7 | Very high | 126 Ų | 126 | 99.4 Ų | 99.4 | 59% | 0.589 | 52% | 0.515 | S | S | * | . | S | Bend | trans | -148.3 | 166.1 | 179.3 | 62.2 | -161 | 163.3 | 0 | 0 | 109.4 | ||
| 41 | A | 94.5 | Very high | 96.7 | Very high | 112 Ų | 112 | 97.2 Ų | 97.2 | 93% | 0.926 | 51% | 0.506 | S | S | * | . | S | Bend | trans | -82.6 | -21.4 | -176.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||
| 42 | E | 96.9 | Very high | 96.7 | Very high | 160 Ų | 160 | 92.7 Ų | 92.7 | 75% | 0.748 | 50% | 0.498 | S | S | * | . | S | Bend | trans | -87.4 | 150.5 | 179.3 | -65.7 | -178.1 | -173.6 | 0 | 0 | 110.7 | S44 | E42-S44 PolarHBondContact O-N 3.49Š|
| 43 | L | 97 | Very high | 96.8 | Very high | 99 Ų | 99 | 92.8 Ų | 92.8 | 52% | 0.518 | 49% | 0.494 | S | S | . | . | P | Polyproline II helix | trans | -68.4 | 123.1 | 171.4 | -65.9 | 174.3 | 0 | 0 | 0 | 109.1 | V34 E47 L51 | V34-L43 HydrophobicContact CG2-CD2 4.38Å; L43-E47 HydrophobicContact CB-CB 4.39Å; L43-E47 HydrophobicContact CD2-CB 4.04Å; L43-L51 HydrophobicContact CD1-CD1 3.75Å; L43-L51 HydrophobicContact CD2-CD1 4.17Å |
| 44 | S | 96.9 | Very high | 96.8 | Very high | 41 Ų | 41 | 93 Ų | 93 | 29% | 0.287 | 50% | 0.495 | S | S | . | . | P | Polyproline II helix | trans | -60.8 | 156 | 166.7 | 68.4 | 0 | 0 | 0 | 0 | 110.1 | E42 G46 E47 A48 | E42-S44 PolarHBondContact O-N 3.49Å; S44-G46 PolarHBondContact O-N 3.23Å; S44-G46 VanDerWaalsContact O-N 3.07Å; S44-E47 VanDerWaalsContact CB-OE2 3.28Å; S44-E47 WeakPolarHBondContact CB-OE2 3.26Å; S44-E47 PolarHBondContact N-OE2 3.42Å; S44-E47 PolarHBondContact O-N 3.3Å; S44-E47 VanDerWaalsContact OG-CD 3.3Å; S44-E47 VanDerWaalsContact OG-CG 3.3Å; S44-E47 WeakPolarHBondContact OG-CG 3.33Å; S44-E47 PolarHBondContact OG-N 3.13Å; S44-E47 PolarHBondContact OG-OE2 3.41Å; S44-A48 PolarHBondContact O-N 2.96Å |
| 45 | K | 97.3 | Very high | 96.8 | Very high | 182 Ų | 182 | 94.8 Ų | 94.8 | 79% | 0.791 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -52.7 | -33.7 | 174 | -174.4 | 178.8 | -179 | 179.5 | 0 | 112.4 | V49 | K45-V49 WeakPolarHBondContact O-CB 3.49Å; K45-V49 VanDerWaalsContact O-CG2 3.28Å; K45-V49 WeakPolarHBondContact O-CG2 3.48Å; K45-V49 PolarHBondContact O-N 2.93Å; K45-V49 VanDerWaalsContact O-N 3.15Å |
| 46 | G | 97.2 | Very high | 97 | Very high | 51 Ų | 51 | 94.5 Ų | 94.5 | 53% | 0.526 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -68.2 | -44.5 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | S44 C50 | S44-G46 PolarHBondContact O-N 3.23Å; S44-G46 VanDerWaalsContact O-N 3.07Å; G46-C50 VanDerWaalsContact O-CB 3.28Å; G46-C50 WeakPolarHBondContact O-CB 3.46Å; G46-C50 PolarHBondContact O-N 3Å |
| 47 | E | 98.3 | Very high | 97.2 | Very high | 31 Ų | 31 | 95.6 Ų | 95.6 | 15% | 0.145 | 50% | 0.501 | C | S | . | . | H | α-helix | trans | -65.3 | -45.3 | 177.7 | -70.3 | 161.1 | 138.8 | 0 | 0 | 111.1 | C33 P35 L43 S44 C50 L51 | C33-E47 WeakPolarHBondContact O-CG 3.46Å; P35-E47 VanDerWaalsContact CD-OE1 3.24Å; P35-E47 WeakPolarHBondContact CD-OE1 3.31Å; L43-E47 HydrophobicContact CB-CB 4.39Å; L43-E47 HydrophobicContact CD2-CB 4.04Å; S44-E47 VanDerWaalsContact CB-OE2 3.28Å; S44-E47 WeakPolarHBondContact CB-OE2 3.26Å; S44-E47 PolarHBondContact N-OE2 3.42Å; S44-E47 PolarHBondContact O-N 3.3Å; S44-E47 VanDerWaalsContact OG-CD 3.3Å; S44-E47 VanDerWaalsContact OG-CG 3.3Å; S44-E47 WeakPolarHBondContact OG-CG 3.33Å; S44-E47 PolarHBondContact OG-N 3.13Å; S44-E47 PolarHBondContact OG-OE2 3.41Å; E47-C50 WeakPolarHBondContact O-CB 3.5Å; E47-C50 PolarHBondContact O-N 3.24Å; E47-L51 VanDerWaalsContact O-CG 3.31Å; E47-L51 WeakPolarHBondContact O-CG 3.4Å; E47-L51 PolarHBondContact O-N 3.44Å |
| 48 | A | 98.1 | Very high | 97.4 | Very high | 36 Ų | 36 | 91.6 Ų | 91.6 | 30% | 0.298 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -57.5 | -52.1 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112 | S44 C50 L51 D52 | S44-A48 PolarHBondContact O-N 2.96Å; A48-C50 VanDerWaalsContact C-N 3.28Å; A48-C50 PolarHBondContact O-N 2.83Å; A48-L51 PolarHBondContact O-N 2.89Å; A48-D52 PolarHBondContact O-N 3.01Å; A48-D52 VanDerWaalsContact O-N 3.09Å |
| 49 | V | 98.7 | Very high | 97.6 | Very high | 56 Ų | 56 | 88.8 Ų | 88.8 | 34% | 0.339 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -63.8 | -34.1 | 177.6 | 171.4 | 0 | 0 | 0 | 0 | 112 | K45 R53 | K45-V49 WeakPolarHBondContact O-CB 3.49Å; K45-V49 VanDerWaalsContact O-CG2 3.28Å; K45-V49 WeakPolarHBondContact O-CG2 3.48Å; K45-V49 PolarHBondContact O-N 2.93Å; K45-V49 VanDerWaalsContact O-N 3.15Å; V49-R53 WeakPolarHBondContact O-CD 3.3Å; V49-R53 VanDerWaalsContact O-CG 3.26Å; V49-R53 WeakPolarHBondContact O-CG 3.35Å; V49-R53 PolarHBondContact O-N 3.32Å |
| 50 | C | 98.7 | Very high | 97.8 | Very high | 45 Ų | 45 | 82.6 Ų | 82.6 | 30% | 0.304 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -65.3 | -45.8 | 174.6 | -176.1 | 0 | 0 | 0 | 0 | 111.3 | C33 G46 E47 A48 R53 C54 | C33-C50 WeakPolarHBondContact CA-SG 3.26Å; C33-C50 HydrophobicContact CB-CB 3.6Å; C33-C50 WeakPolarHBondContact CB-SG 3.23Å; C33-C50 WeakPolarHBondContact SG-CB 3.28Å; C33-C50 PolarHBondContact SG-O 3.38Å; C33-C50 CovalentContact SG-SG 2.05Å; C33-C50 PolarHBondContact SG-SG 2.89Å; G46-C50 VanDerWaalsContact O-CB 3.28Å; G46-C50 WeakPolarHBondContact O-CB 3.46Å; G46-C50 PolarHBondContact O-N 3Å; E47-C50 WeakPolarHBondContact O-CB 3.5Å; E47-C50 PolarHBondContact O-N 3.24Å; A48-C50 VanDerWaalsContact C-N 3.28Å; A48-C50 PolarHBondContact O-N 2.83Å; C50-R53 PolarHBondContact O-N 3.02Å; C50-C54 VanDerWaalsContact O-CB 3.29Å; C50-C54 WeakPolarHBondContact O-CB 3.47Å; C50-C54 PolarHBondContact O-N 3.47Å |
| 51 | L | 98.8 | Very high | 98 | Very high | 40 Ų | 40 | 82 Ų | 82 | 21% | 0.209 | 45% | 0.451 | C | S | . | . | H | α-helix | trans | -59.6 | -47.4 | 179.7 | -73.2 | 168 | 0 | 0 | 0 | 111.1 | C29 C33 L43 E47 A48 R53 C54 V55 | C29-L51 HydrophobicContact CB-CD2 4.09Å; C33-L51 HydrophobicContact CB-CD2 3.88Å; C33-L51 HydrophobicContact CB-CG 4.01Å; L43-L51 HydrophobicContact CD1-CD1 3.75Å; L43-L51 HydrophobicContact CD2-CD1 4.17Å; E47-L51 VanDerWaalsContact O-CG 3.31Å; E47-L51 WeakPolarHBondContact O-CG 3.4Å; E47-L51 PolarHBondContact O-N 3.44Å; A48-L51 PolarHBondContact O-N 2.89Å; L51-R53 VanDerWaalsContact C-N 3.33Å; L51-R53 PolarHBondContact O-N 3.49Å; L51-C54 WeakPolarHBondContact O-CB 3.28Å; L51-C54 PolarHBondContact O-N 2.95Å; L51-C54 VanDerWaalsContact O-N 3.08Å; L51-V55 WeakPolarHBondContact O-CG2 3.47Å; L51-V55 PolarHBondContact O-N 3.28Å |
| 52 | D | 98.7 | Very high | 98.1 | Very high | 118 Ų | 118 | 81.1 Ų | 81.1 | 63% | 0.631 | 43% | 0.427 | S | S | * | . | H | α-helix | trans | -55.6 | -48.7 | 176.2 | -66.9 | -26.2 | 0 | 0 | 0 | 111.6 | A48 C54 A56 | A48-D52 PolarHBondContact O-N 3.01Å; A48-D52 VanDerWaalsContact O-N 3.09Å; D52-C54 VanDerWaalsContact C-N 3.32Å; D52-C54 PolarHBondContact O-N 3.31Å; D52-A56 WeakPolarHBondContact O-CB 3.28Å; D52-A56 PolarHBondContact O-N 3.48Å; D52-A56 VanDerWaalsContact O-N 3.12Å |
| 53 | R | 98.8 | Very high | 98.1 | Very high | 165 Ų | 165 | 78.6 Ų | 78.6 | 62% | 0.623 | 42% | 0.415 | S | S | * | . | H | α-helix | trans | -65.2 | -36 | 177.6 | -71.3 | 171.6 | 177 | 178.8 | 0.5 | 112.2 | V49 C50 L51 K57 | V49-R53 WeakPolarHBondContact O-CD 3.3Å; V49-R53 VanDerWaalsContact O-CG 3.26Å; V49-R53 WeakPolarHBondContact O-CG 3.35Å; V49-R53 PolarHBondContact O-N 3.32Å; C50-R53 PolarHBondContact O-N 3.02Å; L51-R53 VanDerWaalsContact C-N 3.33Å; L51-R53 PolarHBondContact O-N 3.49Å; R53-K57 WeakPolarHBondContact O-CB 3.45Å; R53-K57 VanDerWaalsContact O-CG 3.23Å; R53-K57 WeakPolarHBondContact O-CG 3.29Å; R53-K57 PolarHBondContact O-N 3.02Å |
| 54 | C | 98.8 | Very high | 98.2 | Very high | 15 Ų | 15 | 80.4 Ų | 80.4 | 10% | 0.101 | 42% | 0.415 | C | S | . | . | H | α-helix | trans | -67.6 | -49.2 | -179 | 179.8 | 0 | 0 | 0 | 0 | 110.9 | C29 C50 L51 D52 A56 K57 Y58 | C29-C54 WeakPolarHBondContact CA-SG 3.4Å; C29-C54 HydrophobicContact CB-CB 3.81Å; C29-C54 WeakPolarHBondContact CB-SG 3.49Å; C29-C54 WeakPolarHBondContact SG-CB 3.43Å; C29-C54 CovalentContact SG-SG 2.05Å; C29-C54 PolarHBondContact SG-SG 3.42Å; C50-C54 VanDerWaalsContact O-CB 3.29Å; C50-C54 WeakPolarHBondContact O-CB 3.47Å; C50-C54 PolarHBondContact O-N 3.47Å; L51-C54 WeakPolarHBondContact O-CB 3.28Å; L51-C54 PolarHBondContact O-N 2.95Å; L51-C54 VanDerWaalsContact O-N 3.08Å; D52-C54 VanDerWaalsContact C-N 3.32Å; D52-C54 PolarHBondContact O-N 3.31Å; C54-A56 PolarHBondContact O-N 3Å; C54-K57 PolarHBondContact O-N 3.23Å; C54-Y58 WeakPolarHBondContact O-CB 3.43Å; C54-Y58 PolarHBondContact O-N 2.96Å |
| 55 | V | 98.7 | Very high | 98.2 | Very high | 53 Ų | 53 | 84.1 Ų | 84.1 | 32% | 0.321 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -60.4 | -47.4 | 178.2 | 173.2 | 0 | 0 | 0 | 0 | 110 | M25 L51 K57 Y58 L59 | M25-V55 HydrophobicContact CE-CG1 4.17Å; M25-V55 HydrophobicContact SD-CB 4.31Å; M25-V55 HydrophobicContact SD-CG1 3.73Å; M25-V55 HydrophobicContact SD-CG2 4.28Å; L51-V55 WeakPolarHBondContact O-CG2 3.47Å; L51-V55 PolarHBondContact O-N 3.28Å; V55-K57 VanDerWaalsContact C-N 3.33Å; V55-K57 PolarHBondContact O-N 3.28Å; V55-Y58 PolarHBondContact O-N 3.37Å; V55-Y58 VanDerWaalsContact O-N 3.15Å; V55-L59 HydrophobicContact CG1-CD1 4.07Å; V55-L59 WeakPolarHBondContact O-CG 3.02Å; V55-L59 PolarHBondContact O-N 3.07Å |
| 56 | A | 98.7 | Very high | 98.1 | Very high | 61 Ų | 61 | 77 Ų | 77 | 50% | 0.504 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -56.6 | -45.6 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | D52 C54 D60 | D52-A56 WeakPolarHBondContact O-CB 3.28Å; D52-A56 PolarHBondContact O-N 3.48Å; D52-A56 VanDerWaalsContact O-N 3.12Å; C54-A56 PolarHBondContact O-N 3Å; A56-D60 WeakPolarHBondContact O-CB 3.02Å; A56-D60 PolarHBondContact O-N 3.14Å; A56-D60 VanDerWaalsContact O-N 3.13Å |
| 57 | K | 98.8 | Very high | 98.1 | Very high | 148 Ų | 148 | 80.2 Ų | 80.2 | 64% | 0.643 | 41% | 0.406 | S | S | * | . | H | α-helix | trans | -68.7 | -36.5 | 177.2 | -73.2 | 176.2 | -177.6 | -174.8 | 0 | 113 | R53 C54 V55 L61 | R53-K57 WeakPolarHBondContact O-CB 3.45Å; R53-K57 VanDerWaalsContact O-CG 3.23Å; R53-K57 WeakPolarHBondContact O-CG 3.29Å; R53-K57 PolarHBondContact O-N 3.02Å; C54-K57 PolarHBondContact O-N 3.23Å; V55-K57 VanDerWaalsContact C-N 3.33Å; V55-K57 PolarHBondContact O-N 3.28Å; K57-L61 VanDerWaalsContact O-CB 3.3Å; K57-L61 WeakPolarHBondContact O-CB 3.26Å; K57-L61 PolarHBondContact O-N 3.08Å |
| 58 | Y | 98.8 | Very high | 98 | Very high | 57 Ų | 57 | 83.3 Ų | 83.3 | 22% | 0.224 | 42% | 0.419 | C | S | . | . | H | α-helix | trans | -63.2 | -46.4 | 179.3 | -171.6 | -81 | 0 | 0 | 0 | 110.3 | M21 R24 M25 A28 C54 V55 L61 H62 | M21-Y58 HydrophobicContact CG-CE1 4.18Å; R24-Y58 WeakPolarHBondContact CB-OH 3.1Å; M25-Y58 HydrophobicContact CB-CD1 3.72Å; M25-Y58 HydrophobicContact CB-CD2 4.31Å; M25-Y58 HydrophobicContact CB-CE1 3.63Å; M25-Y58 HydrophobicContact CB-CE2 4.23Å; M25-Y58 HydrophobicContact CB-CG 4.08Å; M25-Y58 HydrophobicContact CG-CD1 3.61Å; M25-Y58 HydrophobicContact CG-CD2 4.18Å; M25-Y58 HydrophobicContact CG-CE1 4.08Å; M25-Y58 HydrophobicContact CG-CG 3.67Å; M25-Y58 HydrophobicContact SD-CD1 3.91Å; M25-Y58 HydrophobicContact SD-CG 4.31Å; A28-Y58 HydrophobicContact CB-CD2 4.36Å; A28-Y58 HydrophobicContact CB-CE2 4.16Å; C54-Y58 WeakPolarHBondContact O-CB 3.43Å; C54-Y58 PolarHBondContact O-N 2.96Å; V55-Y58 PolarHBondContact O-N 3.37Å; V55-Y58 VanDerWaalsContact O-N 3.15Å; Y58-L61 PolarHBondContact O-N 2.78Å; Y58-H62 VanDerWaalsContact O-CB 3.23Å; Y58-H62 WeakPolarHBondContact O-CB 3.46Å; Y58-H62 PolarHBondContact O-N 3.27Å |
| 59 | L | 98.3 | Very high | 97.9 | Very high | 76 Ų | 76 | 87 Ų | 87 | 40% | 0.398 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -66.2 | -44.8 | 179 | -66.2 | 174.1 | 0 | 0 | 0 | 112.1 | M21 M25 V55 L61 H62 E63 | M21-L59 HydrophobicContact CE-CD2 3.94Å; M21-L59 HydrophobicContact SD-CD2 4.07Å; M25-L59 HydrophobicContact SD-CD2 4.2Å; M25-L59 HydrophobicContact SD-CG 4.26Å; V55-L59 HydrophobicContact CG1-CD1 4.07Å; V55-L59 WeakPolarHBondContact O-CG 3.02Å; V55-L59 PolarHBondContact O-N 3.07Å; L59-L61 VanDerWaalsContact C-N 3.33Å; L59-L61 PolarHBondContact O-N 3.45Å; L59-H62 PolarHBondContact O-N 3.34Å; L59-E63 WeakPolarHBondContact O-CB 3.47Å; L59-E63 PolarHBondContact O-N 3.49Å |
| 60 | D | 98.3 | Very high | 97.8 | Very high | 63 Ų | 63 | 88.7 Ų | 88.7 | 34% | 0.337 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -59.3 | -43 | 175 | 174.1 | 49.9 | 0 | 0 | 0 | 111.7 | A56 R64 | A56-D60 WeakPolarHBondContact O-CB 3.02Å; A56-D60 PolarHBondContact O-N 3.14Å; A56-D60 VanDerWaalsContact O-N 3.13Å; D60-R64 VanDerWaalsContact CG-NE 3.34Å; D60-R64 VanDerWaalsContact CG-NH2 3.29Å; D60-R64 VanDerWaalsContact O-CG 3.25Å; D60-R64 WeakPolarHBondContact O-CG 3.28Å; D60-R64 PolarHBondContact O-N 3.32Å; D60-R64 VanDerWaalsContact O-N 3.13Å; D60-R64 IonicContact OD1-CZ 3.63Å; D60-R64 VanDerWaalsContact OD1-CZ 3.26Å; D60-R64 IonicContact OD1-NE 3.02Å; D60-R64 PolarHBondContact OD1-NE 2.81Å; D60-R64 IonicContact OD1-NH2 2.84Å; D60-R64 PolarHBondContact OD1-NH2 3.47Å; D60-R64 IonicContact OD2-CZ 3.26Å; D60-R64 IonicContact OD2-NE 2.81Å; D60-R64 PolarHBondContact OD2-NE 3.45Å; D60-R64 IonicContact OD2-NH2 2.9Å; D60-R64 PolarHBondContact OD2-NH2 2.97Å |
| 61 | L | 97.9 | Very high | 97.7 | Very high | 113 Ų | 113 | 91 Ų | 91 | 59% | 0.592 | 45% | 0.45 | S | S | * | . | H | α-helix | trans | -66.4 | -44.1 | 175.6 | -178.6 | 64 | 0 | 0 | 0 | 112 | K57 Y58 L59 E63 R64 L65 | K57-L61 VanDerWaalsContact O-CB 3.3Å; K57-L61 WeakPolarHBondContact O-CB 3.26Å; K57-L61 PolarHBondContact O-N 3.08Å; Y58-L61 PolarHBondContact O-N 2.78Å; L59-L61 VanDerWaalsContact C-N 3.33Å; L59-L61 PolarHBondContact O-N 3.45Å; L61-E63 VanDerWaalsContact C-N 3.32Å; L61-E63 PolarHBondContact O-N 3.12Å; L61-R64 PolarHBondContact O-N 3.35Å; L61-L65 WeakPolarHBondContact O-CB 3.06Å; L61-L65 PolarHBondContact O-N 2.96Å |
| 62 | H | 97 | Very high | 97.5 | Very high | 94 Ų | 94 | 92.5 Ų | 92.5 | 44% | 0.435 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -58.7 | -44.4 | 179 | 179.7 | -87.2 | 0 | 0 | 0 | 111.1 | Y58 L59 L65 G66 | Y58-H62 VanDerWaalsContact O-CB 3.23Å; Y58-H62 WeakPolarHBondContact O-CB 3.46Å; Y58-H62 PolarHBondContact O-N 3.27Å; L59-H62 PolarHBondContact O-N 3.34Å; H62-L65 PolarHBondContact O-N 3.26Å; H62-G66 PolarHBondContact O-N 3.15Å |
| 63 | E | 97.4 | Very high | 97.3 | Very high | 106 Ų | 106 | 89.4 Ų | 89.4 | 50% | 0.495 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -63.8 | -45.7 | 177.5 | -165.1 | -163.7 | 166.5 | 0 | 0 | 112.2 | L59 L61 L65 G66 R67 | L59-E63 WeakPolarHBondContact O-CB 3.47Å; L59-E63 PolarHBondContact O-N 3.49Å; L61-E63 VanDerWaalsContact C-N 3.32Å; L61-E63 PolarHBondContact O-N 3.12Å; E63-L65 VanDerWaalsContact C-N 3.32Å; E63-L65 PolarHBondContact O-N 3.09Å; E63-G66 PolarHBondContact O-N 2.94Å; E63-R67 PolarHBondContact O-N 3.41Å; E63-R67 IonicContact OE1-CZ 2.86Å; E63-R67 IonicContact OE1-NH1 2.76Å; E63-R67 PolarHBondContact OE1-NH1 2.93Å; E63-R67 IonicContact OE2-NH1 3.07Å |
| 64 | R | 97.9 | Very high | 97.1 | Very high | 138 Ų | 138 | 84.9 Ų | 84.9 | 52% | 0.521 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -62 | -41.5 | 176.6 | -70.3 | 170.6 | -167 | -151 | 6.3 | 111.8 | D60 L61 K68 | D60-R64 VanDerWaalsContact CG-NE 3.34Å; D60-R64 VanDerWaalsContact CG-NH2 3.29Å; D60-R64 VanDerWaalsContact O-CG 3.25Å; D60-R64 WeakPolarHBondContact O-CG 3.28Å; D60-R64 PolarHBondContact O-N 3.32Å; D60-R64 VanDerWaalsContact O-N 3.13Å; D60-R64 IonicContact OD1-CZ 3.63Å; D60-R64 VanDerWaalsContact OD1-CZ 3.26Å; D60-R64 IonicContact OD1-NE 3.02Å; D60-R64 PolarHBondContact OD1-NE 2.81Å; D60-R64 IonicContact OD1-NH2 2.84Å; D60-R64 PolarHBondContact OD1-NH2 3.47Å; D60-R64 IonicContact OD2-CZ 3.26Å; D60-R64 IonicContact OD2-NE 2.81Å; D60-R64 PolarHBondContact OD2-NE 3.45Å; D60-R64 IonicContact OD2-NH2 2.9Å; D60-R64 PolarHBondContact OD2-NH2 2.97Å; L61-R64 PolarHBondContact O-N 3.35Å; R64-K68 PolarHBondContact O-N 2.93Å |
| 65 | L | 96.6 | Very high | 96.8 | Very high | 118 Ų | 118 | 89 Ų | 89 | 62% | 0.618 | 45% | 0.454 | S | S | * | . | H | α-helix | trans | -65.2 | -43.3 | 177.6 | -173.3 | 62.2 | 0 | 0 | 0 | 110.9 | L61 H62 E63 K68 L69 | L61-L65 WeakPolarHBondContact O-CB 3.06Å; L61-L65 PolarHBondContact O-N 2.96Å; H62-L65 PolarHBondContact O-N 3.26Å; E63-L65 VanDerWaalsContact C-N 3.32Å; E63-L65 PolarHBondContact O-N 3.09Å; L65-K68 PolarHBondContact O-N 2.05Å; L65-L69 WeakPolarHBondContact O-CB 3.31Å; L65-L69 PolarHBondContact O-N 3.33Å |
| 66 | G | 95.9 | Very high | 96.5 | Very high | 33 Ų | 33 | 91 Ų | 91 | 34% | 0.34 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -57 | -51 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | H62 E63 K68 L69 T70 | H62-G66 PolarHBondContact O-N 3.15Å; E63-G66 PolarHBondContact O-N 2.94Å; G66-K68 VanDerWaalsContact C-N 3.3Å; G66-K68 PolarHBondContact O-N 3.26Å; G66-L69 PolarHBondContact O-N 3.19Å; G66-T70 PolarHBondContact O-N 3.35Å; G66-T70 PolarHBondContact O-OG1 3.43Å |
| 67 | R | 96.6 | Very high | 96.2 | Very high | 119 Ų | 119 | 94.5 Ų | 94.5 | 45% | 0.449 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -54.7 | -46.6 | 174.4 | -78.2 | -168.4 | -72.6 | -90 | -1.3 | 112.1 | E63 L69 T70 E71 | E63-R67 PolarHBondContact O-N 3.41Å; E63-R67 IonicContact OE1-CZ 2.86Å; E63-R67 IonicContact OE1-NH1 2.76Å; E63-R67 PolarHBondContact OE1-NH1 2.93Å; E63-R67 IonicContact OE2-NH1 3.07Å; R67-L69 VanDerWaalsContact C-N 3.32Å; R67-L69 PolarHBondContact O-N 3.13Å; R67-T70 PolarHBondContact O-N 3.23Å; R67-E71 WeakPolarHBondContact O-CG 3.35Å; R67-E71 PolarHBondContact O-N 3.01Å |
| 68 | K | 96.9 | Very high | 95.8 | Very high | 96 Ų | 96 | 92.3 Ų | 92.3 | 42% | 0.417 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -66.1 | -37.9 | -177.1 | -170.9 | 61.9 | -170.4 | 167.1 | 0 | 112.2 | R64 L65 G66 E71 L72 | R64-K68 PolarHBondContact O-N 2.93Å; L65-K68 PolarHBondContact O-N 2.05Å; G66-K68 VanDerWaalsContact C-N 3.3Å; G66-K68 PolarHBondContact O-N 3.26Å; K68-E71 WeakPolarHBondContact CD-OE2 3.24Å; K68-E71 IonicContact NZ-OE2 3.26Å; K68-E71 PolarHBondContact NZ-OE2 2.85Å; K68-E71 PolarHBondContact O-N 3.18Å; K68-L72 HydrophobicContact CG-CD1 4.38Å; K68-L72 VanDerWaalsContact O-CG 3.3Å; K68-L72 WeakPolarHBondContact O-CG 3.47Å; K68-L72 PolarHBondContact O-N 3.4Å; K68-L72 VanDerWaalsContact O-N 3.1Å |
| 69 | L | 96.5 | Very high | 95.4 | Very high | 113 Ų | 113 | 94.8 Ų | 94.8 | 59% | 0.592 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -63.3 | -45.5 | 176.2 | -174.8 | 61.5 | 0 | 0 | 0 | 110.9 | L65 G66 R67 E71 L72 S73 | L65-L69 WeakPolarHBondContact O-CB 3.31Å; L65-L69 PolarHBondContact O-N 3.33Å; G66-L69 PolarHBondContact O-N 3.19Å; R67-L69 VanDerWaalsContact C-N 3.32Å; R67-L69 PolarHBondContact O-N 3.13Å; L69-E71 PolarHBondContact O-N 2.86Å; L69-L72 PolarHBondContact O-N 3.2Å; L69-S73 PolarHBondContact O-N 2.93Å; L69-S73 PolarHBondContact O-OG 2.05Å; L69-S73 VanDerWaalsContact O-OG 3.11Å |
| 70 | T | 95.6 | Very high | 95 | Very high | 92 Ų | 92 | 97.6 Ų | 97.6 | 56% | 0.564 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -60.2 | -43.8 | 175.9 | -55 | 0 | 0 | 0 | 0 | 112.3 | G66 R67 L72 S73 V74 | G66-T70 PolarHBondContact O-N 3.35Å; G66-T70 PolarHBondContact O-OG1 3.43Å; R67-T70 PolarHBondContact O-N 3.23Å; T70-L72 VanDerWaalsContact C-N 3.3Å; T70-L72 PolarHBondContact O-N 3.43Å; T70-S73 PolarHBondContact O-N 3.15Å; T70-V74 WeakPolarHBondContact O-CG2 3.27Å; T70-V74 PolarHBondContact O-N 2.99Å; T70-V74 VanDerWaalsContact O-N 3.08Å |
| 71 | E | 96.1 | Very high | 94.7 | Very high | 92 Ų | 92 | 103.3 Ų | 103.3 | 43% | 0.43 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -56.5 | -44.8 | 175.1 | -74 | 171.9 | -164.1 | 0 | 0 | 111.9 | R67 K68 L69 Q75 | R67-E71 WeakPolarHBondContact O-CG 3.35Å; R67-E71 PolarHBondContact O-N 3.01Å; K68-E71 WeakPolarHBondContact CD-OE2 3.24Å; K68-E71 IonicContact NZ-OE2 3.26Å; K68-E71 PolarHBondContact NZ-OE2 2.85Å; K68-E71 PolarHBondContact O-N 3.18Å; L69-E71 PolarHBondContact O-N 2.86Å; E71-Q75 VanDerWaalsContact O-CG 3.27Å; E71-Q75 WeakPolarHBondContact O-CG 3.23Å; E71-Q75 PolarHBondContact O-N 2.76Å; E71-Q75 VanDerWaalsContact O-N 3.11Å |
| 72 | L | 95.6 | Very high | 94.2 | Very high | 73 Ų | 73 | 104.7 Ų | 104.7 | 38% | 0.382 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -67.4 | -41.9 | 179.6 | -68.5 | 170.9 | 0 | 0 | 0 | 111.5 | K68 L69 T70 V74 Q75 D76 | K68-L72 HydrophobicContact CG-CD1 4.38Å; K68-L72 VanDerWaalsContact O-CG 3.3Å; K68-L72 WeakPolarHBondContact O-CG 3.47Å; K68-L72 PolarHBondContact O-N 3.4Å; K68-L72 VanDerWaalsContact O-N 3.1Å; L69-L72 PolarHBondContact O-N 3.2Å; T70-L72 VanDerWaalsContact C-N 3.3Å; T70-L72 PolarHBondContact O-N 3.43Å; L72-V74 VanDerWaalsContact C-N 3.34Å; L72-V74 PolarHBondContact O-N 2.87Å; L72-Q75 WeakPolarHBondContact O-CB 3.41Å; L72-Q75 PolarHBondContact O-N 3.06Å; L72-D76 PolarHBondContact O-N 2.9Å |
| 73 | S | 94.8 | Very high | 93.7 | Very high | 53 Ų | 53 | 105 Ų | 105 | 37% | 0.371 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -59.2 | -43.5 | 176.8 | -61.9 | 0 | 0 | 0 | 0 | 112.5 | L69 T70 D76 E77 | L69-S73 PolarHBondContact O-N 2.93Å; L69-S73 PolarHBondContact O-OG 2.05Å; L69-S73 VanDerWaalsContact O-OG 3.11Å; T70-S73 PolarHBondContact O-N 3.15Å; S73-D76 PolarHBondContact O-N 2.98Å; S73-E77 WeakPolarHBondContact O-CG 3.3Å; S73-E77 PolarHBondContact O-N 3.44Å |
| 74 | V | 94 | Very high | 93 | Very high | 70 Ų | 70 | 104 Ų | 104 | 42% | 0.424 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -64.9 | -41.9 | 176.4 | 174 | 0 | 0 | 0 | 0 | 111.1 | T70 L72 D76 E77 E78 | T70-V74 WeakPolarHBondContact O-CG2 3.27Å; T70-V74 PolarHBondContact O-N 2.99Å; T70-V74 VanDerWaalsContact O-N 3.08Å; L72-V74 VanDerWaalsContact C-N 3.34Å; L72-V74 PolarHBondContact O-N 2.87Å; V74-D76 PolarHBondContact O-N 3.44Å; V74-E77 PolarHBondContact O-N 3.02Å; V74-E78 WeakPolarHBondContact O-CG 3.39Å; V74-E78 PolarHBondContact O-N 3.07Å |
| 75 | Q | 92.5 | Very high | 92.2 | Very high | 102 Ų | 102 | 103.3 Ų | 103.3 | 48% | 0.477 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -62.4 | -41.7 | 177 | -74.1 | 175 | -1.9 | 0 | 0 | 112.2 | E71 L72 E78 M79 | E71-Q75 VanDerWaalsContact O-CG 3.27Å; E71-Q75 WeakPolarHBondContact O-CG 3.23Å; E71-Q75 PolarHBondContact O-N 2.76Å; E71-Q75 VanDerWaalsContact O-N 3.11Å; L72-Q75 WeakPolarHBondContact O-CB 3.41Å; L72-Q75 PolarHBondContact O-N 3.06Å; Q75-E78 PolarHBondContact O-N 2.8Å; Q75-M79 WeakPolarHBondContact O-CB 3.41Å; Q75-M79 PolarHBondContact O-N 2.71Å |
| 76 | D | 92.3 | Very high | 90.6 | Very high | 93 Ų | 93 | 100.6 Ų | 100.6 | 50% | 0.497 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -65.3 | -44 | 177.8 | -73.3 | -15.6 | 0 | 0 | 0 | 111.1 | L72 S73 V74 E78 M79 M80 | L72-D76 PolarHBondContact O-N 2.9Å; S73-D76 PolarHBondContact O-N 2.98Å; V74-D76 PolarHBondContact O-N 3.44Å; D76-E78 PolarHBondContact O-N 3.26Å; D76-M79 PolarHBondContact O-N 2.76Å; D76-M80 WeakPolarHBondContact O-CB 3.28Å; D76-M80 WeakPolarHBondContact O-CG 3.3Å; D76-M80 PolarHBondContact O-N 3.01Å |
| 77 | E | 91.9 | Very high | 88.5 | Confident | 135 Ų | 135 | 111.1 Ų | 111.1 | 63% | 0.631 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -60.8 | -43.8 | 175 | -74.6 | 177.9 | -176.5 | 0 | 0 | 112.2 | S73 V74 M80 R81 | S73-E77 WeakPolarHBondContact O-CG 3.3Å; S73-E77 PolarHBondContact O-N 3.44Å; V74-E77 PolarHBondContact O-N 3.02Å; E77-M80 PolarHBondContact O-N 3.39Å; E77-R81 WeakPolarHBondContact O-CB 3.44Å; E77-R81 PolarHBondContact O-N 2.89Å |
| 78 | E | 91.3 | Very high | 88.1 | Confident | 102 Ų | 102 | 110.7 Ų | 110.7 | 48% | 0.477 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -63.8 | -41.8 | 175.6 | -76.7 | -172.7 | -179.3 | 0 | 0 | 112.3 | V74 Q75 D76 R81 K82 | V74-E78 WeakPolarHBondContact O-CG 3.39Å; V74-E78 PolarHBondContact O-N 3.07Å; Q75-E78 PolarHBondContact O-N 2.8Å; D76-E78 PolarHBondContact O-N 3.26Å; E78-R81 PolarHBondContact O-N 3.24Å; E78-K82 VanDerWaalsContact O-CG 3.3Å; E78-K82 WeakPolarHBondContact O-CG 3.3Å; E78-K82 PolarHBondContact O-N 3.05Å |
| 79 | M | 90.9 | Very high | 87.6 | Confident | 109 Ų | 109 | 111.5 Ų | 111.5 | 54% | 0.537 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -63.8 | -46 | 177.4 | -172.3 | -176.1 | -59.4 | 0 | 0 | 110.7 | Q75 D76 R81 K82 N83 | Q75-M79 WeakPolarHBondContact O-CB 3.41Å; Q75-M79 PolarHBondContact O-N 2.71Å; D76-M79 PolarHBondContact O-N 2.76Å; M79-R81 VanDerWaalsContact C-N 3.34Å; M79-R81 PolarHBondContact O-N 3.25Å; M79-K82 PolarHBondContact O-N 3.49Å; M79-N83 PolarHBondContact O-N 3.4Å; M79-N83 PolarHBondContact O-ND2 3.03Å; M79-N83 PolarHBondContact O-OD1 3.07Å |
| 80 | M | 89.6 | Confident | 87.1 | Confident | 135 Ų | 135 | 111.4 Ų | 111.4 | 67% | 0.665 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -61.8 | -42.1 | 177.3 | -70.8 | -69.6 | -81.9 | 0 | 0 | 111.5 | D76 E77 N83 A84 | D76-M80 WeakPolarHBondContact O-CB 3.28Å; D76-M80 WeakPolarHBondContact O-CG 3.3Å; D76-M80 PolarHBondContact O-N 3.01Å; E77-M80 PolarHBondContact O-N 3.39Å; M80-N83 PolarHBondContact O-N 3.17Å; M80-A84 WeakPolarHBondContact O-CB 3.32Å; M80-A84 PolarHBondContact O-N 2.9Å |
| 81 | R | 91.2 | Very high | 86.6 | Confident | 184 Ų | 184 | 112.5 Ų | 112.5 | 69% | 0.694 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -63.2 | -42 | 175.1 | 179.5 | 178.7 | 154.4 | -176.3 | -6 | 112.1 | E77 E78 M79 N83 A84 I85 | E77-R81 WeakPolarHBondContact O-CB 3.44Å; E77-R81 PolarHBondContact O-N 2.89Å; E78-R81 PolarHBondContact O-N 3.24Å; M79-R81 VanDerWaalsContact C-N 3.34Å; M79-R81 PolarHBondContact O-N 3.25Å; R81-N83 VanDerWaalsContact C-N 3.35Å; R81-A84 PolarHBondContact O-N 2.87Å; R81-I85 HydrophobicContact CG-CD1 3.85Å; R81-I85 WeakPolarHBondContact O-CD1 3.24Å; R81-I85 VanDerWaalsContact O-CG1 3.27Å; R81-I85 WeakPolarHBondContact O-CG1 3.45Å; R81-I85 PolarHBondContact O-N 3.36Å |
| 82 | K | 87.8 | Confident | 86 | Confident | 141 Ų | 141 | 113.8 Ų | 113.8 | 61% | 0.613 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -62.9 | -42 | 175.5 | -73.9 | 170.2 | -172.9 | 168.1 | 0 | 111.4 | E78 M79 A84 I85 G86 | E78-K82 VanDerWaalsContact O-CG 3.3Å; E78-K82 WeakPolarHBondContact O-CG 3.3Å; E78-K82 PolarHBondContact O-N 3.05Å; M79-K82 PolarHBondContact O-N 3.49Å; K82-A84 VanDerWaalsContact C-N 3.32Å; K82-A84 PolarHBondContact O-N 3.47Å; K82-I85 PolarHBondContact O-N 3.1Å; K82-G86 PolarHBondContact O-N 3.29Å |
| 83 | N | 86.5 | Confident | 85.4 | Confident | 101 Ų | 101 | 116.5 Ų | 116.5 | 54% | 0.54 | 61% | 0.605 | S | S | . | * | H | α-helix | trans | -65.3 | -35.1 | 177.4 | -66.9 | -13.5 | 0 | 0 | 0 | 112.3 | M79 M80 R81 G86 | M79-N83 PolarHBondContact O-N 3.4Å; M79-N83 PolarHBondContact O-ND2 3.03Å; M79-N83 PolarHBondContact O-OD1 3.07Å; M80-N83 PolarHBondContact O-N 3.17Å; R81-N83 VanDerWaalsContact C-N 3.35Å; N83-G86 PolarHBondContact O-N 3.39Å |
| 84 | A | 83.1 | Confident | 84.7 | Confident | 84 Ų | 84 | 121.1 Ų | 121.1 | 69% | 0.694 | 62% | 0.622 | S | S | * | * | H | α-helix | trans | -73.3 | -24.3 | 177.8 | 0 | 0 | 0 | 0 | 0 | 113.9 | M80 R81 K82 | M80-A84 WeakPolarHBondContact O-CB 3.32Å; M80-A84 PolarHBondContact O-N 2.9Å; R81-A84 PolarHBondContact O-N 2.87Å; K82-A84 VanDerWaalsContact C-N 3.32Å; K82-A84 PolarHBondContact O-N 3.47Å |
| 85 | I | 79.8 | Confident | 84 | Confident | 124 Ų | 124 | 125 Ų | 125 | 64% | 0.636 | 64% | 0.637 | S | S | * | * | H | α-helix | trans | -87.8 | -12.2 | 177.8 | -62.7 | 164.7 | 0 | 0 | 0 | 111.2 | R81 K82 | R81-I85 HydrophobicContact CG-CD1 3.85Å; R81-I85 WeakPolarHBondContact O-CD1 3.24Å; R81-I85 VanDerWaalsContact O-CG1 3.27Å; R81-I85 WeakPolarHBondContact O-CG1 3.45Å; R81-I85 PolarHBondContact O-N 3.36Å; K82-I85 PolarHBondContact O-N 3.1Å |
| 86 | G | 64.6 | Low | 83.3 | Confident | 62 Ų | 62 | 126.9 Ų | 126.9 | 64% | 0.639 | 65% | 0.65 | S | S | * | * | trans | -92.8 | 23.9 | -173.5 | 0 | 0 | 0 | 0 | 0 | 117.3 | K82 N83 | K82-G86 PolarHBondContact O-N 3.29Å; N83-G86 PolarHBondContact O-N 3.39Å | ||
| 87 | Q | 50.9 | Low | 82.5 | Confident | 253 Ų | 253 | 130 Ų | 130 | 100% | 1.182 | 66% | 0.664 | S | S | * | * | trans | -125.3 | 0 | 169.8 | -71.6 | -174.2 | 18.9 | 0 | 0 | 111.6 |
Retrieved 87 of 87 residues in 62.8 ms
(Link to these results)