| 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 | 43.2 | Very low | 43.3 | Very low | 240 Ų | 240 | 109 Ų | 109 | 100% | 1.182 | 55% | 0.554 | S | S | * | * | 0 | 111.9 | 0 | -66.2 | 176 | -151.6 | 0 | 0 | 107.1 | S3 | M1-S3 PolarHBondContact O-N 2.85Š| |||
| 2 | V | 39 | Very low | 44.1 | Very low | 97 Ų | 97 | 104.3 Ų | 104.3 | 59% | 0.588 | 53% | 0.53 | S | S | * | . | trans | -63.1 | 119.3 | 170.4 | 177 | 0 | 0 | 0 | 0 | 105.9 | K4 I6 | V2-K4 PolarHBondContact O-N 2.69Å; V2-I6 HydrophobicContact CG1-CB 3.66Å; V2-I6 HydrophobicContact CG1-CD1 3.93Å; V2-I6 HydrophobicContact CG1-CG1 4.36Å; V2-I6 HydrophobicContact CG1-CG2 3.69Å | ||
| 3 | S | 39.6 | Very low | 44.6 | Very low | 56 Ų | 56 | 102.4 Ų | 102.4 | 39% | 0.392 | 52% | 0.518 | S | S | . | . | trans | -60.3 | 136.6 | -176.2 | -177.6 | 0 | 0 | 0 | 0 | 108.7 | M1 H5 I6 | M1-S3 PolarHBondContact O-N 2.85Å; S3-H5 PolarHBondContact O-N 3.31Å; S3-H5 PolarHBondContact OG-ND1 3.1Å; S3-I6 WeakPolarHBondContact O-CB 3.3Å; S3-I6 PolarHBondContact O-N 3.44Å | ||
| 4 | K | 39.1 | Very low | 44.9 | Very low | 174 Ų | 174 | 100.8 Ų | 100.8 | 76% | 0.757 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -49.6 | -21 | 174.2 | -65.6 | -174.8 | 175.3 | -173.9 | 0 | 113.2 | V2 L8 | V2-K4 PolarHBondContact O-N 2.69Å; K4-L8 PolarHBondContact O-N 3.19Å |
| 5 | H | 38.2 | Very low | 45.3 | Very low | 101 Ų | 101 | 98.2 Ų | 98.2 | 47% | 0.468 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -65 | -37.3 | 172 | -61.6 | 83.4 | 0 | 0 | 0 | 113.6 | S3 L9 | S3-H5 PolarHBondContact O-N 3.31Å; S3-H5 PolarHBondContact OG-ND1 3.1Å; H5-L9 VanDerWaalsContact O-CG 3.3Å; H5-L9 WeakPolarHBondContact O-CG 3.39Å; H5-L9 PolarHBondContact O-N 3.48Å |
| 6 | I | 42.3 | Very low | 45.7 | Very low | 83 Ų | 83 | 101.6 Ų | 101.6 | 43% | 0.426 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -71.2 | -41.3 | 178.6 | -64.8 | 169.8 | 0 | 0 | 0 | 110.3 | V2 S3 L8 L9 L10 | V2-I6 HydrophobicContact CG1-CB 3.66Å; V2-I6 HydrophobicContact CG1-CD1 3.93Å; V2-I6 HydrophobicContact CG1-CG1 4.36Å; V2-I6 HydrophobicContact CG1-CG2 3.69Å; S3-I6 WeakPolarHBondContact O-CB 3.3Å; S3-I6 PolarHBondContact O-N 3.44Å; I6-L8 VanDerWaalsContact C-N 3.32Å; I6-L8 PolarHBondContact O-N 2.88Å; I6-L9 PolarHBondContact O-N 2.75Å; I6-L10 HydrophobicContact CG2-CD1 3.89Å; I6-L10 HydrophobicContact CG2-CG 4.45Å; I6-L10 WeakPolarHBondContact O-CB 3.34Å; I6-L10 WeakPolarHBondContact O-CG 3.45Å; I6-L10 PolarHBondContact O-N 2.9Å |
| 7 | E | 43.4 | Very low | 45.5 | Very low | 120 Ų | 120 | 100.8 Ų | 100.8 | 56% | 0.561 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -61.4 | -41 | 176.4 | -69.5 | 175.2 | 169.4 | 0 | 0 | 111.7 | L10 L11 | E7-L10 PolarHBondContact O-N 2.74Å; E7-L11 PolarHBondContact O-N 3.22Å |
| 8 | L | 44.7 | Very low | 45.4 | Very low | 40 Ų | 40 | 98.3 Ų | 98.3 | 21% | 0.209 | 50% | 0.502 | C | S | . | . | H | α-helix | trans | -67.4 | -42.4 | 176 | 179.5 | 72.8 | 0 | 0 | 0 | 112.9 | K4 I6 L10 L11 L12 L42 | K4-L8 PolarHBondContact O-N 3.19Å; I6-L8 VanDerWaalsContact C-N 3.32Å; I6-L8 PolarHBondContact O-N 2.88Å; L8-L10 VanDerWaalsContact C-N 3.32Å; L8-L11 PolarHBondContact O-N 2.7Å; L8-L12 HydrophobicContact CG-CD1 4.35Å; L8-L12 WeakPolarHBondContact O-CG 3.49Å; L8-L12 PolarHBondContact O-N 2.97Å; L8-L42 HydrophobicContact CD1-CD1 4.19Å; L8-L42 HydrophobicContact CD1-CD2 3.3Å; L8-L42 HydrophobicContact CD1-CG 3.93Å; L8-L42 HydrophobicContact CD2-CD2 3.15Å; L8-L42 HydrophobicContact CG-CD2 3.78Å |
| 9 | L | 48 | Very low | 45.1 | Very low | 110 Ų | 110 | 97.3 Ų | 97.3 | 58% | 0.576 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -65 | -38.6 | 176.1 | -74.9 | 169.4 | 0 | 0 | 0 | 111.2 | H5 I6 L12 E13 | H5-L9 VanDerWaalsContact O-CG 3.3Å; H5-L9 WeakPolarHBondContact O-CG 3.39Å; H5-L9 PolarHBondContact O-N 3.48Å; I6-L9 PolarHBondContact O-N 2.75Å; L9-L12 PolarHBondContact O-N 3.32Å; L9-E13 VanDerWaalsContact O-CB 3.29Å; L9-E13 WeakPolarHBondContact O-CB 3.48Å; L9-E13 PolarHBondContact O-N 2.83Å |
| 10 | L | 47 | Very low | 45.1 | Very low | 103 Ų | 103 | 97.7 Ų | 97.7 | 54% | 0.539 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -62 | -43.5 | 172 | -78.9 | 163.6 | 0 | 0 | 0 | 111.3 | I6 E7 L8 E13 V14 | I6-L10 HydrophobicContact CG2-CD1 3.89Å; I6-L10 HydrophobicContact CG2-CG 4.45Å; I6-L10 WeakPolarHBondContact O-CB 3.34Å; I6-L10 WeakPolarHBondContact O-CG 3.45Å; I6-L10 PolarHBondContact O-N 2.9Å; E7-L10 PolarHBondContact O-N 2.74Å; L8-L10 VanDerWaalsContact C-N 3.32Å; L10-E13 PolarHBondContact O-N 3.35Å; L10-V14 WeakPolarHBondContact O-CB 3.35Å; L10-V14 WeakPolarHBondContact O-CG2 3.45Å; L10-V14 PolarHBondContact O-N 2.58Å |
| 11 | L | 52.3 | Low | 44.7 | Very low | 75 Ų | 75 | 99.9 Ų | 99.9 | 39% | 0.393 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -62.6 | -45.9 | 177.1 | -170.8 | 72.7 | 0 | 0 | 0 | 111.5 | E7 L8 E13 V14 M15 A38 | E7-L11 PolarHBondContact O-N 3.22Å; L8-L11 PolarHBondContact O-N 2.7Å; L11-E13 VanDerWaalsContact C-N 3.31Å; L11-E13 PolarHBondContact O-N 3.15Å; L11-V14 PolarHBondContact O-N 3.34Å; L11-M15 WeakPolarHBondContact O-CB 3.37Å; L11-M15 VanDerWaalsContact O-CG 3.28Å; L11-M15 WeakPolarHBondContact O-CG 3.5Å; L11-M15 PolarHBondContact O-N 3.5Å; L11-A38 HydrophobicContact CD2-CB 4.45Å |
| 12 | L | 51.9 | Low | 44.5 | Very low | 52 Ų | 52 | 97 Ų | 97 | 27% | 0.272 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -64.1 | -35.6 | 176.8 | -71.3 | 170.9 | 0 | 0 | 0 | 112.4 | L8 L9 R16 L50 | L8-L12 HydrophobicContact CG-CD1 4.35Å; L8-L12 WeakPolarHBondContact O-CG 3.49Å; L8-L12 PolarHBondContact O-N 2.97Å; L9-L12 PolarHBondContact O-N 3.32Å; L12-R16 VanDerWaalsContact O-CB 3.3Å; L12-R16 WeakPolarHBondContact O-CB 3.17Å; L12-R16 PolarHBondContact O-N 3.44Å; L12-L50 HydrophobicContact CD2-CD2 4.42Å |
| 13 | E | 50.6 | Low | 44.5 | Very low | 80 Ų | 80 | 94.7 Ų | 94.7 | 37% | 0.374 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -72.8 | -40.2 | 175.9 | -172.8 | 60.8 | -162.6 | 0 | 0 | 111.6 | L9 L10 L11 M15 R16 T17 | L9-E13 VanDerWaalsContact O-CB 3.29Å; L9-E13 WeakPolarHBondContact O-CB 3.48Å; L9-E13 PolarHBondContact O-N 2.83Å; L10-E13 PolarHBondContact O-N 3.35Å; L11-E13 VanDerWaalsContact C-N 3.31Å; L11-E13 PolarHBondContact O-N 3.15Å; E13-M15 VanDerWaalsContact C-N 3.33Å; E13-M15 PolarHBondContact O-N 2.92Å; E13-R16 VanDerWaalsContact CD-NE 3.32Å; E13-R16 WeakPolarHBondContact O-CB 3.29Å; E13-R16 PolarHBondContact O-N 3.3Å; E13-R16 VanDerWaalsContact O-N 3.15Å; E13-R16 IonicContact OE1-CZ 3.31Å; E13-R16 VanDerWaalsContact OE1-CZ 3.31Å; E13-R16 IonicContact OE1-NE 3.1Å; E13-R16 PolarHBondContact OE1-NE 3.45Å; E13-R16 VanDerWaalsContact OE1-NE 3.1Å; E13-R16 IonicContact OE1-NH2 2.69Å; E13-R16 PolarHBondContact OE1-NH2 3.28Å; E13-R16 IonicContact OE2-CZ 3.73Å; E13-R16 IonicContact OE2-NE 2.85Å; E13-R16 PolarHBondContact OE2-NE 2.95Å; E13-R16 IonicContact OE2-NH2 3.77Å; E13-T17 HydrophobicContact CG-CG2 4.33Å; E13-T17 WeakPolarHBondContact O-CB 3.22Å; E13-T17 WeakPolarHBondContact O-CG2 3.38Å; E13-T17 PolarHBondContact O-N 2.92Å; E13-T17 PolarHBondContact O-OG1 3.26Å; E13-T17 WeakPolarHBondContact OE1-CG2 3.37Å |
| 14 | V | 49.9 | Very low | 44.4 | Very low | 80 Ų | 80 | 97.9 Ų | 97.9 | 49% | 0.485 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -59.2 | -46.8 | 170.9 | 169.4 | 0 | 0 | 0 | 0 | 109.2 | L10 L11 R16 T17 S18 | L10-V14 WeakPolarHBondContact O-CB 3.35Å; L10-V14 WeakPolarHBondContact O-CG2 3.45Å; L10-V14 PolarHBondContact O-N 2.58Å; L11-V14 PolarHBondContact O-N 3.34Å; V14-R16 VanDerWaalsContact C-N 3.29Å; V14-R16 PolarHBondContact O-N 2.89Å; V14-T17 WeakPolarHBondContact CA-OG1 3.49Å; V14-T17 PolarHBondContact O-N 3.45Å; V14-T17 PolarHBondContact O-OG1 2.84Å; V14-S18 WeakPolarHBondContact O-CA 3.3Å; V14-S18 WeakPolarHBondContact O-CB 3.47Å; V14-S18 PolarHBondContact O-N 3.15Å; V14-S18 PolarHBondContact O-OG 2.78Å |
| 15 | M | 51.2 | Low | 44.5 | Very low | 62 Ų | 62 | 98.4 Ų | 98.4 | 31% | 0.305 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -65.7 | -28.5 | 175.6 | -69.4 | -169.4 | 70.9 | 0 | 0 | 114 | L11 E13 S18 I20 L35 | L11-M15 WeakPolarHBondContact O-CB 3.37Å; L11-M15 VanDerWaalsContact O-CG 3.28Å; L11-M15 WeakPolarHBondContact O-CG 3.5Å; L11-M15 PolarHBondContact O-N 3.5Å; E13-M15 VanDerWaalsContact C-N 3.33Å; E13-M15 PolarHBondContact O-N 2.92Å; M15-S18 VanDerWaalsContact O-O 3.11Å; M15-I20 HydrophobicContact CE-CD1 4.15Å; M15-L35 HydrophobicContact CE-CD1 3.19Å; M15-L35 HydrophobicContact SD-CD1 3.77Å |
| 16 | R | 51.4 | Low | 44.7 | Very low | 152 Ų | 152 | 101 Ų | 101 | 57% | 0.574 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -75.1 | -37.9 | 175.9 | -172.4 | -173.9 | 83 | 89.4 | 1.1 | 112.1 | L12 E13 V14 | L12-R16 VanDerWaalsContact O-CB 3.3Å; L12-R16 WeakPolarHBondContact O-CB 3.17Å; L12-R16 PolarHBondContact O-N 3.44Å; E13-R16 VanDerWaalsContact CD-NE 3.32Å; E13-R16 WeakPolarHBondContact O-CB 3.29Å; E13-R16 PolarHBondContact O-N 3.3Å; E13-R16 VanDerWaalsContact O-N 3.15Å; E13-R16 IonicContact OE1-CZ 3.31Å; E13-R16 VanDerWaalsContact OE1-CZ 3.31Å; E13-R16 IonicContact OE1-NE 3.1Å; E13-R16 PolarHBondContact OE1-NE 3.45Å; E13-R16 VanDerWaalsContact OE1-NE 3.1Å; E13-R16 IonicContact OE1-NH2 2.69Å; E13-R16 PolarHBondContact OE1-NH2 3.28Å; E13-R16 IonicContact OE2-CZ 3.73Å; E13-R16 IonicContact OE2-NE 2.85Å; E13-R16 PolarHBondContact OE2-NE 2.95Å; E13-R16 IonicContact OE2-NH2 3.77Å; V14-R16 VanDerWaalsContact C-N 3.29Å; V14-R16 PolarHBondContact O-N 2.89Å |
| 17 | T | 42.4 | Very low | 44.6 | Very low | 88 Ų | 88 | 102.8 Ų | 102.8 | 54% | 0.54 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -89.7 | -26.8 | -175.9 | 51.5 | 0 | 0 | 0 | 0 | 112.6 | E13 V14 S19 | E13-T17 HydrophobicContact CG-CG2 4.33Å; E13-T17 WeakPolarHBondContact O-CB 3.22Å; E13-T17 WeakPolarHBondContact O-CG2 3.38Å; E13-T17 PolarHBondContact O-N 2.92Å; E13-T17 PolarHBondContact O-OG1 3.26Å; E13-T17 WeakPolarHBondContact OE1-CG2 3.37Å; V14-T17 WeakPolarHBondContact CA-OG1 3.49Å; V14-T17 PolarHBondContact O-N 3.45Å; V14-T17 PolarHBondContact O-OG1 2.84Å; T17-S19 VanDerWaalsContact C-N 3.31Å; T17-S19 PolarHBondContact O-N 3.05Å |
| 18 | S | 42.3 | Very low | 44.5 | Very low | 57 Ų | 57 | 98.3 Ų | 98.3 | 40% | 0.399 | 51% | 0.511 | S | S | . | . | S | Bend | trans | -62.9 | 101 | 158.2 | -51 | 0 | 0 | 0 | 0 | 105.3 | V14 M15 I20 | V14-S18 WeakPolarHBondContact O-CA 3.3Å; V14-S18 WeakPolarHBondContact O-CB 3.47Å; V14-S18 PolarHBondContact O-N 3.15Å; V14-S18 PolarHBondContact O-OG 2.78Å; M15-S18 VanDerWaalsContact O-O 3.11Å; S18-I20 PolarHBondContact O-N 2.93Å |
| 19 | S | 40.8 | Very low | 44.3 | Very low | 78 Ų | 78 | 100.8 Ų | 100.8 | 55% | 0.545 | 53% | 0.525 | S | S | . | . | trans | -55.6 | 97.8 | 155.8 | 49.7 | 0 | 0 | 0 | 0 | 105.3 | T17 E21 | T17-S19 VanDerWaalsContact C-N 3.31Å; T17-S19 PolarHBondContact O-N 3.05Å; S19-E21 PolarHBondContact O-N 3.19Å | ||
| 20 | I | 44.8 | Very low | 44 | Very low | 105 Ų | 105 | 102 Ų | 102 | 54% | 0.538 | 53% | 0.526 | S | S | . | . | trans | -69.7 | 63.9 | 168.5 | -53.8 | -179.9 | 0 | 0 | 0 | 105.6 | M15 S18 V23 | M15-I20 HydrophobicContact CE-CD1 4.15Å; S18-I20 PolarHBondContact O-N 2.93Å; I20-V23 HydrophobicContact CG2-CG2 3.33Å | ||
| 21 | E | 36.5 | Very low | 44.1 | Very low | 144 Ų | 144 | 100.5 Ų | 100.5 | 67% | 0.673 | 52% | 0.518 | S | S | * | . | trans | -86.6 | 103.2 | 174 | -84.5 | 173 | -174.4 | 0 | 0 | 103.9 | S19 | S19-E21 PolarHBondContact O-N 3.19Š| ||
| 22 | H | 39 | Very low | 44 | Very low | 180 Ų | 180 | 101.3 Ų | 101.3 | 83% | 0.833 | 52% | 0.522 | S | S | * | . | trans | 65.4 | 78.3 | 170.9 | -54 | -74.5 | 0 | 0 | 0 | 114.3 | D24 | H22-D24 PolarHBondContact O-N 3.44Š| ||
| 23 | V | 38.2 | Very low | 43.8 | Very low | 49 Ų | 49 | 101.6 Ų | 101.6 | 30% | 0.297 | 53% | 0.529 | S | S | . | . | trans | -71.3 | 114.4 | 155.7 | -164.2 | 0 | 0 | 0 | 0 | 106.7 | I20 E27 G28 N31 | I20-V23 HydrophobicContact CG2-CG2 3.33Å; V23-E27 HydrophobicContact CG1-CB 3.5Å; V23-E27 VanDerWaalsContact CG1-CB 3.5Å; V23-E27 WeakPolarHBondContact CG1-O 3.41Å; V23-G28 VanDerWaalsContact CG1-CA 3.43Å; V23-N31 WeakPolarHBondContact CG1-ND2 3.48Å | ||
| 24 | D | 38.5 | Very low | 43.7 | Very low | 122 Ų | 122 | 101.2 Ų | 101.2 | 65% | 0.652 | 53% | 0.528 | S | S | * | . | trans | -49.7 | 142.9 | 168.8 | -97.8 | -40.7 | 0 | 0 | 0 | 109.2 | H22 D26 E27 G28 | H22-D24 PolarHBondContact O-N 3.44Å; D24-D26 PolarHBondContact O-N 3.41Å; D24-E27 WeakPolarHBondContact O-CA 3.39Å; D24-E27 PolarHBondContact O-N 2.95Å; D24-G28 PolarHBondContact O-N 3.38Å | ||
| 25 | E | 40.2 | Very low | 43.9 | Very low | 185 Ų | 185 | 99.9 Ų | 99.9 | 86% | 0.864 | 52% | 0.518 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -54.3 | -23.7 | -172.6 | -67.4 | -174.3 | 154.1 | 0 | 0 | 113.3 | ||
| 26 | D | 44.3 | Very low | 43.9 | Very low | 157 Ų | 157 | 100.5 Ų | 100.5 | 84% | 0.84 | 52% | 0.523 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -87.4 | -21.8 | 176.7 | -66.5 | -37.7 | 0 | 0 | 0 | 114 | D24 | D24-D26 PolarHBondContact O-N 3.41Š|
| 27 | E | 40.3 | Very low | 43.9 | Very low | 119 Ų | 119 | 100.3 Ų | 100.3 | 56% | 0.556 | 53% | 0.526 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -91.5 | -14.5 | 174 | -70.5 | -164.5 | 164.4 | 0 | 0 | 112.7 | V23 D24 D29 F30 N31 | V23-E27 HydrophobicContact CG1-CB 3.5Å; V23-E27 VanDerWaalsContact CG1-CB 3.5Å; V23-E27 WeakPolarHBondContact CG1-O 3.41Å; D24-E27 WeakPolarHBondContact O-CA 3.39Å; D24-E27 PolarHBondContact O-N 2.95Å; E27-D29 VanDerWaalsContact C-N 3.27Å; E27-D29 PolarHBondContact O-N 3.35Å; E27-F30 PolarHBondContact O-N 3.17Å; E27-F30 VanDerWaalsContact O-N 3.12Å; E27-N31 PolarHBondContact O-N 3.49Å; E27-N31 VanDerWaalsContact O-N 3.16Å |
| 28 | G | 40.7 | Very low | 44.3 | Very low | 26 Ų | 26 | 97.4 Ų | 97.4 | 27% | 0.268 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -57.1 | -40.9 | -179.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | V23 D24 L32 | V23-G28 VanDerWaalsContact CG1-CA 3.43Å; D24-G28 PolarHBondContact O-N 3.38Å; G28-L32 VanDerWaalsContact O-CB 3.25Å; G28-L32 WeakPolarHBondContact O-CB 3.44Å; G28-L32 PolarHBondContact O-N 3.35Å; G28-L32 VanDerWaalsContact O-N 3.07Å |
| 29 | D | 41.1 | Very low | 44.8 | Very low | 92 Ų | 92 | 96.9 Ų | 96.9 | 49% | 0.492 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -68.2 | -34.3 | 179.2 | -78.6 | -9.7 | 0 | 0 | 0 | 112.2 | E27 S33 | E27-D29 VanDerWaalsContact C-N 3.27Å; E27-D29 PolarHBondContact O-N 3.35Å; D29-S33 VanDerWaalsContact O-CB 3.25Å; D29-S33 WeakPolarHBondContact O-CB 3.46Å; D29-S33 PolarHBondContact O-N 3.49Å; D29-S33 PolarHBondContact O-OG 2.77Å |
| 30 | F | 39.9 | Very low | 45.4 | Very low | 137 Ų | 137 | 99 Ų | 99 | 60% | 0.601 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -72.9 | -46.6 | -179.6 | -170.9 | -106.6 | 0 | 0 | 0 | 111.5 | E27 L32 S33 I34 | E27-F30 PolarHBondContact O-N 3.17Å; E27-F30 VanDerWaalsContact O-N 3.12Å; F30-L32 VanDerWaalsContact C-N 3.33Å; F30-L32 PolarHBondContact O-N 3.16Å; F30-S33 WeakPolarHBondContact CA-OG 3.1Å; F30-S33 PolarHBondContact O-N 3.34Å; F30-S33 PolarHBondContact O-OG 3.31Å; F30-I34 HydrophobicContact CD1-CD1 3.66Å; F30-I34 HydrophobicContact CE1-CD1 3.3Å; F30-I34 HydrophobicContact CE1-CG1 4.45Å; F30-I34 HydrophobicContact CE2-CD1 4.39Å; F30-I34 HydrophobicContact CG-CD1 4.36Å; F30-I34 HydrophobicContact CZ-CD1 3.71Å; F30-I34 WeakPolarHBondContact O-CG1 3.28Å; F30-I34 PolarHBondContact O-N 3.5Å |
| 31 | N | 49.1 | Very low | 45.7 | Very low | 71 Ų | 71 | 99.1 Ų | 99.1 | 38% | 0.38 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -68 | -34.7 | 179 | -73.7 | -34.6 | 0 | 0 | 0 | 112.3 | V23 E27 L35 | V23-N31 WeakPolarHBondContact CG1-ND2 3.48Å; E27-N31 PolarHBondContact O-N 3.49Å; E27-N31 VanDerWaalsContact O-N 3.16Å; N31-L35 PolarHBondContact O-N 2.85Å; N31-L35 VanDerWaalsContact O-N 3.1Å |
| 32 | L | 50.6 | Low | 46.3 | Very low | 91 Ų | 91 | 92.7 Ų | 92.7 | 48% | 0.476 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -73.9 | -38 | 177 | -168.1 | 65.8 | 0 | 0 | 0 | 112.3 | G28 F30 L35 L36 | G28-L32 VanDerWaalsContact O-CB 3.25Å; G28-L32 WeakPolarHBondContact O-CB 3.44Å; G28-L32 PolarHBondContact O-N 3.35Å; G28-L32 VanDerWaalsContact O-N 3.07Å; F30-L32 VanDerWaalsContact C-N 3.33Å; F30-L32 PolarHBondContact O-N 3.16Å; L32-L35 HydrophobicContact CD1-CD2 4.35Å; L32-L35 WeakPolarHBondContact O-CB 3.48Å; L32-L35 PolarHBondContact O-N 3.02Å; L32-L36 HydrophobicContact CG-CD1 4.37Å; L32-L36 WeakPolarHBondContact O-CB 3.43Å; L32-L36 VanDerWaalsContact O-CG 3.28Å; L32-L36 WeakPolarHBondContact O-CG 3.3Å; L32-L36 PolarHBondContact O-N 3.28Å |
| 33 | S | 47.9 | Very low | 46.8 | Very low | 59 Ų | 59 | 87.6 Ų | 87.6 | 41% | 0.413 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -66.4 | -36.2 | 175.2 | 56.6 | 0 | 0 | 0 | 0 | 112.6 | D29 F30 L36 F37 | D29-S33 VanDerWaalsContact O-CB 3.25Å; D29-S33 WeakPolarHBondContact O-CB 3.46Å; D29-S33 PolarHBondContact O-N 3.49Å; D29-S33 PolarHBondContact O-OG 2.77Å; F30-S33 WeakPolarHBondContact CA-OG 3.1Å; F30-S33 PolarHBondContact O-N 3.34Å; F30-S33 PolarHBondContact O-OG 3.31Å; S33-L36 PolarHBondContact O-N 3.25Å; S33-F37 VanDerWaalsContact O-CB 3.26Å; S33-F37 WeakPolarHBondContact O-CB 3.34Å; S33-F37 PolarHBondContact O-N 2.88Å |
| 34 | I | 49.1 | Very low | 47.4 | Very low | 71 Ų | 71 | 89.7 Ų | 89.7 | 36% | 0.364 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -63.1 | -43.7 | 170.7 | -70.1 | 168.3 | 0 | 0 | 0 | 110.7 | F30 F37 A38 | F30-I34 HydrophobicContact CD1-CD1 3.66Å; F30-I34 HydrophobicContact CE1-CD1 3.3Å; F30-I34 HydrophobicContact CE1-CG1 4.45Å; F30-I34 HydrophobicContact CE2-CD1 4.39Å; F30-I34 HydrophobicContact CG-CD1 4.36Å; F30-I34 HydrophobicContact CZ-CD1 3.71Å; F30-I34 WeakPolarHBondContact O-CG1 3.28Å; F30-I34 PolarHBondContact O-N 3.5Å; I34-F37 PolarHBondContact O-N 2.69Å; I34-A38 VanDerWaalsContact O-CB 3.3Å; I34-A38 WeakPolarHBondContact O-CB 3.29Å; I34-A38 PolarHBondContact O-N 2.81Å |
| 35 | L | 53.7 | Low | 47.5 | Very low | 52 Ų | 52 | 89.2 Ų | 89.2 | 27% | 0.272 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -61 | -47.9 | 177.2 | -165.2 | 98.2 | 0 | 0 | 0 | 111 | M15 N31 L32 A38 M39 | M15-L35 HydrophobicContact CE-CD1 3.19Å; M15-L35 HydrophobicContact SD-CD1 3.77Å; N31-L35 PolarHBondContact O-N 2.85Å; N31-L35 VanDerWaalsContact O-N 3.1Å; L32-L35 HydrophobicContact CD1-CD2 4.35Å; L32-L35 WeakPolarHBondContact O-CB 3.48Å; L32-L35 PolarHBondContact O-N 3.02Å; L35-A38 WeakPolarHBondContact O-CB 3.49Å; L35-A38 PolarHBondContact O-N 3.24Å; L35-M39 VanDerWaalsContact O-CG 3.29Å; L35-M39 WeakPolarHBondContact O-CG 3.28Å; L35-M39 PolarHBondContact O-N 3.03Å |
| 36 | L | 51.2 | Low | 47.6 | Very low | 76 Ų | 76 | 80.5 Ų | 80.5 | 40% | 0.398 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -62.8 | -44.3 | 178.3 | -70.5 | 172.2 | 0 | 0 | 0 | 111.8 | L32 S33 A38 M39 D40 | L32-L36 HydrophobicContact CG-CD1 4.37Å; L32-L36 WeakPolarHBondContact O-CB 3.43Å; L32-L36 VanDerWaalsContact O-CG 3.28Å; L32-L36 WeakPolarHBondContact O-CG 3.3Å; L32-L36 PolarHBondContact O-N 3.28Å; S33-L36 PolarHBondContact O-N 3.25Å; L36-A38 VanDerWaalsContact C-N 3.3Å; L36-A38 PolarHBondContact O-N 3.42Å; L36-M39 HydrophobicContact CD2-CE 3.83Å; L36-M39 WeakPolarHBondContact O-CB 3.48Å; L36-M39 PolarHBondContact O-N 3.07Å; L36-M39 VanDerWaalsContact O-N 3.1Å; L36-D40 PolarHBondContact O-N 3.28Å |
| 37 | F | 51.2 | Low | 47.7 | Very low | 148 Ų | 148 | 77.9 Ų | 77.9 | 65% | 0.649 | 41% | 0.414 | S | S | * | . | H | α-helix | trans | -61.9 | -39 | 175.7 | -177.9 | -96.9 | 0 | 0 | 0 | 112 | S33 I34 N41 | S33-F37 VanDerWaalsContact O-CB 3.26Å; S33-F37 WeakPolarHBondContact O-CB 3.34Å; S33-F37 PolarHBondContact O-N 2.88Å; I34-F37 PolarHBondContact O-N 2.69Å; F37-N41 PolarHBondContact O-N 3.04Å; F37-N41 PolarHBondContact O-ND2 3.08Å |
| 38 | A | 50 | Low | 47.8 | Very low | 26 Ų | 26 | 75 Ų | 75 | 22% | 0.215 | 41% | 0.41 | C | S | . | . | H | α-helix | trans | -65.2 | -39 | 173.9 | 0 | 0 | 0 | 0 | 0 | 111.4 | L11 I34 L35 L36 L42 | L11-A38 HydrophobicContact CD2-CB 4.45Å; I34-A38 VanDerWaalsContact O-CB 3.3Å; I34-A38 WeakPolarHBondContact O-CB 3.29Å; I34-A38 PolarHBondContact O-N 2.81Å; L35-A38 WeakPolarHBondContact O-CB 3.49Å; L35-A38 PolarHBondContact O-N 3.24Å; L36-A38 VanDerWaalsContact C-N 3.3Å; L36-A38 PolarHBondContact O-N 3.42Å; A38-L42 WeakPolarHBondContact O-CB 3.25Å; A38-L42 WeakPolarHBondContact O-CD1 3.26Å; A38-L42 WeakPolarHBondContact O-CG 3.48Å; A38-L42 PolarHBondContact O-N 3.5Å; A38-L42 VanDerWaalsContact O-N 3.1Å |
| 39 | M | 54.4 | Low | 47.8 | Very low | 47 Ų | 47 | 77.7 Ų | 77.7 | 23% | 0.232 | 42% | 0.418 | C | S | . | . | H | α-helix | trans | -66.8 | -37.6 | 176.7 | -67.1 | -158 | -36.4 | 0 | 0 | 114.5 | L35 L36 N41 L42 R47 L50 | L35-M39 VanDerWaalsContact O-CG 3.29Å; L35-M39 WeakPolarHBondContact O-CG 3.28Å; L35-M39 PolarHBondContact O-N 3.03Å; L36-M39 HydrophobicContact CD2-CE 3.83Å; L36-M39 WeakPolarHBondContact O-CB 3.48Å; L36-M39 PolarHBondContact O-N 3.07Å; L36-M39 VanDerWaalsContact O-N 3.1Å; M39-N41 VanDerWaalsContact C-N 3.31Å; M39-N41 PolarHBondContact O-N 3.18Å; M39-L42 PolarHBondContact O-N 3.1Å; M39-R47 PolarHBondContact O-NH1 2.94Å; M39-R47 VanDerWaalsContact O-NH1 3.07Å; M39-L50 HydrophobicContact CG-CD1 3.59Å; M39-L50 HydrophobicContact SD-CD1 3.82Å |
| 40 | D | 52.9 | Low | 48 | Very low | 122 Ų | 122 | 74.9 Ų | 74.9 | 65% | 0.652 | 40% | 0.403 | S | S | * | . | H | α-helix | trans | -66.9 | -37.3 | 179.2 | -79.5 | -16.3 | 0 | 0 | 0 | 111.3 | L36 R47 | L36-D40 PolarHBondContact O-N 3.28Å; D40-R47 PolarHBondContact O-NH1 3.1Å; D40-R47 VanDerWaalsContact O-NH1 3.1Å |
| 41 | N | 50.3 | Low | 48.1 | Very low | 108 Ų | 108 | 72.2 Ų | 72.2 | 58% | 0.578 | 40% | 0.395 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -90.3 | 0.2 | -179.3 | -68 | -72.1 | 0 | 0 | 0 | 114.4 | F37 M39 | F37-N41 PolarHBondContact O-N 3.04Å; F37-N41 PolarHBondContact O-ND2 3.08Å; M39-N41 VanDerWaalsContact C-N 3.31Å; M39-N41 PolarHBondContact O-N 3.18Å |
| 42 | L | 50 | Low | 47.6 | Very low | 8 Ų | 8 | 77.2 Ų | 77.2 | 4% | 0.042 | 41% | 0.413 | C | S | . | . | S | Bend | trans | -74.4 | 129.2 | -179.5 | -101.3 | 166.6 | 0 | 0 | 0 | 111.3 | L8 A38 M39 R47 L50 | L8-L42 HydrophobicContact CD1-CD1 4.19Å; L8-L42 HydrophobicContact CD1-CD2 3.3Å; L8-L42 HydrophobicContact CD1-CG 3.93Å; L8-L42 HydrophobicContact CD2-CD2 3.15Å; L8-L42 HydrophobicContact CG-CD2 3.78Å; A38-L42 WeakPolarHBondContact O-CB 3.25Å; A38-L42 WeakPolarHBondContact O-CD1 3.26Å; A38-L42 WeakPolarHBondContact O-CG 3.48Å; A38-L42 PolarHBondContact O-N 3.5Å; A38-L42 VanDerWaalsContact O-N 3.1Å; M39-L42 PolarHBondContact O-N 3.1Å; L42-R47 HydrophobicContact CB-CG 4.39Å; L42-R47 PolarHBondContact O-NH2 3.1Å; L42-L50 HydrophobicContact CD1-CD1 3.63Å |
| 43 | P | 49 | Very low | 47.2 | Very low | 74 Ų | 74 | 81 Ų | 81 | 48% | 0.481 | 42% | 0.421 | S | S | . | . | trans | -52.2 | 148.4 | 165.5 | -23.4 | 32.7 | 0 | 0 | 0 | 109.9 | I45 G46 R47 | P43-I45 PolarHBondContact O-N 3.23Å; P43-G46 PolarHBondContact O-N 3.1Å; P43-R47 PolarHBondContact O-N 3.44Å | ||
| 44 | S | 51.1 | Low | 46.7 | Very low | 92 Ų | 92 | 80.3 Ų | 80.3 | 64% | 0.643 | 42% | 0.415 | S | S | * | . | H | α-helix | trans | -47 | -31.6 | -175.9 | 50.3 | 0 | 0 | 0 | 0 | 114.4 | R47 A48 | S44-R47 PolarHBondContact O-N 2.89Å; S44-A48 PolarHBondContact O-N 3.41Å; S44-A48 VanDerWaalsContact O-N 3.16Å |
| 45 | I | 41.1 | Very low | 45.9 | Very low | 112 Ų | 112 | 81.9 Ų | 81.9 | 57% | 0.574 | 43% | 0.427 | S | S | * | . | H | α-helix | trans | -59.4 | -42.7 | 173.4 | -77.8 | 166.7 | 0 | 0 | 0 | 113 | P43 A48 I49 | P43-I45 PolarHBondContact O-N 3.23Å; I45-A48 PolarHBondContact O-N 2.87Å; I45-I49 HydrophobicContact CG2-CD1 4.45Å; I45-I49 WeakPolarHBondContact O-CG1 3.5Å; I45-I49 PolarHBondContact O-N 3.28Å |
| 46 | G | 42.5 | Very low | 44.8 | Very low | 3 Ų | 3 | 84.1 Ų | 84.1 | 3% | 0.031 | 45% | 0.446 | C | S | . | . | H | α-helix | trans | -71.3 | -31.9 | 178.1 | 0 | 0 | 0 | 0 | 0 | 113.1 | P43 A48 I49 L50 | P43-G46 PolarHBondContact O-N 3.1Å; G46-A48 VanDerWaalsContact C-N 3.34Å; G46-A48 PolarHBondContact O-N 3.35Å; G46-I49 PolarHBondContact O-N 3.37Å; G46-L50 PolarHBondContact O-N 3.02Å |
| 47 | R | 45.1 | Very low | 44 | Very low | 102 Ų | 102 | 85.7 Ų | 85.7 | 39% | 0.385 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -63.5 | -38.4 | 171.5 | -73.2 | -171.2 | -101.1 | -106.3 | 4.1 | 112.1 | M39 D40 L42 P43 S44 I49 L50 N51 | M39-R47 PolarHBondContact O-NH1 2.94Å; M39-R47 VanDerWaalsContact O-NH1 3.07Å; D40-R47 PolarHBondContact O-NH1 3.1Å; D40-R47 VanDerWaalsContact O-NH1 3.1Å; L42-R47 HydrophobicContact CB-CG 4.39Å; L42-R47 PolarHBondContact O-NH2 3.1Å; P43-R47 PolarHBondContact O-N 3.44Å; S44-R47 PolarHBondContact O-N 2.89Å; R47-I49 PolarHBondContact O-N 3.15Å; R47-L50 PolarHBondContact O-N 3.37Å; R47-N51 WeakPolarHBondContact O-CB 3.34Å; R47-N51 PolarHBondContact O-N 3.08Å |
| 48 | A | 41.9 | Very low | 43 | Very low | 57 Ų | 57 | 85.5 Ų | 85.5 | 47% | 0.471 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -67 | -34.6 | 177.1 | 0 | 0 | 0 | 0 | 0 | 113.1 | S44 I45 G46 K52 | S44-A48 PolarHBondContact O-N 3.41Å; S44-A48 VanDerWaalsContact O-N 3.16Å; I45-A48 PolarHBondContact O-N 2.87Å; G46-A48 VanDerWaalsContact C-N 3.34Å; G46-A48 PolarHBondContact O-N 3.35Å; A48-K52 PolarHBondContact O-N 3.1Å |
| 49 | I | 42.1 | Very low | 42.3 | Very low | 83 Ų | 83 | 91 Ų | 91 | 43% | 0.426 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -68.3 | -40.8 | 176.4 | -65.6 | 169.1 | 0 | 0 | 0 | 110.5 | I45 G46 R47 K52 | I45-I49 HydrophobicContact CG2-CD1 4.45Å; I45-I49 WeakPolarHBondContact O-CG1 3.5Å; I45-I49 PolarHBondContact O-N 3.28Å; G46-I49 PolarHBondContact O-N 3.37Å; R47-I49 PolarHBondContact O-N 3.15Å; I49-K52 PolarHBondContact O-N 3.23Å |
| 50 | L | 44 | Very low | 41.4 | Very low | 34 Ų | 34 | 94 Ų | 94 | 18% | 0.178 | 50% | 0.5 | C | S | . | . | H | α-helix | trans | -69.8 | -38.8 | 177 | -70.9 | 170 | 0 | 0 | 0 | 112.5 | L12 M39 L42 G46 R47 K52 R53 T54 | L12-L50 HydrophobicContact CD2-CD2 4.42Å; M39-L50 HydrophobicContact CG-CD1 3.59Å; M39-L50 HydrophobicContact SD-CD1 3.82Å; L42-L50 HydrophobicContact CD1-CD1 3.63Å; G46-L50 PolarHBondContact O-N 3.02Å; R47-L50 PolarHBondContact O-N 3.37Å; L50-K52 PolarHBondContact O-N 3.37Å; L50-R53 PolarHBondContact O-N 2.99Å; L50-T54 WeakPolarHBondContact O-CG2 3.41Å; L50-T54 PolarHBondContact O-N 3.07Å |
| 51 | N | 43.4 | Very low | 40.5 | Very low | 80 Ų | 80 | 90.1 Ų | 90.1 | 43% | 0.428 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -62.8 | -21.9 | 176.1 | -87.9 | -8.8 | 0 | 0 | 0 | 114.3 | R47 T54 | R47-N51 WeakPolarHBondContact O-CB 3.34Å; R47-N51 PolarHBondContact O-N 3.08Å; N51-T54 WeakPolarHBondContact CA-OG1 3.48Å; N51-T54 PolarHBondContact O-OG1 3.44Å; N51-T54 VanDerWaalsContact O-OG1 3.08Å |
| 52 | K | 37.8 | Very low | 39.8 | Very low | 177 Ų | 177 | 89.7 Ų | 89.7 | 77% | 0.77 | 50% | 0.495 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -79.9 | -16.1 | 172.1 | -77 | -171.8 | 177.2 | -176.7 | 0 | 113.6 | A48 I49 L50 T55 | A48-K52 PolarHBondContact O-N 3.1Å; I49-K52 PolarHBondContact O-N 3.23Å; L50-K52 PolarHBondContact O-N 3.37Å; K52-T55 PolarHBondContact O-OG1 2.85Å |
| 53 | R | 41.8 | Very low | 39.1 | Very low | 169 Ų | 169 | 98.2 Ų | 98.2 | 64% | 0.638 | 53% | 0.531 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -103.2 | -20.8 | 179.5 | -70.8 | -167.1 | 175.2 | -166 | 1.4 | 113.3 | L50 T55 C56 | L50-R53 PolarHBondContact O-N 2.99Å; R53-T55 PolarHBondContact O-N 2.88Å; R53-C56 WeakPolarHBondContact O-CB 3.25Å; R53-C56 PolarHBondContact O-N 2.98Å |
| 54 | T | 38.3 | Very low | 38.5 | Very low | 46 Ų | 46 | 100.7 Ų | 100.7 | 28% | 0.282 | 54% | 0.539 | S | S | . | . | G | 310 helix | trans | -64.3 | -21.6 | 175.7 | 47.2 | 0 | 0 | 0 | 0 | 113.7 | L50 N51 C56 M57 H58 | L50-T54 WeakPolarHBondContact O-CG2 3.41Å; L50-T54 PolarHBondContact O-N 3.07Å; N51-T54 WeakPolarHBondContact CA-OG1 3.48Å; N51-T54 PolarHBondContact O-OG1 3.44Å; N51-T54 VanDerWaalsContact O-OG1 3.08Å; T54-C56 PolarHBondContact O-N 3.42Å; T54-M57 HydrophobicContact CG2-CE 3.61Å; T54-M57 PolarHBondContact O-N 2.91Å; T54-H58 PolarHBondContact O-N 3.44Å |
| 55 | T | 33.3 | Very low | 37.5 | Very low | 103 Ų | 103 | 106.9 Ų | 106.9 | 63% | 0.632 | 55% | 0.55 | S | S | * | * | G | 310 helix | trans | -59.5 | -25.9 | 169.1 | 27.9 | 0 | 0 | 0 | 0 | 113 | K52 R53 | K52-T55 PolarHBondContact O-OG1 2.85Å; R53-T55 PolarHBondContact O-N 2.88Å |
| 56 | C | 30.5 | Very low | 36.9 | Very low | 99 Ų | 99 | 107 Ų | 107 | 67% | 0.669 | 56% | 0.559 | S | S | * | * | G | 310 helix | trans | -80.4 | -20.4 | 174.8 | -136.4 | 0 | 0 | 0 | 0 | 113 | R53 T54 | R53-C56 WeakPolarHBondContact O-CB 3.25Å; R53-C56 PolarHBondContact O-N 2.98Å; T54-C56 PolarHBondContact O-N 3.42Å |
| 57 | M | 34.3 | Very low | 36.4 | Very low | 109 Ų | 109 | 108.6 Ų | 108.6 | 54% | 0.537 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -84.3 | -20.5 | 174.5 | -67 | -167.8 | -59.4 | 0 | 0 | 112.6 | T54 D59 V60 G61 | T54-M57 HydrophobicContact CG2-CE 3.61Å; T54-M57 PolarHBondContact O-N 2.91Å; M57-D59 VanDerWaalsContact C-N 3.26Å; M57-D59 PolarHBondContact O-N 2.8Å; M57-V60 PolarHBondContact O-N 3.05Å; M57-G61 PolarHBondContact O-N 3.07Å; M57-G61 VanDerWaalsContact O-N 3.1Å |
| 58 | H | 30.4 | Very low | 35.8 | Very low | 145 Ų | 145 | 110.5 Ų | 110.5 | 67% | 0.671 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -64.5 | -29.7 | 177.8 | -128.5 | -92 | 0 | 0 | 0 | 112.6 | T54 | T54-H58 PolarHBondContact O-N 3.44Å |
| 59 | D | 34.4 | Very low | 35.4 | Very low | 140 Ų | 140 | 117.3 Ų | 117.3 | 75% | 0.749 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -79.9 | -28.3 | 175.4 | -102.8 | -16.1 | 0 | 0 | 0 | 113.2 | M57 S62 | M57-D59 VanDerWaalsContact C-N 3.26Å; M57-D59 PolarHBondContact O-N 2.8Å; D59-S62 PolarHBondContact O-OG 2.9Å |
| 60 | V | 35.2 | Very low | 34.7 | Very low | 110 Ų | 110 | 122.3 Ų | 122.3 | 67% | 0.667 | 64% | 0.639 | S | S | * | * | H | α-helix | trans | -79.3 | -23.4 | 177.8 | -166.6 | 0 | 0 | 0 | 0 | 111.5 | M57 S62 K63 | M57-V60 PolarHBondContact O-N 3.05Å; V60-S62 PolarHBondContact O-N 3.16Å; V60-S62 VanDerWaalsContact O-N 3.08Å; V60-K63 PolarHBondContact O-N 3.12Å |
| 61 | G | 34.6 | Very low | 34.2 | Very low | 41 Ų | 41 | 127 Ų | 127 | 42% | 0.423 | 66% | 0.66 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -67.4 | -1.4 | 177.8 | 0 | 0 | 0 | 0 | 0 | 116.1 | M57 I64 | M57-G61 PolarHBondContact O-N 3.07Å; M57-G61 VanDerWaalsContact O-N 3.1Å; G61-I64 WeakPolarHBondContact O-CD1 3.48Å |
| 62 | S | 35.2 | Very low | 33.6 | Very low | 99 Ų | 99 | 132.4 Ų | 132.4 | 69% | 0.692 | 68% | 0.675 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.7 | -7.5 | 175.9 | 60.7 | 0 | 0 | 0 | 0 | 113.9 | D59 V60 | D59-S62 PolarHBondContact O-OG 2.9Å; V60-S62 PolarHBondContact O-N 3.16Å; V60-S62 VanDerWaalsContact O-N 3.08Å |
| 63 | K | 35.7 | Very low | 33.5 | Very low | 187 Ų | 187 | 132.3 Ų | 132.3 | 81% | 0.813 | 68% | 0.675 | S | S | * | * | trans | -115.4 | 41 | -179.7 | -71 | -174.5 | 177.4 | 178.4 | 0 | 113.7 | V60 Y65 | V60-K63 PolarHBondContact O-N 3.12Å; K63-Y65 PolarHBondContact O-N 2.81Å; K63-Y65 VanDerWaalsContact O-N 3.11Å | ||
| 64 | I | 36.3 | Very low | 32.9 | Very low | 127 Ų | 127 | 131.1 Ų | 131.1 | 65% | 0.651 | 68% | 0.68 | S | S | * | * | trans | -73.8 | 101.5 | 174.7 | -60.5 | 171.9 | 0 | 0 | 0 | 108.9 | G61 | G61-I64 WeakPolarHBondContact O-CD1 3.48Š| ||
| 65 | Y | 30.1 | Very low | 32.6 | Very low | 222 Ų | 222 | 134.4 Ų | 134.4 | 87% | 0.871 | 70% | 0.695 | S | S | * | * | trans | -71.8 | 122.2 | 177.7 | -157.4 | -102.4 | 0 | 0 | 0 | 110.4 | K63 G67 | K63-Y65 PolarHBondContact O-N 2.81Å; K63-Y65 VanDerWaalsContact O-N 3.11Å; Y65-G67 PolarHBondContact O-N 3.17Å; Y65-G67 VanDerWaalsContact O-N 3.07Å | ||
| 66 | C | 29.1 | Very low | 32.4 | Very low | 113 Ų | 113 | 134.3 Ų | 134.3 | 76% | 0.764 | 70% | 0.698 | S | S | * | * | trans | -79.2 | 80.3 | 179.8 | -75.7 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 67 | G | 31 | Very low | 32.6 | Very low | 37 Ų | 37 | 138.7 Ų | 138.7 | 38% | 0.381 | 70% | 0.7 | S | S | . | * | trans | -81.5 | 159.6 | 164.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | Y65 K69 | Y65-G67 PolarHBondContact O-N 3.17Å; Y65-G67 VanDerWaalsContact O-N 3.07Å; G67-K69 PolarHBondContact O-N 3.11Å | ||
| 68 | P | 32.7 | Very low | 32.3 | Very low | 142 Ų | 142 | 138.3 Ų | 138.3 | 92% | 0.922 | 71% | 0.709 | S | S | * | * | S | Bend | trans | -68.6 | 6.6 | -168.9 | 25.9 | -33.4 | 0 | 0 | 0 | 116.3 | ||
| 69 | K | 32.8 | Very low | 32.1 | Very low | 200 Ų | 200 | 137.6 Ų | 137.6 | 87% | 0.87 | 72% | 0.715 | S | S | * | * | S | Bend | trans | -124.3 | 103.8 | 172.4 | -72.7 | -177.5 | 178.7 | 177 | 0 | 109.3 | G67 Q71 | G67-K69 PolarHBondContact O-N 3.11Å; K69-Q71 PolarHBondContact O-N 3.45Å |
| 70 | K | 29 | Very low | 31.7 | Very low | 188 Ų | 188 | 140.1 Ų | 140.1 | 82% | 0.817 | 72% | 0.719 | S | S | * | * | trans | -71.3 | 110.5 | -176.9 | -66 | 173.8 | 177.9 | 174.1 | 0 | 110.6 | ||||
| 71 | Q | 32.5 | Very low | 31.4 | Very low | 133 Ų | 133 | 146.9 Ų | 146.9 | 62% | 0.621 | 75% | 0.75 | S | S | * | * | trans | -122 | 98.7 | 150.3 | -72.7 | -171.3 | 2.9 | 0 | 0 | 107.8 | K69 F73 | K69-Q71 PolarHBondContact O-N 3.45Å; Q71-F73 HydrophobicContact CB-CD2 4.43Å; Q71-F73 HydrophobicContact CB-CE2 4.11Å; Q71-F73 HydrophobicContact CG-CE2 4.45Å | ||
| 72 | R | 30.6 | Very low | 31.3 | Very low | 194 Ų | 194 | 152.2 Ų | 152.2 | 73% | 0.732 | 77% | 0.766 | S | S | * | * | trans | -98.7 | 109.8 | 172.8 | -74.6 | -178.9 | 174.2 | -176.5 | -3.6 | 106.9 | ||||
| 73 | F | 35.2 | Very low | 31.1 | Very low | 175 Ų | 175 | 154.9 Ų | 154.9 | 77% | 0.768 | 77% | 0.77 | S | S | * | * | trans | -113.6 | 99.2 | 165.1 | -67.8 | -75.2 | 0 | 0 | 0 | 108.8 | Q71 L75 | Q71-F73 HydrophobicContact CB-CD2 4.43Å; Q71-F73 HydrophobicContact CB-CE2 4.11Å; Q71-F73 HydrophobicContact CG-CE2 4.45Å; F73-L75 PolarHBondContact O-N 3.33Å | ||
| 74 | L | 30.1 | Very low | 30.8 | Very low | 144 Ų | 144 | 153.2 Ų | 153.2 | 75% | 0.754 | 77% | 0.768 | S | S | * | * | trans | -75.6 | 108.9 | 165.7 | -109.2 | 103 | 0 | 0 | 0 | 107.8 | C76 | L74-C76 VanDerWaalsContact C-N 3.27Å; L74-C76 PolarHBondContact O-N 3.07Å; L74-C76 VanDerWaalsContact O-N 3.17Å | ||
| 75 | L | 31.5 | Very low | 30.5 | Very low | 114 Ų | 114 | 154.7 Ų | 154.7 | 60% | 0.597 | 78% | 0.775 | S | S | * | * | trans | -82.1 | 79.2 | 160.6 | -85.5 | 162 | 0 | 0 | 0 | 108.6 | F73 | F73-L75 PolarHBondContact O-N 3.33Š| ||
| 76 | C | 30.2 | Very low | 30.5 | Very low | 102 Ų | 102 | 150.5 Ų | 150.5 | 69% | 0.689 | 77% | 0.769 | S | S | * | * | trans | -86.3 | 98.4 | 161 | -93.9 | 0 | 0 | 0 | 0 | 108.3 | L74 | L74-C76 VanDerWaalsContact C-N 3.27Å; L74-C76 PolarHBondContact O-N 3.07Å; L74-C76 VanDerWaalsContact O-N 3.17Å | ||
| 77 | W | 33.2 | Very low | 30.6 | Very low | 190 Ų | 190 | 153 Ų | 153 | 72% | 0.72 | 77% | 0.769 | S | S | * | * | trans | -96.6 | 103.1 | 158.9 | -152.1 | -61.2 | 0 | 0 | 0 | 108.3 | T79 | W77-T79 PolarHBondContact O-N 2.91Š| ||
| 78 | S | 28 | Very low | 30.6 | Very low | 102 Ų | 102 | 161.3 Ų | 161.3 | 71% | 0.713 | 80% | 0.797 | S | S | * | * | trans | -72.6 | 115.7 | 170.1 | 49.7 | 0 | 0 | 0 | 0 | 109.3 | K80 | S78-K80 PolarHBondContact O-N 3.33Å; S78-K80 VanDerWaalsContact O-N 3.15Å | ||
| 79 | T | 26.3 | Very low | 30.4 | Very low | 130 Ų | 130 | 162.8 Ų | 162.8 | 80% | 0.798 | 79% | 0.787 | S | S | * | * | trans | -75.4 | 92.9 | 165.3 | 45.4 | 0 | 0 | 0 | 0 | 109.3 | W77 | W77-T79 PolarHBondContact O-N 2.91Š| ||
| 80 | K | 25.8 | Very low | 30.2 | Very low | 193 Ų | 193 | 159.7 Ų | 159.7 | 84% | 0.839 | 78% | 0.78 | S | S | * | * | trans | -151.3 | 87.7 | 155.6 | -80 | -166.6 | 179 | 176.8 | 0 | 108.8 | S78 | S78-K80 PolarHBondContact O-N 3.33Å; S78-K80 VanDerWaalsContact O-N 3.15Å | ||
| 81 | L | 30.3 | Very low | 30.3 | Very low | 251 Ų | 251 | 157.1 Ų | 157.1 | 100% | 1.314 | 78% | 0.777 | S | S | * | * | trans | -173.2 | 0 | 150.2 | -97.5 | 166.7 | 0 | 0 | 0 | 108.1 |
Retrieved 81 of 81 residues in 36.3 ms
(Link to these results)