| 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 | 57.1 | Low | 74.4 | Confident | 200 Ų | 200 | 118.4 Ų | 118.4 | 99% | 0.985 | 62% | 0.623 | S | S | * | * | 0 | -49.6 | 0 | -67.5 | -59.4 | -96.7 | 0 | 0 | 113 | K3 L4 F5 | M1-K3 PolarHBondContact O-N 3.46Å; M1-L4 PolarHBondContact O-N 3.47Å; M1-F5 PolarHBondContact O-N 3.28Å | |||
| 2 | A | 64 | Low | 75.4 | Confident | 82 Ų | 82 | 111.7 Ų | 111.7 | 68% | 0.678 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -59.8 | -44.5 | -178.4 | 0 | 0 | 0 | 0 | 0 | 115.5 | L4 F5 E6 | A2-L4 VanDerWaalsContact C-N 3.28Å; A2-L4 PolarHBondContact O-N 3.06Å; A2-F5 PolarHBondContact O-N 3.36Å; A2-E6 PolarHBondContact O-N 2.99Å; A2-E6 VanDerWaalsContact O-N 3.08Å |
| 3 | K | 66.3 | Low | 76.2 | Confident | 174 Ų | 174 | 112.1 Ų | 112.1 | 76% | 0.757 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -65.1 | -27.1 | 179.3 | -70.2 | -173 | 175.9 | -178.5 | 0 | 114.5 | M1 S7 | M1-K3 PolarHBondContact O-N 3.46Å; K3-S7 WeakPolarHBondContact O-CB 3.42Å; K3-S7 PolarHBondContact O-N 3.13Å; K3-S7 VanDerWaalsContact O-N 3.12Å; K3-S7 PolarHBondContact O-OG 3.26Å |
| 4 | L | 70.8 | Confident | 76.8 | Confident | 113 Ų | 113 | 108.6 Ų | 108.6 | 59% | 0.592 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -73.3 | -43.2 | 176.8 | -107.1 | 152.1 | 0 | 0 | 0 | 110.5 | M1 A2 E6 S7 I8 | M1-L4 PolarHBondContact O-N 3.47Å; A2-L4 VanDerWaalsContact C-N 3.28Å; A2-L4 PolarHBondContact O-N 3.06Å; L4-E6 VanDerWaalsContact C-N 3.35Å; L4-E6 PolarHBondContact O-N 2.96Å; L4-S7 PolarHBondContact O-N 2.92Å; L4-I8 HydrophobicContact CD2-CD1 4.37Å; L4-I8 WeakPolarHBondContact O-CB 3.31Å; L4-I8 WeakPolarHBondContact O-CD1 3.41Å; L4-I8 WeakPolarHBondContact O-CG1 3.35Å; L4-I8 PolarHBondContact O-N 3.47Å |
| 5 | F | 74.3 | Confident | 77.4 | Confident | 170 Ų | 170 | 110.1 Ų | 110.1 | 75% | 0.746 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -64.2 | -39.3 | 175.7 | -130.3 | -91.2 | 0 | 0 | 0 | 112.2 | M1 A2 G9 | M1-F5 PolarHBondContact O-N 3.28Å; A2-F5 PolarHBondContact O-N 3.36Å; F5-G9 PolarHBondContact O-N 2.9Å |
| 6 | E | 77.9 | Confident | 77.9 | Confident | 108 Ų | 108 | 107.4 Ų | 107.4 | 51% | 0.505 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -67.3 | -38.3 | 176.3 | -159.9 | -170 | 153.2 | 0 | 0 | 112.4 | A2 L4 G9 K10 | A2-E6 PolarHBondContact O-N 2.99Å; A2-E6 VanDerWaalsContact O-N 3.08Å; L4-E6 VanDerWaalsContact C-N 3.35Å; L4-E6 PolarHBondContact O-N 2.96Å; E6-G9 PolarHBondContact O-N 3.33Å; E6-K10 WeakPolarHBondContact O-CG 3.47Å; E6-K10 PolarHBondContact O-N 3.45Å; E6-K10 WeakPolarHBondContact OE1-CE 3.3Å; E6-K10 IonicContact OE1-NZ 2.94Å; E6-K10 PolarHBondContact OE1-NZ 2.83Å |
| 7 | S | 76.8 | Confident | 78.3 | Confident | 64 Ų | 64 | 106.4 Ų | 106.4 | 45% | 0.448 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -70.9 | -39 | 176.5 | -60.7 | 0 | 0 | 0 | 0 | 112.2 | K3 L4 K10 L11 | K3-S7 WeakPolarHBondContact O-CB 3.42Å; K3-S7 PolarHBondContact O-N 3.13Å; K3-S7 VanDerWaalsContact O-N 3.12Å; K3-S7 PolarHBondContact O-OG 3.26Å; L4-S7 PolarHBondContact O-N 2.92Å; S7-K10 PolarHBondContact O-N 3.34Å; S7-L11 WeakPolarHBondContact O-CB 3.31Å; S7-L11 WeakPolarHBondContact O-CG 3.31Å; S7-L11 PolarHBondContact O-N 3.07Å |
| 8 | I | 81.8 | Confident | 78.5 | Confident | 106 Ų | 106 | 102.3 Ų | 102.3 | 54% | 0.544 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -65.3 | -40.6 | 174 | -68 | 164.2 | 0 | 0 | 0 | 110.5 | L4 L11 G12 | L4-I8 HydrophobicContact CD2-CD1 4.37Å; L4-I8 WeakPolarHBondContact O-CB 3.31Å; L4-I8 WeakPolarHBondContact O-CD1 3.41Å; L4-I8 WeakPolarHBondContact O-CG1 3.35Å; L4-I8 PolarHBondContact O-N 3.47Å; I8-L11 PolarHBondContact O-N 3.27Å; I8-G12 PolarHBondContact O-N 2.95Å |
| 9 | G | 82.6 | Confident | 78.7 | Confident | 44 Ų | 44 | 99.2 Ų | 99.2 | 45% | 0.454 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -62.9 | -42.9 | 174.5 | 0 | 0 | 0 | 0 | 0 | 113 | F5 E6 G12 L13 | F5-G9 PolarHBondContact O-N 2.9Å; E6-G9 PolarHBondContact O-N 3.33Å; G9-G12 PolarHBondContact O-N 3.23Å; G9-L13 WeakPolarHBondContact O-CB 3.27Å; G9-L13 PolarHBondContact O-N 2.96Å |
| 10 | K | 82.9 | Confident | 78.8 | Confident | 127 Ų | 127 | 96.2 Ų | 96.2 | 55% | 0.552 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -65.3 | -40.7 | 175.2 | -73.7 | 173.2 | -173.1 | 169.8 | 0 | 112.3 | E6 S7 A14 | E6-K10 WeakPolarHBondContact O-CG 3.47Å; E6-K10 PolarHBondContact O-N 3.45Å; E6-K10 WeakPolarHBondContact OE1-CE 3.3Å; E6-K10 IonicContact OE1-NZ 2.94Å; E6-K10 PolarHBondContact OE1-NZ 2.83Å; S7-K10 PolarHBondContact O-N 3.34Å; K10-A14 VanDerWaalsContact O-CB 3.31Å; K10-A14 WeakPolarHBondContact O-CB 3.23Å; K10-A14 PolarHBondContact O-N 2.84Å |
| 11 | L | 84.3 | Confident | 78.9 | Confident | 114 Ų | 114 | 95.5 Ų | 95.5 | 60% | 0.597 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -66.5 | -42.1 | 175.3 | -79.9 | 160.7 | 0 | 0 | 0 | 112.1 | S7 I8 A14 L15 | S7-L11 WeakPolarHBondContact O-CB 3.31Å; S7-L11 WeakPolarHBondContact O-CG 3.31Å; S7-L11 PolarHBondContact O-N 3.07Å; I8-L11 PolarHBondContact O-N 3.27Å; L11-A14 PolarHBondContact O-N 3.36Å; L11-L15 WeakPolarHBondContact O-CB 3.45Å; L11-L15 PolarHBondContact O-N 3.36Å |
| 12 | G | 86 | Confident | 80.1 | Confident | 38 Ų | 38 | 89.8 Ų | 89.8 | 39% | 0.392 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -63.6 | -42.1 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | I8 G9 L15 A16 | I8-G12 PolarHBondContact O-N 2.95Å; G9-G12 PolarHBondContact O-N 3.23Å; G12-L15 PolarHBondContact O-N 2.94Å; G12-A16 WeakPolarHBondContact O-CB 3.39Å; G12-A16 PolarHBondContact O-N 3.09Å |
| 13 | L | 86.3 | Confident | 80.8 | Confident | 117 Ų | 117 | 91.8 Ų | 91.8 | 61% | 0.613 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -66 | -42.2 | 175.1 | -172.9 | 67.6 | 0 | 0 | 0 | 111.6 | G9 L15 A16 V17 | G9-L13 WeakPolarHBondContact O-CB 3.27Å; G9-L13 PolarHBondContact O-N 2.96Å; L13-L15 PolarHBondContact O-N 3.45Å; L13-A16 PolarHBondContact O-N 3.38Å; L13-V17 HydrophobicContact CD1-CG2 4.47Å; L13-V17 HydrophobicContact CG-CG2 4.46Å; L13-V17 WeakPolarHBondContact O-CB 3.34Å; L13-V17 VanDerWaalsContact O-CG2 3.26Å; L13-V17 WeakPolarHBondContact O-CG2 3.39Å; L13-V17 PolarHBondContact O-N 2.87Å |
| 14 | A | 84.1 | Confident | 81.6 | Confident | 63 Ų | 63 | 86.4 Ų | 86.4 | 52% | 0.521 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -63.6 | -39.9 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | K10 L11 G18 | K10-A14 VanDerWaalsContact O-CB 3.31Å; K10-A14 WeakPolarHBondContact O-CB 3.23Å; K10-A14 PolarHBondContact O-N 2.84Å; L11-A14 PolarHBondContact O-N 3.36Å; A14-G18 PolarHBondContact O-N 3.29Å |
| 15 | L | 86.8 | Confident | 82.1 | Confident | 132 Ų | 132 | 81 Ų | 81 | 69% | 0.691 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -66.1 | -41 | 173.4 | -87.6 | 159.5 | 0 | 0 | 0 | 112.3 | L11 G12 L13 G19 | L11-L15 WeakPolarHBondContact O-CB 3.45Å; L11-L15 PolarHBondContact O-N 3.36Å; G12-L15 PolarHBondContact O-N 2.94Å; L13-L15 PolarHBondContact O-N 3.45Å; L15-G19 PolarHBondContact O-N 3.08Å |
| 16 | A | 84.4 | Confident | 82.7 | Confident | 66 Ų | 66 | 76.6 Ų | 76.6 | 55% | 0.545 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -66.3 | -44 | 177.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | G12 L13 G20 | G12-A16 WeakPolarHBondContact O-CB 3.39Å; G12-A16 PolarHBondContact O-N 3.09Å; L13-A16 PolarHBondContact O-N 3.38Å; A16-G20 PolarHBondContact O-N 3.21Å |
| 17 | V | 84.4 | Confident | 83.2 | Confident | 90 Ų | 90 | 72.4 Ų | 72.4 | 55% | 0.545 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -66.1 | -45.8 | 175.5 | 173.8 | 0 | 0 | 0 | 0 | 110.3 | L13 G20 V21 | L13-V17 HydrophobicContact CD1-CG2 4.47Å; L13-V17 HydrophobicContact CG-CG2 4.46Å; L13-V17 WeakPolarHBondContact O-CB 3.34Å; L13-V17 VanDerWaalsContact O-CG2 3.26Å; L13-V17 WeakPolarHBondContact O-CG2 3.39Å; L13-V17 PolarHBondContact O-N 2.87Å; V17-G20 PolarHBondContact O-N 3.22Å; V17-V21 HydrophobicContact CG1-CG2 4.49Å; V17-V21 VanDerWaalsContact O-CG2 3.28Å; V17-V21 WeakPolarHBondContact O-CG2 3.22Å; V17-V21 PolarHBondContact O-N 2.96Å |
| 18 | G | 82.2 | Confident | 83.8 | Confident | 34 Ų | 34 | 74 Ų | 74 | 35% | 0.351 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -60.9 | -45.8 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | A14 V21 V22 | A14-G18 PolarHBondContact O-N 3.29Å; G18-V21 PolarHBondContact O-N 3.48Å; G18-V22 WeakPolarHBondContact O-CG2 3.39Å; G18-V22 PolarHBondContact O-N 2.9Å |
| 19 | G | 82 | Confident | 84.2 | Confident | 42 Ų | 42 | 69.2 Ų | 69.2 | 43% | 0.433 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -63.7 | -39.6 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | L15 V22 N23 | L15-G19 PolarHBondContact O-N 3.08Å; G19-V22 PolarHBondContact O-N 2.82Å; G19-N23 VanDerWaalsContact O-CB 3.3Å; G19-N23 WeakPolarHBondContact O-CB 3.49Å; G19-N23 PolarHBondContact O-N 2.88Å |
| 20 | G | 81.5 | Confident | 84.5 | Confident | 40 Ų | 40 | 72.6 Ų | 72.6 | 41% | 0.412 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -64.9 | -39.2 | 174.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | A16 V17 S24 | A16-G20 PolarHBondContact O-N 3.21Å; V17-G20 PolarHBondContact O-N 3.22Å; G20-S24 WeakPolarHBondContact O-CB 3.43Å; G20-S24 PolarHBondContact O-N 2.86Å; G20-S24 PolarHBondContact O-OG 3.42Å |
| 21 | V | 81.5 | Confident | 84.7 | Confident | 81 Ų | 81 | 69.4 Ų | 69.4 | 49% | 0.491 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -66.7 | -44.5 | 175.4 | 173 | 0 | 0 | 0 | 0 | 110.9 | V17 G18 S24 A25 | V17-V21 HydrophobicContact CG1-CG2 4.49Å; V17-V21 VanDerWaalsContact O-CG2 3.28Å; V17-V21 WeakPolarHBondContact O-CG2 3.22Å; V17-V21 PolarHBondContact O-N 2.96Å; G18-V21 PolarHBondContact O-N 3.48Å; V21-S24 WeakPolarHBondContact CA-OG 3.22Å; V21-S24 PolarHBondContact O-N 2.83Å; V21-S24 PolarHBondContact O-OG 3.41Å; V21-A25 WeakPolarHBondContact O-CB 3.35Å; V21-A25 PolarHBondContact O-N 3.49Å |
| 22 | V | 81.3 | Confident | 84.8 | Confident | 80 Ų | 80 | 65.3 Ų | 65.3 | 49% | 0.485 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -63.9 | -43.8 | 177 | 173.3 | 0 | 0 | 0 | 0 | 111.2 | G18 G19 S24 A25 L26 | G18-V22 WeakPolarHBondContact O-CG2 3.39Å; G18-V22 PolarHBondContact O-N 2.9Å; G19-V22 PolarHBondContact O-N 2.82Å; V22-S24 PolarHBondContact O-N 3.22Å; V22-A25 PolarHBondContact O-N 2.88Å; V22-A25 VanDerWaalsContact O-N 3.17Å; V22-L26 HydrophobicContact CG1-CD1 4.29Å; V22-L26 WeakPolarHBondContact O-CG 3.39Å; V22-L26 PolarHBondContact O-N 3.36Å |
| 23 | N | 79.8 | Confident | 85.1 | Confident | 124 Ų | 124 | 65.6 Ų | 65.6 | 66% | 0.663 | 42% | 0.42 | S | S | * | . | H | α-helix | trans | -66.2 | -38.5 | 179.4 | -169.9 | 49.7 | 0 | 0 | 0 | 112.3 | G19 A25 L26 | G19-N23 VanDerWaalsContact O-CB 3.3Å; G19-N23 WeakPolarHBondContact O-CB 3.49Å; G19-N23 PolarHBondContact O-N 2.88Å; N23-A25 PolarHBondContact O-N 3.19Å; N23-L26 PolarHBondContact O-N 3.36Å |
| 24 | S | 81.1 | Confident | 85.3 | Confident | 61 Ų | 61 | 64.2 Ų | 64.2 | 43% | 0.427 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -72.8 | -17.6 | 175.1 | 58.1 | 0 | 0 | 0 | 0 | 113.7 | G20 V21 V22 P58 | G20-S24 WeakPolarHBondContact O-CB 3.43Å; G20-S24 PolarHBondContact O-N 2.86Å; G20-S24 PolarHBondContact O-OG 3.42Å; V21-S24 WeakPolarHBondContact CA-OG 3.22Å; V21-S24 PolarHBondContact O-N 2.83Å; V21-S24 PolarHBondContact O-OG 3.41Å; V22-S24 PolarHBondContact O-N 3.22Å; S24-P58 WeakPolarHBondContact OG-CG 3.41Å |
| 25 | A | 83.1 | Confident | 85.7 | Confident | 0 Ų | 0 | 61.2 Ų | 61.2 | 0% | 0 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -88 | -13.6 | 177.5 | 0 | 0 | 0 | 0 | 0 | 113.3 | V21 V22 N23 F55 L56 P58 | V21-A25 WeakPolarHBondContact O-CB 3.35Å; V21-A25 PolarHBondContact O-N 3.49Å; V22-A25 PolarHBondContact O-N 2.88Å; V22-A25 VanDerWaalsContact O-N 3.17Å; N23-A25 PolarHBondContact O-N 3.19Å; A25-F55 HydrophobicContact CB-CD2 3.87Å; A25-F55 HydrophobicContact CB-CE1 4.2Å; A25-F55 HydrophobicContact CB-CE2 3.28Å; A25-F55 HydrophobicContact CB-CZ 3.48Å; A25-F55 VanDerWaalsContact CB-CZ 3.48Å; A25-F55 CarbonylContact O-C 3.53Å; A25-F55 WeakPolarHBondContact O-CA 3.28Å; A25-L56 VanDerWaalsContact CA-O 3.31Å; A25-L56 WeakPolarHBondContact CA-O 3.42Å; A25-L56 VanDerWaalsContact CB-O 3.23Å; A25-L56 WeakPolarHBondContact CB-O 3.45Å; A25-L56 PolarHBondContact O-N 3.41Å; A25-P58 HydrophobicContact CB-CG 3.74Å |
| 26 | L | 86.4 | Confident | 85.9 | Confident | 78 Ų | 78 | 54.9 Ų | 54.9 | 41% | 0.408 | 35% | 0.349 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -92.5 | 133.8 | 176 | -67.2 | 170.2 | 0 | 0 | 0 | 109.9 | V22 N23 T53 F55 | V22-L26 HydrophobicContact CG1-CD1 4.29Å; V22-L26 WeakPolarHBondContact O-CG 3.39Å; V22-L26 PolarHBondContact O-N 3.36Å; N23-L26 PolarHBondContact O-N 3.36Å; L26-T53 HydrophobicContact CB-CG2 4.42Å; L26-T53 HydrophobicContact CD2-CG2 4.05Å; L26-F55 HydrophobicContact CD2-CD2 4.18Å |
| 27 | F | 88.6 | Confident | 86.2 | Confident | 20 Ų | 20 | 52.5 Ų | 52.5 | 9% | 0.088 | 33% | 0.327 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -134.7 | 150.5 | 168.7 | 76.6 | -78.3 | 0 | 0 | 0 | 110.3 | V29 A35 V49 T53 H54 L56 P63 | F27-V29 HydrophobicContact CD2-CG2 3.92Å; F27-V29 HydrophobicContact CE2-CG2 3.52Å; F27-A35 HydrophobicContact CE2-CB 3.94Å; F27-V49 HydrophobicContact CZ-CG1 4.18Å; F27-T53 WeakPolarHBondContact O-CA 3.31Å; F27-H54 HydrophobicContact CD1-CB 4.05Å; F27-H54 VanDerWaalsContact CD1-O 3.27Å; F27-H54 WeakPolarHBondContact CD1-O 3.29Å; F27-H54 HydrophobicContact CE1-CB 3.41Å; F27-H54 VanDerWaalsContact CE1-CB 3.41Å; F27-H54 HydrophobicContact CE2-CB 4.24Å; F27-H54 HydrophobicContact CZ-CB 3.53Å; F27-H54 PolarHBondContact N-O 2.91Å; F27-H54 PolarHBondContact O-N 3.37Å; F27-L56 HydrophobicContact CB-CD2 3.99Å; F27-L56 HydrophobicContact CD1-CB 3.91Å; F27-L56 HydrophobicContact CD1-CD2 3.41Å; F27-L56 VanDerWaalsContact CD1-CD2 3.41Å; F27-L56 HydrophobicContact CD1-CG 3.74Å; F27-L56 HydrophobicContact CE1-CB 3.91Å; F27-L56 HydrophobicContact CE1-CD2 3.99Å; F27-L56 HydrophobicContact CE1-CG 4.27Å; F27-L56 HydrophobicContact CG-CD2 3.83Å; F27-P63 HydrophobicContact CB-CG 4.48Å; F27-P63 HydrophobicContact CD2-CB 3.86Å; F27-P63 HydrophobicContact CD2-CG 4.1Å; F27-P63 HydrophobicContact CE2-CB 3.8Å; F27-P63 HydrophobicContact CG-CB 4.37Å; F27-P63 HydrophobicContact CG-CG 4.23Å; F27-P63 HydrophobicContact CZ-CB 4.26Å |
| 28 | N | 88.4 | Confident | 86.4 | Confident | 97 Ų | 97 | 51.9 Ų | 51.9 | 52% | 0.519 | 32% | 0.317 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -112.9 | 136 | -176.9 | -69.1 | 62 | 0 | 0 | 0 | 109.1 | T53 | N28-T53 PolarHBondContact ND2-OG1 3.31Å |
| 29 | V | 90.6 | Very high | 86.8 | Confident | 5 Ų | 5 | 50.9 Ų | 50.9 | 3% | 0.03 | 30% | 0.304 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -110.9 | 116.9 | 172.1 | -177.2 | 0 | 0 | 0 | 0 | 107.8 | F27 H33 A35 G50 G52 | F27-V29 HydrophobicContact CD2-CG2 3.92Å; F27-V29 HydrophobicContact CE2-CG2 3.52Å; V29-H33 HydrophobicContact CG1-CB 4.04Å; V29-H33 WeakPolarHBondContact CG1-O 3.47Å; V29-A35 HydrophobicContact CG2-CB 3.79Å; V29-G50 WeakPolarHBondContact CB-O 3.44Å; V29-G52 PolarHBondContact N-O 2.88Å; V29-G52 PolarHBondContact O-N 3.42Å |
| 30 | D | 89.4 | Confident | 87 | Confident | 115 Ų | 115 | 57.1 Ų | 57.1 | 62% | 0.615 | 31% | 0.314 | S | S | * | . | trans | -68.4 | 157.7 | 179.7 | -70 | -34.4 | 0 | 0 | 0 | 112.2 | G32 H33 | D30-G32 PolarHBondContact O-N 3.49Å; D30-H33 WeakPolarHBondContact O-CB 3.37Å; D30-H33 PolarHBondContact O-N 2.82Å | ||
| 31 | A | 87.3 | Confident | 87.2 | Confident | 60 Ų | 60 | 63.3 Ų | 63.3 | 50% | 0.496 | 33% | 0.33 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -55.9 | 136.2 | 178.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | H33 E51 R69 | A31-H33 PolarHBondContact O-N 3.43Å; A31-H33 PolarHBondContact O-ND1 3.38Å; A31-E51 WeakPolarHBondContact CA-OE2 3.35Å; A31-R69 PolarHBondContact O-NH2 2.92Å |
| 32 | G | 86.1 | Confident | 87.3 | Confident | 28 Ų | 28 | 70 Ų | 70 | 29% | 0.289 | 35% | 0.346 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 74.1 | 1.7 | -177.6 | 0 | 0 | 0 | 0 | 0 | 115.4 | D30 C68 | D30-G32 PolarHBondContact O-N 3.49Å; G32-C68 WeakPolarHBondContact O-CB 3.4Å; G32-C68 PolarHBondContact O-N 3.43Å |
| 33 | H | 91.8 | Very high | 87.6 | Confident | 44 Ų | 44 | 67.2 Ų | 67.2 | 20% | 0.204 | 34% | 0.335 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.1 | 158.6 | 168.1 | -64.1 | 73.5 | 0 | 0 | 0 | 110.5 | V29 D30 A31 I65 F66 | V29-H33 HydrophobicContact CG1-CB 4.04Å; V29-H33 WeakPolarHBondContact CG1-O 3.47Å; D30-H33 WeakPolarHBondContact O-CB 3.37Å; D30-H33 PolarHBondContact O-N 2.82Å; A31-H33 PolarHBondContact O-N 3.43Å; A31-H33 PolarHBondContact O-ND1 3.38Å; H33-I65 HydrophobicContact CB-CG2 3.63Å; H33-F66 CarbonylContact C-O 3.55Å; H33-F66 VanDerWaalsContact CA-O 3.24Å; H33-F66 WeakPolarHBondContact CA-O 3.39Å |
| 34 | R | 91.4 | Very high | 87.9 | Confident | 88 Ų | 88 | 63 Ų | 63 | 33% | 0.332 | 31% | 0.313 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -136.8 | 145.3 | 170.7 | -67.8 | -166.1 | 178.8 | -145.6 | 1.5 | 110.2 | V48 V49 F66 T99 L102 | R34-V48 HydrophobicContact CB-CG1 3.77Å; R34-V48 HydrophobicContact CG-CG1 4.29Å; R34-V49 WeakPolarHBondContact CA-O 3.49Å; R34-F66 PolarHBondContact N-O 2.95Å; R34-F66 PolarHBondContact O-N 2.9Å; R34-T99 VanDerWaalsContact NE-CG2 3.26Å; R34-L102 HydrophobicContact CB-CD1 3.63Å; R34-L102 HydrophobicContact CG-CD1 4.45Å |
| 35 | A | 90.6 | Very high | 88.2 | Confident | 0 Ų | 0 | 62.7 Ų | 62.7 | 0% | 0 | 31% | 0.305 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -106.6 | 135.4 | -180 | 0 | 0 | 0 | 0 | 0 | 111.5 | F27 V29 V49 P63 I64 I65 | F27-A35 HydrophobicContact CE2-CB 3.94Å; V29-A35 HydrophobicContact CG2-CB 3.79Å; A35-V49 HydrophobicContact CB-CB 4.24Å; A35-V49 PolarHBondContact N-O 2.94Å; A35-V49 PolarHBondContact O-N 3.26Å; A35-P63 HydrophobicContact CB-CB 4.49Å; A35-I64 CarbonylContact C-O 3.52Å; A35-I64 VanDerWaalsContact CA-O 3.28Å; A35-I64 WeakPolarHBondContact CA-O 3.35Å; A35-I65 HydrophobicContact CB-CG1 4.37Å |
| 36 | V | 91.4 | Very high | 88.2 | Confident | 0 Ų | 0 | 69.7 Ų | 69.7 | 0% | 0 | 34% | 0.342 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -101.3 | 129 | 165.4 | 179.1 | 0 | 0 | 0 | 0 | 107.4 | V44 I64 F66 L102 P103 | V36-V44 HydrophobicContact CG1-CG1 3.47Å; V36-V44 VanDerWaalsContact CG1-CG1 3.47Å; V36-I64 PolarHBondContact N-O 3.2Å; V36-I64 PolarHBondContact O-N 3.45Å; V36-F66 HydrophobicContact CB-CE2 4.24Å; V36-F66 HydrophobicContact CG2-CD2 4Å; V36-F66 HydrophobicContact CG2-CE2 3.92Å; V36-L102 HydrophobicContact CG2-CB 3.62Å; V36-P103 HydrophobicContact CG1-CB 4.25Å; V36-P103 HydrophobicContact CG1-CG 4.26Å; V36-P103 HydrophobicContact CG2-CG 4.31Å |
| 37 | I | 90.4 | Very high | 88.1 | Confident | 16 Ų | 16 | 68.9 Ų | 68.9 | 8% | 0.082 | 35% | 0.347 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -89.9 | 122.9 | -180 | -59.7 | 174.9 | 0 | 0 | 0 | 109.3 | Q45 V49 Q61 | I37-Q45 HydrophobicContact CB-CB 4.48Å; I37-Q45 HydrophobicContact CB-CG 4.4Å; I37-Q45 PolarHBondContact O-N 2.93Å; I37-V49 HydrophobicContact CD1-CG2 3.63Å; I37-V49 HydrophobicContact CG1-CG2 3.99Å; I37-Q61 HydrophobicContact CG2-CB 3.94Å; I37-Q61 HydrophobicContact CG2-CG 4Å |
| 38 | F | 90.1 | Very high | 88.1 | Confident | 77 Ų | 77 | 69.6 Ų | 69.6 | 34% | 0.338 | 35% | 0.353 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -95.2 | 118.9 | 166.4 | 177.9 | -98.7 | 0 | 0 | 0 | 109.9 | V44 Q61 K62 I64 | F38-V44 HydrophobicContact CD2-CG2 3.86Å; F38-Q61 CarbonylContact O-C 3.57Å; F38-Q61 VanDerWaalsContact O-CA 3.3Å; F38-Q61 WeakPolarHBondContact O-CA 3.3Å; F38-K62 PolarHBondContact N-O 2.96Å; F38-K62 PolarHBondContact O-N 3.22Å; F38-I64 HydrophobicContact CB-CD1 4.05Å |
| 39 | D | 89.9 | Confident | 88.2 | Confident | 13 Ų | 13 | 66 Ų | 66 | 7% | 0.07 | 34% | 0.335 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -99.1 | 131 | 173.9 | -166.5 | -45.3 | 0 | 0 | 0 | 110 | F41 R42 G43 V60 Q61 | D39-F41 PolarHBondContact O-N 2.98Å; D39-F41 PolarHBondContact OD1-N 3.18Å; D39-R42 HydrophobicContact CB-CB 4.23Å; D39-G43 WeakPolarHBondContact CB-O 3.43Å; D39-G43 PolarHBondContact N-O 2.87Å; D39-G43 VanDerWaalsContact O-CA 3.24Å; D39-G43 WeakPolarHBondContact O-CA 3.49Å; D39-G43 PolarHBondContact O-N 2.97Å; D39-V60 WeakPolarHBondContact OD1-CG1 3.32Å; D39-Q61 HydrophobicContact CB-CG 4.45Å |
| 40 | R | 85.6 | Confident | 88.1 | Confident | 172 Ų | 172 | 67.1 Ų | 67.1 | 65% | 0.649 | 35% | 0.347 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -56.5 | -33 | 178.3 | -168.3 | 81.4 | 72.9 | 133.1 | 7.9 | 112.9 | W59 V60 | R40-W59 PolarHBondContact NH2-O 3.24Å; R40-V60 WeakPolarHBondContact CB-O 3.47Å; R40-V60 PolarHBondContact N-O 3.48Å |
| 41 | F | 86.9 | Confident | 88.1 | Confident | 170 Ų | 170 | 67.9 Ų | 67.9 | 75% | 0.746 | 35% | 0.347 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -97.6 | -34.4 | -173.8 | -60.2 | -73 | 0 | 0 | 0 | 113.5 | D39 V60 | D39-F41 PolarHBondContact O-N 2.98Å; D39-F41 PolarHBondContact OD1-N 3.18Å; F41-V60 HydrophobicContact CD2-CG1 3.61Å; F41-V60 HydrophobicContact CE2-CB 4.49Å; F41-V60 HydrophobicContact CE2-CG1 3.71Å; F41-V60 HydrophobicContact CE2-CG2 4.02Å |
| 42 | R | 82.9 | Confident | 88.2 | Confident | 221 Ų | 221 | 66.6 Ų | 66.6 | 83% | 0.834 | 34% | 0.34 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -105.4 | -8.9 | -175.4 | -67.3 | -179.1 | 178.2 | 171.7 | 0 | 113.7 | D39 | D39-R42 HydrophobicContact CB-CB 4.23Š|
| 43 | G | 86.8 | Confident | 88.3 | Confident | 23 Ų | 23 | 69.2 Ų | 69.2 | 24% | 0.237 | 35% | 0.35 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | 78.9 | -150.7 | -174.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | D39 | D39-G43 WeakPolarHBondContact CB-O 3.43Å; D39-G43 PolarHBondContact N-O 2.87Å; D39-G43 VanDerWaalsContact O-CA 3.24Å; D39-G43 WeakPolarHBondContact O-CA 3.49Å; D39-G43 PolarHBondContact O-N 2.97Å |
| 44 | V | 87.1 | Confident | 88.1 | Confident | 34 Ų | 34 | 70.1 Ų | 70.1 | 21% | 0.206 | 35% | 0.354 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -73.3 | 128.1 | -178.2 | -178.9 | 0 | 0 | 0 | 0 | 109.9 | V36 F38 P103 F106 T107 | V36-V44 HydrophobicContact CG1-CG1 3.47Å; V36-V44 VanDerWaalsContact CG1-CG1 3.47Å; F38-V44 HydrophobicContact CD2-CG2 3.86Å; V44-P103 HydrophobicContact CG1-CB 3.96Å; V44-F106 HydrophobicContact CG1-CD1 4.21Å; V44-F106 HydrophobicContact CG2-CD1 3.69Å; V44-F106 HydrophobicContact CG2-CE1 3.67Å; V44-T107 HydrophobicContact CB-CG2 3.81Å; V44-T107 HydrophobicContact CG1-CG2 4.1Å; V44-T107 HydrophobicContact CG2-CG2 3.66Å |
| 45 | Q | 86.3 | Confident | 87.9 | Confident | 56 Ų | 56 | 72.4 Ų | 72.4 | 26% | 0.262 | 37% | 0.367 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -81.7 | 141.1 | 175.8 | -60.8 | -175.1 | 25 | 0 | 0 | 111.2 | I37 A47 P103 | I37-Q45 HydrophobicContact CB-CB 4.48Å; I37-Q45 HydrophobicContact CB-CG 4.4Å; I37-Q45 PolarHBondContact O-N 2.93Å; Q45-A47 VanDerWaalsContact C-N 3.25Å; Q45-A47 PolarHBondContact O-N 3.44Å; Q45-P103 WeakPolarHBondContact O-CG 3.36Å |
| 46 | D | 83.1 | Confident | 87.8 | Confident | 146 Ų | 146 | 73 Ų | 73 | 78% | 0.781 | 37% | 0.37 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -72.4 | -20 | 177.3 | -66 | -39 | 0 | 0 | 0 | 113 | V48 | D46-V48 PolarHBondContact O-N 3.45Å |
| 47 | A | 85.6 | Confident | 87.6 | Confident | 62 Ų | 62 | 77.2 Ų | 77.2 | 51% | 0.512 | 39% | 0.391 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -77 | 121.5 | 179 | 0 | 0 | 0 | 0 | 0 | 110.7 | Q45 | Q45-A47 VanDerWaalsContact C-N 3.25Å; Q45-A47 PolarHBondContact O-N 3.44Å |
| 48 | V | 88.4 | Confident | 87.1 | Confident | 35 Ų | 35 | 77.8 Ų | 77.8 | 21% | 0.212 | 40% | 0.397 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -91.6 | 125.9 | 175.4 | -180 | 0 | 0 | 0 | 0 | 109.7 | R34 D46 T99 L102 P103 | R34-V48 HydrophobicContact CB-CG1 3.77Å; R34-V48 HydrophobicContact CG-CG1 4.29Å; D46-V48 PolarHBondContact O-N 3.45Å; V48-T99 WeakPolarHBondContact CG2-O 3.05Å; V48-L102 HydrophobicContact CG1-CD1 3.85Å; V48-L102 HydrophobicContact CG2-CB 4.2Å; V48-P103 HydrophobicContact CG2-CG 3.72Å |
| 49 | V | 89.8 | Confident | 86.6 | Confident | 22 Ų | 22 | 85.2 Ų | 85.2 | 13% | 0.133 | 42% | 0.422 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -87.5 | 126.6 | 179.1 | -179 | 0 | 0 | 0 | 0 | 109.5 | F27 R34 A35 I37 H54 | F27-V49 HydrophobicContact CZ-CG1 4.18Å; R34-V49 WeakPolarHBondContact CA-O 3.49Å; A35-V49 HydrophobicContact CB-CB 4.24Å; A35-V49 PolarHBondContact N-O 2.94Å; A35-V49 PolarHBondContact O-N 3.26Å; I37-V49 HydrophobicContact CD1-CG2 3.63Å; I37-V49 HydrophobicContact CG1-CG2 3.99Å; V49-H54 HydrophobicContact CG1-CB 4.08Å; V49-H54 WeakPolarHBondContact CG1-CD2 3.34Å; V49-H54 VanDerWaalsContact CG1-NE2 3.31Å; V49-H54 WeakPolarHBondContact CG1-NE2 3.48Å |
| 50 | G | 88.6 | Confident | 86.5 | Confident | 28 Ų | 28 | 86.4 Ų | 86.4 | 29% | 0.289 | 43% | 0.43 | S | S | . | . | trans | -78.7 | -172.7 | 177.8 | 0 | 0 | 0 | 0 | 0 | 113.4 | V29 H54 | V29-G50 WeakPolarHBondContact CB-O 3.44Å; G50-H54 PolarHBondContact O-NE2 3.25Å | ||
| 51 | E | 89.1 | Confident | 86.7 | Confident | 130 Ų | 130 | 79.9 Ų | 79.9 | 61% | 0.607 | 41% | 0.407 | S | S | * | . | S | Bend | trans | -60.9 | 151.2 | 175.3 | 59.8 | -167 | -165.8 | 0 | 0 | 112.6 | A31 H54 | A31-E51 WeakPolarHBondContact CA-OE2 3.35Å; E51-H54 PolarHBondContact O-NE2 2.92Å |
| 52 | G | 89.5 | Confident | 86.8 | Confident | 34 Ų | 34 | 78.1 Ų | 78.1 | 35% | 0.351 | 40% | 0.399 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | 117.5 | -178.2 | 179.3 | 0 | 0 | 0 | 0 | 0 | 114.6 | V29 H54 | V29-G52 PolarHBondContact N-O 2.88Å; V29-G52 PolarHBondContact O-N 3.42Å; G52-H54 PolarHBondContact O-CD2 3.02Å; G52-H54 VanDerWaalsContact O-CD2 3.23Å |
| 53 | T | 88.6 | Confident | 87.1 | Confident | 83 Ų | 83 | 69.4 Ų | 69.4 | 51% | 0.509 | 37% | 0.371 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -88.2 | 123.2 | 177.1 | -48 | 0 | 0 | 0 | 0 | 109.7 | L26 F27 N28 | L26-T53 HydrophobicContact CB-CG2 4.42Å; L26-T53 HydrophobicContact CD2-CG2 4.05Å; F27-T53 WeakPolarHBondContact O-CA 3.31Å; N28-T53 PolarHBondContact ND2-OG1 3.31Å |
| 54 | H | 88.8 | Confident | 87.3 | Confident | 63 Ų | 63 | 69 Ų | 69 | 29% | 0.292 | 36% | 0.363 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -123.6 | 158.1 | -178.6 | -62.8 | -78.6 | 0 | 0 | 0 | 110.6 | F27 V49 G50 E51 G52 | F27-H54 HydrophobicContact CD1-CB 4.05Å; F27-H54 VanDerWaalsContact CD1-O 3.27Å; F27-H54 WeakPolarHBondContact CD1-O 3.29Å; F27-H54 HydrophobicContact CE1-CB 3.41Å; F27-H54 VanDerWaalsContact CE1-CB 3.41Å; F27-H54 HydrophobicContact CE2-CB 4.24Å; F27-H54 HydrophobicContact CZ-CB 3.53Å; F27-H54 PolarHBondContact N-O 2.91Å; F27-H54 PolarHBondContact O-N 3.37Å; V49-H54 HydrophobicContact CG1-CB 4.08Å; V49-H54 WeakPolarHBondContact CG1-CD2 3.34Å; V49-H54 VanDerWaalsContact CG1-NE2 3.31Å; V49-H54 WeakPolarHBondContact CG1-NE2 3.48Å; G50-H54 PolarHBondContact O-NE2 3.25Å; E51-H54 PolarHBondContact O-NE2 2.92Å; G52-H54 PolarHBondContact O-CD2 3.02Å; G52-H54 VanDerWaalsContact O-CD2 3.23Å |
| 55 | F | 87.3 | Confident | 87.5 | Confident | 135 Ų | 135 | 71.5 Ų | 71.5 | 59% | 0.592 | 37% | 0.374 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -99.8 | 131.4 | 178.4 | -167.9 | -92.7 | 0 | 0 | 0 | 109.9 | A25 L26 | A25-F55 HydrophobicContact CB-CD2 3.87Å; A25-F55 HydrophobicContact CB-CE1 4.2Å; A25-F55 HydrophobicContact CB-CE2 3.28Å; A25-F55 HydrophobicContact CB-CZ 3.48Å; A25-F55 VanDerWaalsContact CB-CZ 3.48Å; A25-F55 CarbonylContact O-C 3.53Å; A25-F55 WeakPolarHBondContact O-CA 3.28Å; L26-F55 HydrophobicContact CD2-CD2 4.18Å |
| 56 | L | 88.4 | Confident | 87.7 | Confident | 13 Ų | 13 | 69.2 Ų | 69.2 | 7% | 0.068 | 36% | 0.364 | C | S | . | . | trans | -124.6 | 157.7 | 171.7 | 65.2 | 77.7 | 0 | 0 | 0 | 110 | A25 F27 P58 Q61 P63 | A25-L56 VanDerWaalsContact CA-O 3.31Å; A25-L56 WeakPolarHBondContact CA-O 3.42Å; A25-L56 VanDerWaalsContact CB-O 3.23Å; A25-L56 WeakPolarHBondContact CB-O 3.45Å; A25-L56 PolarHBondContact O-N 3.41Å; F27-L56 HydrophobicContact CB-CD2 3.99Å; F27-L56 HydrophobicContact CD1-CB 3.91Å; F27-L56 HydrophobicContact CD1-CD2 3.41Å; F27-L56 VanDerWaalsContact CD1-CD2 3.41Å; F27-L56 HydrophobicContact CD1-CG 3.74Å; F27-L56 HydrophobicContact CE1-CB 3.91Å; F27-L56 HydrophobicContact CE1-CD2 3.99Å; F27-L56 HydrophobicContact CE1-CG 4.27Å; F27-L56 HydrophobicContact CG-CD2 3.83Å; L56-P58 HydrophobicContact CD1-CG 4.44Å; L56-P58 VanDerWaalsContact O-CD 3.27Å; L56-P58 WeakPolarHBondContact O-CD 3.45Å; L56-Q61 HydrophobicContact CB-CB 4.24Å; L56-P63 HydrophobicContact CD2-CB 4.38Å; L56-P63 HydrophobicContact CD2-CG 3.67Å | ||
| 57 | I | 86.3 | Confident | 88.1 | Confident | 88 Ų | 88 | 64.1 Ų | 64.1 | 45% | 0.451 | 34% | 0.337 | S | S | . | . | trans | -85.4 | 112.4 | 172.8 | -58.7 | 173.1 | 0 | 0 | 0 | 108.3 | V60 Q61 | I57-V60 HydrophobicContact CB-CB 4.31Å; I57-V60 HydrophobicContact CG2-CB 3.98Å; I57-V60 HydrophobicContact CG2-CG2 3.94Å; I57-V60 PolarHBondContact O-N 2.99Å; I57-Q61 HydrophobicContact CB-CG 4.49Å; I57-Q61 PolarHBondContact O-N 2.94Å | ||
| 58 | P | 79.1 | Confident | 88.3 | Confident | 29 Ų | 29 | 62 Ų | 62 | 19% | 0.188 | 32% | 0.318 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -54.9 | 144.8 | 178.5 | -24 | 35.3 | 0 | 0 | 0 | 110.3 | S24 A25 L56 V60 | S24-P58 WeakPolarHBondContact OG-CG 3.41Å; A25-P58 HydrophobicContact CB-CG 3.74Å; L56-P58 HydrophobicContact CD1-CG 4.44Å; L56-P58 VanDerWaalsContact O-CD 3.27Å; L56-P58 WeakPolarHBondContact O-CD 3.45Å; P58-V60 PolarHBondContact O-N 3.48Å |
| 59 | W | 81.6 | Confident | 88.5 | Confident | 232 Ų | 232 | 66.6 Ų | 66.6 | 88% | 0.879 | 33% | 0.331 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 72.8 | -29.9 | -178.9 | -61.7 | 68.6 | 0 | 0 | 0 | 117.2 | R40 | R40-W59 PolarHBondContact NH2-O 3.24Š|
| 60 | V | 87 | Confident | 88.7 | Confident | 39 Ų | 39 | 68 Ų | 68 | 24% | 0.236 | 34% | 0.342 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -92.7 | -43.8 | -179.8 | -178.7 | 0 | 0 | 0 | 0 | 111.1 | D39 R40 F41 I57 P58 | D39-V60 WeakPolarHBondContact OD1-CG1 3.32Å; R40-V60 WeakPolarHBondContact CB-O 3.47Å; R40-V60 PolarHBondContact N-O 3.48Å; F41-V60 HydrophobicContact CD2-CG1 3.61Å; F41-V60 HydrophobicContact CE2-CB 4.49Å; F41-V60 HydrophobicContact CE2-CG1 3.71Å; F41-V60 HydrophobicContact CE2-CG2 4.02Å; I57-V60 HydrophobicContact CB-CB 4.31Å; I57-V60 HydrophobicContact CG2-CB 3.98Å; I57-V60 HydrophobicContact CG2-CG2 3.94Å; I57-V60 PolarHBondContact O-N 2.99Å; P58-V60 PolarHBondContact O-N 3.48Å |
| 61 | Q | 89 | Confident | 88.9 | Confident | 35 Ų | 35 | 70.4 Ų | 70.4 | 16% | 0.164 | 34% | 0.342 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -109.3 | 136 | -176 | -68.6 | 176.5 | -21.7 | 0 | 0 | 110.9 | I37 F38 D39 L56 I57 | I37-Q61 HydrophobicContact CG2-CB 3.94Å; I37-Q61 HydrophobicContact CG2-CG 4Å; F38-Q61 CarbonylContact O-C 3.57Å; F38-Q61 VanDerWaalsContact O-CA 3.3Å; F38-Q61 WeakPolarHBondContact O-CA 3.3Å; D39-Q61 HydrophobicContact CB-CG 4.45Å; L56-Q61 HydrophobicContact CB-CB 4.24Å; I57-Q61 HydrophobicContact CB-CG 4.49Å; I57-Q61 PolarHBondContact O-N 2.94Å |
| 62 | K | 89.1 | Confident | 89.1 | Confident | 133 Ų | 133 | 67.8 Ų | 67.8 | 58% | 0.578 | 34% | 0.337 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -122.2 | 123.2 | 174.1 | -172.3 | -176.3 | 177.4 | -168 | 0 | 109 | F38 | F38-K62 PolarHBondContact N-O 2.96Å; F38-K62 PolarHBondContact O-N 3.22Å |
| 63 | P | 89.8 | Confident | 89.3 | Confident | 37 Ų | 37 | 71.1 Ų | 71.1 | 24% | 0.24 | 34% | 0.339 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -82.5 | 132.6 | 175.5 | 33.1 | -27.7 | 0 | 0 | 0 | 109.2 | F27 A35 L56 | F27-P63 HydrophobicContact CB-CG 4.48Å; F27-P63 HydrophobicContact CD2-CB 3.86Å; F27-P63 HydrophobicContact CD2-CG 4.1Å; F27-P63 HydrophobicContact CE2-CB 3.8Å; F27-P63 HydrophobicContact CG-CB 4.37Å; F27-P63 HydrophobicContact CG-CG 4.23Å; F27-P63 HydrophobicContact CZ-CB 4.26Å; A35-P63 HydrophobicContact CB-CB 4.49Å; L56-P63 HydrophobicContact CD2-CB 4.38Å; L56-P63 HydrophobicContact CD2-CG 3.67Å |
| 64 | I | 90.6 | Very high | 89.5 | Confident | 14 Ų | 14 | 71.2 Ų | 71.2 | 7% | 0.072 | 34% | 0.336 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -112.6 | 115.9 | 172.7 | -61.1 | 154.1 | 0 | 0 | 0 | 106.8 | A35 V36 F38 F66 F106 E111 | A35-I64 CarbonylContact C-O 3.52Å; A35-I64 VanDerWaalsContact CA-O 3.28Å; A35-I64 WeakPolarHBondContact CA-O 3.35Å; V36-I64 PolarHBondContact N-O 3.2Å; V36-I64 PolarHBondContact O-N 3.45Å; F38-I64 HydrophobicContact CB-CD1 4.05Å; I64-F66 HydrophobicContact CB-CE2 4.27Å; I64-F66 HydrophobicContact CG2-CD2 4.23Å; I64-F66 HydrophobicContact CG2-CE2 3.53Å; I64-F66 HydrophobicContact CG2-CZ 3.87Å; I64-F106 HydrophobicContact CD1-CD1 4.06Å; I64-F106 HydrophobicContact CD1-CD2 4.38Å; I64-F106 HydrophobicContact CD1-CE1 3.38Å; I64-F106 HydrophobicContact CD1-CE2 3.72Å; I64-F106 HydrophobicContact CD1-CZ 3.2Å; I64-F106 HydrophobicContact CG1-CZ 4.45Å; I64-F106 HydrophobicContact CG2-CD2 4.48Å; I64-F106 HydrophobicContact CG2-CE2 4.35Å; I64-E111 HydrophobicContact CG2-CG 4.29Å; I64-E111 WeakPolarHBondContact CG2-OE1 3.27Å |
| 65 | I | 90.9 | Very high | 89.8 | Confident | 87 Ų | 87 | 68.5 Ų | 68.5 | 45% | 0.446 | 32% | 0.324 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -97.3 | 123.9 | -171.4 | -55.9 | 175 | 0 | 0 | 0 | 108.7 | H33 A35 | H33-I65 HydrophobicContact CB-CG2 3.63Å; A35-I65 HydrophobicContact CB-CG1 4.37Å |
| 66 | F | 91.1 | Very high | 90.1 | Very high | 9 Ų | 9 | 66.5 Ų | 66.5 | 4% | 0.039 | 33% | 0.325 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -106.9 | 135.8 | 175.7 | -72 | -86.8 | 0 | 0 | 0 | 110.7 | H33 R34 V36 I64 C68 L102 F106 E111 Y113 | H33-F66 CarbonylContact C-O 3.55Å; H33-F66 VanDerWaalsContact CA-O 3.24Å; H33-F66 WeakPolarHBondContact CA-O 3.39Å; R34-F66 PolarHBondContact N-O 2.95Å; R34-F66 PolarHBondContact O-N 2.9Å; V36-F66 HydrophobicContact CB-CE2 4.24Å; V36-F66 HydrophobicContact CG2-CD2 4Å; V36-F66 HydrophobicContact CG2-CE2 3.92Å; I64-F66 HydrophobicContact CB-CE2 4.27Å; I64-F66 HydrophobicContact CG2-CD2 4.23Å; I64-F66 HydrophobicContact CG2-CE2 3.53Å; I64-F66 HydrophobicContact CG2-CZ 3.87Å; F66-C68 PolarHBondContact O-N 2.93Å; F66-L102 HydrophobicContact CB-CD1 4.41Å; F66-L102 HydrophobicContact CB-CD2 4.06Å; F66-L102 HydrophobicContact CD1-CD2 4.5Å; F66-L102 HydrophobicContact CG-CD2 4.11Å; F66-F106 HydrophobicContact CE2-CB 4.18Å; F66-F106 HydrophobicContact CE2-CD2 4.39Å; F66-F106 HydrophobicContact CE2-CG 4.42Å; F66-F106 HydrophobicContact CZ-CB 3.79Å; F66-F106 AromaticContact CZ-CD2 3.73Å; F66-F106 HydrophobicContact CZ-CD2 3.73Å; F66-F106 HydrophobicContact CZ-CG 4.05Å; F66-E111 HydrophobicContact CZ-CG 4.46Å; F66-Y113 HydrophobicContact CD1-CE1 4.02Å; F66-Y113 HydrophobicContact CE1-CD1 4.31Å; F66-Y113 HydrophobicContact CE1-CE1 4.27Å |
| 67 | D | 91.3 | Very high | 90.4 | Very high | 39 Ų | 39 | 66.1 Ų | 66.1 | 21% | 0.209 | 32% | 0.323 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -76.8 | 115.8 | 167.5 | -172.7 | -0.2 | 0 | 0 | 0 | 109.5 | R69 R71 | D67-R69 WeakPolarHBondContact OD1-CB 3.18Å; D67-R69 WeakPolarHBondContact OD1-CD 3.23Å; D67-R69 WeakPolarHBondContact OD1-CG 3.43Å; D67-R69 PolarHBondContact OD1-N 3.45Å; D67-R71 IonicContact OD2-NE 3.48Å |
| 68 | C | 90.8 | Very high | 90.7 | Very high | 17 Ų | 17 | 67.3 Ų | 67.3 | 12% | 0.115 | 33% | 0.329 | C | S | . | . | trans | -96.7 | 8 | 179.7 | -63.1 | 0 | 0 | 0 | 0 | 112.7 | G32 F66 T99 | G32-C68 WeakPolarHBondContact O-CB 3.4Å; G32-C68 PolarHBondContact O-N 3.43Å; F66-C68 PolarHBondContact O-N 2.93Å; C68-T99 HydrophobicContact CB-CG2 4.15Å | ||
| 69 | R | 92.3 | Very high | 91.4 | Very high | 131 Ų | 131 | 66.5 Ų | 66.5 | 49% | 0.494 | 32% | 0.324 | S | S | . | . | S | Bend | trans | -78.7 | 153.1 | 178 | -60.5 | 168.1 | -179 | -176.6 | 0.8 | 111 | A31 D67 R71 | A31-R69 PolarHBondContact O-NH2 2.92Å; D67-R69 WeakPolarHBondContact OD1-CB 3.18Å; D67-R69 WeakPolarHBondContact OD1-CD 3.23Å; D67-R69 WeakPolarHBondContact OD1-CG 3.43Å; D67-R69 PolarHBondContact OD1-N 3.45Å; R69-R71 PolarHBondContact O-N 2.9Å |
| 70 | S | 93.8 | Very high | 91.9 | Very high | 53 Ų | 53 | 56.9 Ų | 56.9 | 37% | 0.371 | 30% | 0.297 | S | S | . | . | trans | -67.8 | 119.3 | 174.5 | -51.3 | 0 | 0 | 0 | 0 | 110.3 | F95 D165 | S70-F95 WeakPolarHBondContact CA-O 3.39Å; S70-D165 VanDerWaalsContact CB-OD2 3.29Å; S70-D165 WeakPolarHBondContact CB-OD2 3.44Å; S70-D165 PolarHBondContact OG-OD2 2.92Å | ||
| 71 | R | 92.6 | Very high | 92.2 | Very high | 77 Ų | 77 | 55.3 Ų | 55.3 | 29% | 0.291 | 29% | 0.287 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -118.6 | 136.9 | 179.4 | -68.1 | -173 | -76.5 | 129.8 | -3.5 | 110.2 | D67 R69 F95 Y113 D114 | D67-R71 IonicContact OD2-NE 3.48Å; R69-R71 PolarHBondContact O-N 2.9Å; R71-F95 HydrophobicContact CB-CE1 4.42Å; R71-F95 PolarHBondContact N-O 2.96Å; R71-F95 WeakPolarHBondContact O-CD1 3.3Å; R71-F95 WeakPolarHBondContact O-CE1 3.37Å; R71-F95 PolarHBondContact O-N 3.49Å; R71-Y113 PolarHBondContact NH2-OH 3.42Å; R71-D114 IonicContact CZ-OD2 3.48Å; R71-D114 IonicContact NH1-OD2 2.71Å; R71-D114 PolarHBondContact NH1-OD2 2.92Å; R71-D114 IonicContact NH2-OD2 2.97Å; R71-D114 PolarHBondContact NH2-OD2 3.33Å |
| 72 | P | 94.1 | Very high | 92.4 | Very high | 76 Ų | 76 | 59.3 Ų | 59.3 | 49% | 0.494 | 30% | 0.304 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -79.8 | 140.3 | 176.9 | 31.9 | -33.3 | 0 | 0 | 0 | 110.8 | I93 L94 | P72-I93 CarbonylContact C-O 3.31Å; P72-I93 WeakPolarHBondContact CA-O 3.32Å; P72-L94 HydrophobicContact CB-CD1 4.29Å |
| 73 | R | 92.6 | Very high | 92.6 | Very high | 104 Ų | 104 | 55.9 Ų | 55.9 | 39% | 0.392 | 29% | 0.292 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -134.1 | 130.9 | 171.8 | -179.1 | 63.7 | 166.5 | 155.4 | -5.2 | 109.7 | V75 I93 F95 L118 | R73-V75 HydrophobicContact CG-CG2 3.99Å; R73-I93 PolarHBondContact N-O 3.31Å; R73-I93 PolarHBondContact O-N 2.96Å; R73-F95 HydrophobicContact CB-CD1 4.22Å; R73-F95 HydrophobicContact CB-CE1 3.76Å; R73-L118 HydrophobicContact CG-CD1 4.46Å |
| 74 | N | 93.8 | Very high | 92.6 | Very high | 84 Ų | 84 | 61.4 Ų | 61.4 | 45% | 0.449 | 32% | 0.319 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -102.6 | 127 | 172.9 | -62.3 | -21.4 | 0 | 0 | 0 | 108.9 | T90 L91 R92 | N74-T90 HydrophobicContact CB-CG2 4.23Å; N74-L91 CarbonylContact C-O 3.58Å; N74-L91 WeakPolarHBondContact CA-O 3.35Å; N74-R92 WeakPolarHBondContact OD1-CB 3.49Å; N74-R92 WeakPolarHBondContact OD1-CG 3.43Å |
| 75 | V | 93.6 | Very high | 92.6 | Very high | 7 Ų | 7 | 64.1 Ų | 64.1 | 4% | 0.042 | 33% | 0.331 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -121.1 | 108.1 | 178.5 | -174.7 | 0 | 0 | 0 | 0 | 108.3 | R73 V77 L91 I93 P119 T122 | R73-V75 HydrophobicContact CG-CG2 3.99Å; V75-V77 HydrophobicContact CG1-CG2 3.97Å; V75-L91 PolarHBondContact N-O 3.45Å; V75-L91 PolarHBondContact O-N 3.35Å; V75-I93 HydrophobicContact CG2-CD1 4.28Å; V75-P119 HydrophobicContact CG1-CB 4.37Å; V75-T122 HydrophobicContact CB-CG2 4.14Å; V75-T122 HydrophobicContact CG1-CG2 4.15Å |
| 76 | P | 94.3 | Very high | 92.7 | Very high | 92 Ų | 92 | 65.1 Ų | 65.1 | 60% | 0.597 | 34% | 0.337 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -78 | 135 | 171.6 | 32 | -32.1 | 0 | 0 | 0 | 109.8 | ||
| 77 | V | 94.1 | Very high | 92.7 | Very high | 6 Ų | 6 | 64.7 Ų | 64.7 | 4% | 0.036 | 34% | 0.335 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -137.5 | 132.3 | -179 | -179.9 | 0 | 0 | 0 | 0 | 109 | V75 I89 T122 T123 L126 | V75-V77 HydrophobicContact CG1-CG2 3.97Å; V77-I89 PolarHBondContact N-O 2.98Å; V77-I89 PolarHBondContact O-N 3.5Å; V77-T122 HydrophobicContact CG2-CG2 4.47Å; V77-T123 HydrophobicContact CG1-CG2 4.1Å; V77-L126 HydrophobicContact CB-CD2 3.55Å; V77-L126 HydrophobicContact CG1-CD2 3.81Å; V77-L126 HydrophobicContact CG2-CD2 3.99Å |
| 78 | I | 93.1 | Very high | 92.9 | Very high | 112 Ų | 112 | 65.9 Ų | 65.9 | 57% | 0.574 | 34% | 0.342 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -102.5 | 125 | 172 | -57.7 | 170.3 | 0 | 0 | 0 | 107.6 | N88 | I78-N88 HydrophobicContact CG1-CB 4.39Å |
| 79 | T | 93.1 | Very high | 93 | Very high | 13 Ų | 13 | 65.2 Ų | 65.2 | 8% | 0.08 | 34% | 0.337 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -141.6 | 157.4 | -179 | -173.9 | 0 | 0 | 0 | 0 | 111.6 | V87 I89 K127 V130 | T79-V87 PolarHBondContact N-O 2.94Å; T79-V87 PolarHBondContact O-N 2.91Å; T79-I89 HydrophobicContact CG2-CD1 4.13Å; T79-K127 WeakPolarHBondContact OG1-CG 3.34Å; T79-V130 HydrophobicContact CG2-CB 3.81Å; T79-V130 HydrophobicContact CG2-CG1 3.57Å; T79-V130 HydrophobicContact CG2-CG2 4.12Å |
| 80 | G | 92.5 | Very high | 93.1 | Very high | 30 Ų | 30 | 60.2 Ų | 60.2 | 31% | 0.309 | 32% | 0.321 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -85.2 | 141.4 | 167.5 | 0 | 0 | 0 | 0 | 0 | 110.9 | Q85 | G80-Q85 CarbonylContact C-O 3.57Å; G80-Q85 VanDerWaalsContact CA-O 3.31Å; G80-Q85 WeakPolarHBondContact CA-O 3.36Å |
| 81 | S | 93.7 | Very high | 93.2 | Very high | 5 Ų | 5 | 57.7 Ų | 57.7 | 4% | 0.035 | 30% | 0.303 | C | S | . | . | trans | -79 | 175.5 | 163.8 | 56.8 | 0 | 0 | 0 | 0 | 111.2 | D83 L84 Q85 | S81-D83 VanDerWaalsContact CB-OD1 3.22Å; S81-D83 WeakPolarHBondContact CB-OD1 3.35Å; S81-D83 PolarHBondContact O-N 3.4Å; S81-D83 PolarHBondContact OG-OD1 2.88Å; S81-L84 PolarHBondContact O-N 2.92Å; S81-Q85 PolarHBondContact N-O 3.24Å; S81-Q85 WeakPolarHBondContact OG-CB 3.34Å; S81-Q85 PolarHBondContact OG-N 3.39Å; S81-Q85 VanDerWaalsContact OG-N 3.12Å; S81-Q85 PolarHBondContact OG-O 3.09Å | ||
| 82 | K | 93.9 | Very high | 93.2 | Very high | 120 Ų | 120 | 58.3 Ų | 58.3 | 52% | 0.522 | 31% | 0.306 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -59.9 | -32.5 | 177.5 | 179.6 | 175.7 | 159 | -148.1 | 0 | 113.6 | L84 A131 R132 F133 D134 | K82-L84 PolarHBondContact O-N 2.98Å; K82-A131 WeakPolarHBondContact CB-O 3.49Å; K82-R132 WeakPolarHBondContact CD-O 3.47Å; K82-F133 VanDerWaalsContact CB-O 3.25Å; K82-F133 WeakPolarHBondContact CB-O 3.29Å; K82-F133 PolarHBondContact N-O 3.03Å; K82-D134 WeakPolarHBondContact CB-OD1 3.33Å; K82-D134 WeakPolarHBondContact CD-OD1 3.38Å; K82-D134 WeakPolarHBondContact CG-OD1 3.47Å; K82-D134 IonicContact NZ-OD1 3.77Å; K82-D134 IonicContact NZ-OD2 3.81Å |
| 83 | D | 92.4 | Very high | 93.3 | Very high | 61 Ų | 61 | 54.7 Ų | 54.7 | 33% | 0.326 | 28% | 0.282 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -85.5 | 17.8 | 174.2 | 62.3 | -34 | 0 | 0 | 0 | 113.5 | S81 Q85 A135 | S81-D83 VanDerWaalsContact CB-OD1 3.22Å; S81-D83 WeakPolarHBondContact CB-OD1 3.35Å; S81-D83 PolarHBondContact O-N 3.4Å; S81-D83 PolarHBondContact OG-OD1 2.88Å; D83-Q85 PolarHBondContact O-N 3.46Å; D83-Q85 WeakPolarHBondContact OD2-CG 3.42Å; D83-A135 PolarHBondContact OD1-N 3.27Å |
| 84 | L | 89.6 | Confident | 93.4 | Very high | 153 Ų | 153 | 51.7 Ų | 51.7 | 80% | 0.801 | 27% | 0.274 | S | S | * | . | trans | 61.5 | 26.4 | 177 | -55.6 | 172.8 | 0 | 0 | 0 | 114 | S81 K82 | S81-L84 PolarHBondContact O-N 2.92Å; K82-L84 PolarHBondContact O-N 2.98Å | ||
| 85 | Q | 91.6 | Very high | 93.4 | Very high | 70 Ų | 70 | 47.9 Ų | 47.9 | 33% | 0.327 | 25% | 0.253 | S | S | . | . | trans | -89 | 135.7 | 174.5 | -62.7 | -64.8 | -1.2 | 0 | 0 | 111.3 | G80 S81 D83 V87 A135 F178 | G80-Q85 CarbonylContact C-O 3.57Å; G80-Q85 VanDerWaalsContact CA-O 3.31Å; G80-Q85 WeakPolarHBondContact CA-O 3.36Å; S81-Q85 PolarHBondContact N-O 3.24Å; S81-Q85 WeakPolarHBondContact OG-CB 3.34Å; S81-Q85 PolarHBondContact OG-N 3.39Å; S81-Q85 VanDerWaalsContact OG-N 3.12Å; S81-Q85 PolarHBondContact OG-O 3.09Å; D83-Q85 PolarHBondContact O-N 3.46Å; D83-Q85 WeakPolarHBondContact OD2-CG 3.42Å; Q85-V87 PolarHBondContact O-N 2.94Å; Q85-A135 HydrophobicContact CB-CB 4.25Å; Q85-A135 HydrophobicContact CG-CB 4.34Å; Q85-F178 HydrophobicContact CG-CD2 3.87Å; Q85-F178 HydrophobicContact CG-CE2 4.1Å | ||
| 86 | N | 92 | Very high | 93.4 | Very high | 108 Ų | 108 | 51.4 Ų | 51.4 | 58% | 0.578 | 27% | 0.266 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -73.4 | 122 | 174.3 | -77.4 | 24.4 | 0 | 0 | 0 | 109.9 | G175 | N86-G175 PolarHBondContact O-N 3.27Å |
| 87 | V | 92.5 | Very high | 93.4 | Very high | 0 Ų | 0 | 47 Ų | 47 | 0% | 0 | 24% | 0.238 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -119.4 | 128.5 | 176.7 | -161.5 | 0 | 0 | 0 | 0 | 108.7 | T79 Q85 I89 L138 L172 F174 | T79-V87 PolarHBondContact N-O 2.94Å; T79-V87 PolarHBondContact O-N 2.91Å; Q85-V87 PolarHBondContact O-N 2.94Å; V87-I89 HydrophobicContact CB-CD1 4.33Å; V87-I89 HydrophobicContact CB-CG1 4.29Å; V87-I89 HydrophobicContact CG1-CD1 3.92Å; V87-I89 HydrophobicContact CG1-CG1 3.62Å; V87-L138 HydrophobicContact CG1-CD1 4.45Å; V87-L138 HydrophobicContact CG2-CD1 4Å; V87-L172 HydrophobicContact CG1-CD1 4.35Å; V87-L172 HydrophobicContact CG1-CD2 4Å; V87-L172 HydrophobicContact CG1-CG 3.86Å; V87-F174 HydrophobicContact CB-CD1 4.41Å; V87-F174 HydrophobicContact CB-CE1 4.42Å; V87-F174 HydrophobicContact CG1-CD1 4.06Å; V87-F174 HydrophobicContact CG1-CE1 3.87Å; V87-F174 HydrophobicContact CG1-CZ 4.44Å; V87-F174 HydrophobicContact CG2-CD1 3.76Å; V87-F174 HydrophobicContact CG2-CE1 3.67Å |
| 88 | N | 94.3 | Very high | 93.3 | Very high | 65 Ų | 65 | 48 Ų | 48 | 35% | 0.348 | 24% | 0.243 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -99.5 | 119.3 | 170.1 | -177.5 | 18.6 | 0 | 0 | 0 | 108.5 | I78 L172 T173 | I78-N88 HydrophobicContact CG1-CB 4.39Å; N88-L172 WeakPolarHBondContact O-CA 3.4Å; N88-T173 WeakPolarHBondContact CB-OG1 3.33Å; N88-T173 PolarHBondContact N-O 2.97Å; N88-T173 PolarHBondContact O-N 3.12Å |
| 89 | I | 94.1 | Very high | 93.2 | Very high | 2 Ų | 2 | 44.6 Ų | 44.6 | 1% | 0.01 | 23% | 0.228 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -126.4 | 131 | -173.8 | -57.7 | 170.8 | 0 | 0 | 0 | 108.9 | V77 T79 V87 L126 V130 L169 H171 L172 | V77-I89 PolarHBondContact N-O 2.98Å; V77-I89 PolarHBondContact O-N 3.5Å; T79-I89 HydrophobicContact CG2-CD1 4.13Å; V87-I89 HydrophobicContact CB-CD1 4.33Å; V87-I89 HydrophobicContact CB-CG1 4.29Å; V87-I89 HydrophobicContact CG1-CD1 3.92Å; V87-I89 HydrophobicContact CG1-CG1 3.62Å; I89-L126 HydrophobicContact CB-CD2 3.92Å; I89-L126 HydrophobicContact CD1-CD2 4.34Å; I89-L126 HydrophobicContact CG2-CD1 4.43Å; I89-L126 HydrophobicContact CG2-CD2 3.96Å; I89-V130 HydrophobicContact CD1-CG1 4.33Å; I89-V130 HydrophobicContact CD1-CG2 3.71Å; I89-L169 HydrophobicContact CG2-CD2 3.57Å; I89-H171 CarbonylContact C-O 3.56Å; I89-H171 VanDerWaalsContact CA-O 3.3Å; I89-H171 WeakPolarHBondContact CA-O 3.21Å; I89-L172 HydrophobicContact CD1-CD1 4.21Å; I89-L172 HydrophobicContact CG1-CD1 4.09Å; I89-L172 HydrophobicContact CG1-CG 4.1Å |
| 90 | T | 94.5 | Very high | 93 | Very high | 26 Ų | 26 | 48.2 Ų | 48.2 | 16% | 0.16 | 25% | 0.254 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -106.3 | 117.9 | 171.6 | -56.2 | 0 | 0 | 0 | 0 | 109.6 | N74 T170 H171 | N74-T90 HydrophobicContact CB-CG2 4.23Å; T90-T170 WeakPolarHBondContact CB-OG1 3.25Å; T90-T170 PolarHBondContact O-N 3.22Å; T90-T170 PolarHBondContact O-OG1 2.83Å; T90-H171 PolarHBondContact N-O 3.49Å |
| 91 | L | 94.1 | Very high | 92.8 | Very high | 0 Ų | 0 | 49.9 Ų | 49.9 | 0% | 0 | 25% | 0.253 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -94.5 | 129.4 | 173.8 | -161.2 | 72.6 | 0 | 0 | 0 | 109.6 | N74 V75 I93 T122 V149 L153 V167 L169 | N74-L91 CarbonylContact C-O 3.58Å; N74-L91 WeakPolarHBondContact CA-O 3.35Å; V75-L91 PolarHBondContact N-O 3.45Å; V75-L91 PolarHBondContact O-N 3.35Å; L91-I93 HydrophobicContact CD2-CD1 3.94Å; L91-I93 HydrophobicContact CD2-CG1 3.79Å; L91-I93 HydrophobicContact CG-CG1 3.98Å; L91-T122 HydrophobicContact CB-CG2 4.17Å; L91-T122 HydrophobicContact CD2-CG2 3.49Å; L91-T122 VanDerWaalsContact CD2-CG2 3.49Å; L91-T122 HydrophobicContact CG-CG2 4.48Å; L91-V149 HydrophobicContact CD1-CG1 4.28Å; L91-V149 HydrophobicContact CD2-CG1 4.23Å; L91-L153 HydrophobicContact CD2-CD2 3.79Å; L91-V167 HydrophobicContact CD1-CG1 3.81Å; L91-V167 HydrophobicContact CD2-CG1 3.76Å; L91-V167 HydrophobicContact CG-CG1 3.97Å; L91-L169 HydrophobicContact CD1-CD2 3.49Å; L91-L169 VanDerWaalsContact CD1-CD2 3.49Å; L91-L169 HydrophobicContact CD1-CG 4.03Å |
| 92 | R | 94.4 | Very high | 92.6 | Very high | 91 Ų | 91 | 49.7 Ų | 49.7 | 34% | 0.343 | 25% | 0.252 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -98.8 | 125.9 | 167.8 | 173.7 | -177.5 | 163.3 | 91.2 | -0.1 | 107.9 | N74 S168 T170 | N74-R92 WeakPolarHBondContact OD1-CB 3.49Å; N74-R92 WeakPolarHBondContact OD1-CG 3.43Å; R92-S168 PolarHBondContact N-O 2.7Å; R92-S168 PolarHBondContact O-N 2.86Å; R92-T170 HydrophobicContact CB-CG2 3.61Å |
| 93 | I | 94.6 | Very high | 92.4 | Very high | 0 Ų | 0 | 44.2 Ų | 44.2 | 0% | 0 | 23% | 0.229 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -123.6 | 126.6 | -177.6 | -53 | 167.5 | 0 | 0 | 0 | 107.5 | P72 R73 V75 L91 F95 T122 L153 L164 V167 | P72-I93 CarbonylContact C-O 3.31Å; P72-I93 WeakPolarHBondContact CA-O 3.32Å; R73-I93 PolarHBondContact N-O 3.31Å; R73-I93 PolarHBondContact O-N 2.96Å; V75-I93 HydrophobicContact CG2-CD1 4.28Å; L91-I93 HydrophobicContact CD2-CD1 3.94Å; L91-I93 HydrophobicContact CD2-CG1 3.79Å; L91-I93 HydrophobicContact CG-CG1 3.98Å; I93-F95 HydrophobicContact CG2-CB 4.24Å; I93-T122 HydrophobicContact CD1-CG2 4.1Å; I93-T122 WeakPolarHBondContact CD1-OG1 3.38Å; I93-L153 HydrophobicContact CD1-CD2 4.08Å; I93-L153 HydrophobicContact CG1-CD2 4.4Å; I93-L164 HydrophobicContact CG2-CD2 3.68Å; I93-V167 HydrophobicContact CG2-CG2 4.42Å |
| 94 | L | 94.9 | Very high | 92.3 | Very high | 41 Ų | 41 | 48.9 Ų | 48.9 | 22% | 0.215 | 24% | 0.242 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -100.8 | 117.5 | 167.2 | -170.3 | 68.8 | 0 | 0 | 0 | 107.7 | P72 L164 D165 D166 | P72-L94 HydrophobicContact CB-CD1 4.29Å; L94-L164 CarbonylContact O-C 3.52Å; L94-L164 WeakPolarHBondContact O-CA 3.48Å; L94-D165 HydrophobicContact CD2-CB 4.05Å; L94-D165 HydrophobicContact CG-CB 4.26Å; L94-D165 PolarHBondContact O-N 3.39Å; L94-D166 HydrophobicContact CB-CB 4Å; L94-D166 PolarHBondContact N-O 2.92Å; L94-D166 PolarHBondContact O-N 3.11Å |
| 95 | F | 94.7 | Very high | 92.4 | Very high | 4 Ų | 4 | 41.8 Ų | 41.8 | 2% | 0.018 | 20% | 0.204 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -136.1 | 157.5 | -173.1 | 73.5 | -77.6 | 0 | 0 | 0 | 112.2 | S70 R71 R73 I93 Y113 D114 L118 I163 L164 | S70-F95 WeakPolarHBondContact CA-O 3.39Å; R71-F95 HydrophobicContact CB-CE1 4.42Å; R71-F95 PolarHBondContact N-O 2.96Å; R71-F95 WeakPolarHBondContact O-CD1 3.3Å; R71-F95 WeakPolarHBondContact O-CE1 3.37Å; R71-F95 PolarHBondContact O-N 3.49Å; R73-F95 HydrophobicContact CB-CD1 4.22Å; R73-F95 HydrophobicContact CB-CE1 3.76Å; I93-F95 HydrophobicContact CG2-CB 4.24Å; F95-Y113 AromaticContact CE2-CE2 4Å; F95-Y113 HydrophobicContact CE2-CE2 4Å; F95-D114 HydrophobicContact CE2-CB 3.71Å; F95-D114 HydrophobicContact CZ-CB 3.55Å; F95-L118 HydrophobicContact CD1-CD1 3.53Å; F95-L118 HydrophobicContact CD2-CD1 3.77Å; F95-L118 HydrophobicContact CE1-CD1 3.43Å; F95-L118 VanDerWaalsContact CE1-CD1 3.43Å; F95-L118 HydrophobicContact CE2-CD1 3.66Å; F95-L118 HydrophobicContact CG-CD1 3.71Å; F95-L118 HydrophobicContact CG-CD2 4.42Å; F95-L118 HydrophobicContact CZ-CD1 3.49Å; F95-L118 VanDerWaalsContact CZ-CD1 3.49Å; F95-I163 CarbonylContact C-O 3.57Å; F95-I163 VanDerWaalsContact CA-O 3.25Å; F95-I163 WeakPolarHBondContact CA-O 3.5Å; F95-L164 HydrophobicContact CB-CD2 3.7Å |
| 96 | R | 93.9 | Very high | 92.3 | Very high | 80 Ų | 80 | 40.4 Ų | 40.4 | 30% | 0.302 | 20% | 0.197 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -148.7 | 149.3 | 172.1 | 60.7 | -174.4 | 175.5 | 95.6 | 2 | 110.8 | I163 D165 | R96-I163 HydrophobicContact CG-CB 4.04Å; R96-I163 PolarHBondContact N-O 3.23Å; R96-I163 PolarHBondContact O-N 3.01Å; R96-D165 WeakPolarHBondContact CD-OD2 3.48Å; R96-D165 IonicContact CZ-OD1 3.69Å; R96-D165 IonicContact NE-OD1 3.63Å; R96-D165 PolarHBondContact NE-OD1 3.36Å; R96-D165 IonicContact NE-OD2 3.74Å; R96-D165 PolarHBondContact NE-OD2 3.38Å; R96-D165 IonicContact NH2-OD1 2.66Å |
| 97 | P | 93.7 | Very high | 92.1 | Very high | 1 Ų | 1 | 39.6 Ų | 39.6 | 1% | 0.006 | 20% | 0.197 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -74 | 148.8 | 177.2 | 31.2 | -34.9 | 0 | 0 | 0 | 112 | T99 L102 I105 Y113 L162 | P97-T99 PolarHBondContact O-N 3.25Å; P97-L102 HydrophobicContact CB-CD2 3.74Å; P97-L102 HydrophobicContact CG-CD2 3.93Å; P97-I105 HydrophobicContact CB-CD1 4.07Å; P97-Y113 HydrophobicContact CB-CE2 4.38Å; P97-L162 HydrophobicContact CB-CD2 4.31Å |
| 98 | V | 92.5 | Very high | 91.8 | Very high | 26 Ų | 26 | 43.5 Ų | 43.5 | 16% | 0.158 | 22% | 0.224 | C | C | . | . | trans | -70.1 | 117.9 | 171 | 178.8 | 0 | 0 | 0 | 0 | 108.7 | S100 Q101 L102 G161 I163 | V98-S100 VanDerWaalsContact CG1-OG 3.29Å; V98-S100 WeakPolarHBondContact CG1-OG 3.46Å; V98-S100 PolarHBondContact O-N 3.48Å; V98-Q101 HydrophobicContact CB-CB 4.3Å; V98-Q101 HydrophobicContact CB-CG 4.46Å; V98-Q101 HydrophobicContact CG1-CB 4.35Å; V98-Q101 HydrophobicContact CG1-CG 4.08Å; V98-Q101 PolarHBondContact O-N 3.21Å; V98-L102 PolarHBondContact O-N 3.26Å; V98-G161 WeakPolarHBondContact CB-O 3.34Å; V98-G161 VanDerWaalsContact CG2-O 3.27Å; V98-G161 WeakPolarHBondContact CG2-O 3.36Å; V98-G161 PolarHBondContact N-O 2.95Å; V98-I163 HydrophobicContact CG2-CD1 3.82Å; V98-I163 HydrophobicContact CG2-CG1 3.49Å; V98-I163 VanDerWaalsContact CG2-CG1 3.49Å | ||
| 99 | T | 89.7 | Confident | 91.5 | Very high | 41 Ų | 41 | 41.6 Ų | 41.6 | 25% | 0.252 | 21% | 0.213 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -62.8 | -27.2 | -173.8 | 57.5 | 0 | 0 | 0 | 0 | 114.5 | R34 V48 C68 P97 | R34-T99 VanDerWaalsContact NE-CG2 3.26Å; V48-T99 WeakPolarHBondContact CG2-O 3.05Å; C68-T99 HydrophobicContact CB-CG2 4.15Å; P97-T99 PolarHBondContact O-N 3.25Å |
| 100 | S | 88.9 | Confident | 91.1 | Very high | 88 Ų | 88 | 42.2 Ų | 42.2 | 62% | 0.615 | 22% | 0.221 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -80.8 | -16.7 | 176.9 | 55.7 | 0 | 0 | 0 | 0 | 113.9 | V98 | V98-S100 VanDerWaalsContact CG1-OG 3.29Å; V98-S100 WeakPolarHBondContact CG1-OG 3.46Å; V98-S100 PolarHBondContact O-N 3.48Å |
| 101 | Q | 88.7 | Confident | 90.6 | Very high | 66 Ų | 66 | 46.3 Ų | 46.3 | 31% | 0.308 | 24% | 0.238 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -110.1 | 6.9 | -175.9 | -61.3 | -173.5 | 6.3 | 0 | 0 | 113.2 | V98 P103 R104 I105 G161 | V98-Q101 HydrophobicContact CB-CB 4.3Å; V98-Q101 HydrophobicContact CB-CG 4.46Å; V98-Q101 HydrophobicContact CG1-CB 4.35Å; V98-Q101 HydrophobicContact CG1-CG 4.08Å; V98-Q101 PolarHBondContact O-N 3.21Å; Q101-P103 VanDerWaalsContact C-N 3.32Å; Q101-R104 WeakPolarHBondContact O-CA 3.3Å; Q101-R104 WeakPolarHBondContact O-CB 3.44Å; Q101-R104 PolarHBondContact O-N 2.89Å; Q101-I105 WeakPolarHBondContact O-CG1 3.49Å; Q101-I105 PolarHBondContact O-N 3.5Å; Q101-G161 VanDerWaalsContact OE1-CA 3.3Å |
| 102 | L | 89.5 | Confident | 90.3 | Very high | 0 Ų | 0 | 50.2 Ų | 50.2 | 0% | 0 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -50.9 | -41.2 | 177.9 | -69.1 | 172.8 | 0 | 0 | 0 | 114.3 | R34 V36 V48 F66 P97 V98 R104 I105 F106 | R34-L102 HydrophobicContact CB-CD1 3.63Å; R34-L102 HydrophobicContact CG-CD1 4.45Å; V36-L102 HydrophobicContact CG2-CB 3.62Å; V48-L102 HydrophobicContact CG1-CD1 3.85Å; V48-L102 HydrophobicContact CG2-CB 4.2Å; F66-L102 HydrophobicContact CB-CD1 4.41Å; F66-L102 HydrophobicContact CB-CD2 4.06Å; F66-L102 HydrophobicContact CD1-CD2 4.5Å; F66-L102 HydrophobicContact CG-CD2 4.11Å; P97-L102 HydrophobicContact CB-CD2 3.74Å; P97-L102 HydrophobicContact CG-CD2 3.93Å; V98-L102 PolarHBondContact O-N 3.26Å; L102-R104 VanDerWaalsContact C-N 3.29Å; L102-R104 PolarHBondContact O-N 3.33Å; L102-I105 HydrophobicContact CD2-CD1 4.48Å; L102-I105 PolarHBondContact O-N 3.04Å; L102-F106 WeakPolarHBondContact O-CB 3.34Å; L102-F106 PolarHBondContact O-N 2.84Å |
| 103 | P | 90.3 | Very high | 89.9 | Confident | 6 Ų | 6 | 46 Ų | 46 | 4% | 0.039 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -62.3 | -38 | 177 | -23.4 | 35.6 | 0 | 0 | 0 | 112.3 | V36 V44 Q45 V48 Q101 T107 | V36-P103 HydrophobicContact CG1-CB 4.25Å; V36-P103 HydrophobicContact CG1-CG 4.26Å; V36-P103 HydrophobicContact CG2-CG 4.31Å; V44-P103 HydrophobicContact CG1-CB 3.96Å; Q45-P103 WeakPolarHBondContact O-CG 3.36Å; V48-P103 HydrophobicContact CG2-CG 3.72Å; Q101-P103 VanDerWaalsContact C-N 3.32Å; P103-T107 WeakPolarHBondContact O-CB 3.4Å; P103-T107 WeakPolarHBondContact O-CG2 3.36Å; P103-T107 PolarHBondContact O-N 2.88Å; P103-T107 PolarHBondContact O-OG1 3.43Å |
| 104 | R | 90.7 | Very high | 89.5 | Confident | 159 Ų | 159 | 47.5 Ų | 47.5 | 60% | 0.6 | 25% | 0.251 | S | S | * | . | H | α-helix | trans | -69.5 | -41.8 | 176.8 | -171 | 179.7 | -179.5 | -169.5 | -0.7 | 111.5 | Q101 L102 T107 S108 | Q101-R104 WeakPolarHBondContact O-CA 3.3Å; Q101-R104 WeakPolarHBondContact O-CB 3.44Å; Q101-R104 PolarHBondContact O-N 2.89Å; L102-R104 VanDerWaalsContact C-N 3.29Å; L102-R104 PolarHBondContact O-N 3.33Å; R104-T107 WeakPolarHBondContact CA-OG1 3.25Å; R104-T107 PolarHBondContact O-N 3.34Å; R104-T107 PolarHBondContact O-OG1 3.06Å; R104-T107 VanDerWaalsContact O-OG1 3.08Å; R104-S108 VanDerWaalsContact O-CB 3.3Å; R104-S108 WeakPolarHBondContact O-CB 3.35Å; R104-S108 PolarHBondContact O-N 2.74Å; R104-S108 PolarHBondContact O-OG 3.19Å |
| 105 | I | 90.1 | Very high | 89.1 | Confident | 3 Ų | 3 | 51.8 Ų | 51.8 | 2% | 0.015 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -61.2 | -47.6 | 176.8 | -64.8 | 168.2 | 0 | 0 | 0 | 109.8 | P97 Q101 L102 T107 S108 I109 G110 Y113 G161 | P97-I105 HydrophobicContact CB-CD1 4.07Å; Q101-I105 WeakPolarHBondContact O-CG1 3.49Å; Q101-I105 PolarHBondContact O-N 3.5Å; L102-I105 HydrophobicContact CD2-CD1 4.48Å; L102-I105 PolarHBondContact O-N 3.04Å; I105-T107 PolarHBondContact O-N 3.42Å; I105-S108 PolarHBondContact O-N 3.31Å; I105-I109 HydrophobicContact CG2-CD1 4.23Å; I105-I109 WeakPolarHBondContact O-CB 3.48Å; I105-I109 PolarHBondContact O-N 3.42Å; I105-G110 PolarHBondContact O-N 2.91Å; I105-Y113 HydrophobicContact CG2-CD1 4.03Å; I105-Y113 HydrophobicContact CG2-CD2 4.43Å; I105-Y113 HydrophobicContact CG2-CG 3.8Å; I105-G161 WeakPolarHBondContact CD1-O 3.49Å |
| 106 | F | 89.6 | Confident | 88.7 | Confident | 41 Ų | 41 | 58.9 Ų | 58.9 | 18% | 0.18 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -62.6 | -42.2 | 179.1 | 178.2 | -114.1 | 0 | 0 | 0 | 112.8 | V44 I64 F66 L102 G110 E111 | V44-F106 HydrophobicContact CG1-CD1 4.21Å; V44-F106 HydrophobicContact CG2-CD1 3.69Å; V44-F106 HydrophobicContact CG2-CE1 3.67Å; I64-F106 HydrophobicContact CD1-CD1 4.06Å; I64-F106 HydrophobicContact CD1-CD2 4.38Å; I64-F106 HydrophobicContact CD1-CE1 3.38Å; I64-F106 HydrophobicContact CD1-CE2 3.72Å; I64-F106 HydrophobicContact CD1-CZ 3.2Å; I64-F106 HydrophobicContact CG1-CZ 4.45Å; I64-F106 HydrophobicContact CG2-CD2 4.48Å; I64-F106 HydrophobicContact CG2-CE2 4.35Å; F66-F106 HydrophobicContact CE2-CB 4.18Å; F66-F106 HydrophobicContact CE2-CD2 4.39Å; F66-F106 HydrophobicContact CE2-CG 4.42Å; F66-F106 HydrophobicContact CZ-CB 3.79Å; F66-F106 AromaticContact CZ-CD2 3.73Å; F66-F106 HydrophobicContact CZ-CD2 3.73Å; F66-F106 HydrophobicContact CZ-CG 4.05Å; L102-F106 WeakPolarHBondContact O-CB 3.34Å; L102-F106 PolarHBondContact O-N 2.84Å; F106-G110 WeakPolarHBondContact O-CA 3.36Å; F106-G110 PolarHBondContact O-N 3.48Å; F106-E111 HydrophobicContact CD2-CG 3.93Å; F106-E111 HydrophobicContact CE2-CG 3.69Å |
| 107 | T | 88 | Confident | 88.5 | Confident | 91 Ų | 91 | 55.7 Ų | 55.7 | 56% | 0.558 | 29% | 0.286 | S | S | * | . | H | α-helix | trans | -73.9 | -35.4 | -179.5 | 47.5 | 0 | 0 | 0 | 0 | 113.7 | V44 P103 R104 I105 | V44-T107 HydrophobicContact CB-CG2 3.81Å; V44-T107 HydrophobicContact CG1-CG2 4.1Å; V44-T107 HydrophobicContact CG2-CG2 3.66Å; P103-T107 WeakPolarHBondContact O-CB 3.4Å; P103-T107 WeakPolarHBondContact O-CG2 3.36Å; P103-T107 PolarHBondContact O-N 2.88Å; P103-T107 PolarHBondContact O-OG1 3.43Å; R104-T107 WeakPolarHBondContact CA-OG1 3.25Å; R104-T107 PolarHBondContact O-N 3.34Å; R104-T107 PolarHBondContact O-OG1 3.06Å; R104-T107 VanDerWaalsContact O-OG1 3.08Å; I105-T107 PolarHBondContact O-N 3.42Å |
| 108 | S | 87.6 | Confident | 88.4 | Confident | 82 Ų | 82 | 55.7 Ų | 55.7 | 57% | 0.573 | 29% | 0.286 | S | S | * | . | H | α-helix | trans | -88.1 | -37.4 | -175.8 | 59.2 | 0 | 0 | 0 | 0 | 114 | R104 I105 | R104-S108 VanDerWaalsContact O-CB 3.3Å; R104-S108 WeakPolarHBondContact O-CB 3.35Å; R104-S108 PolarHBondContact O-N 2.74Å; R104-S108 PolarHBondContact O-OG 3.19Å; I105-S108 PolarHBondContact O-N 3.31Å |
| 109 | I | 86.6 | Confident | 88.4 | Confident | 25 Ų | 25 | 56 Ų | 56 | 13% | 0.128 | 29% | 0.289 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -115.3 | -41 | -172 | -57 | 153.7 | 0 | 0 | 0 | 111.4 | I105 R116 V117 F160 | I105-I109 HydrophobicContact CG2-CD1 4.23Å; I105-I109 WeakPolarHBondContact O-CB 3.48Å; I105-I109 PolarHBondContact O-N 3.42Å; I109-R116 HydrophobicContact CG2-CB 4.28Å; I109-R116 PolarHBondContact O-NH1 3.15Å; I109-V117 HydrophobicContact CD1-CG2 3.72Å; I109-V117 HydrophobicContact CG1-CG2 4.02Å; I109-V117 HydrophobicContact CG2-CG2 3.8Å; I109-F160 HydrophobicContact CD1-CB 4.48Å; I109-F160 HydrophobicContact CD1-CD1 4.34Å |
| 110 | G | 85.9 | Confident | 88.5 | Confident | 16 Ų | 16 | 57.7 Ų | 57.7 | 17% | 0.165 | 30% | 0.302 | C | S | . | . | trans | 106.9 | -169.5 | -175.2 | 0 | 0 | 0 | 0 | 0 | 113.4 | I105 F106 | I105-G110 PolarHBondContact O-N 2.91Å; F106-G110 WeakPolarHBondContact O-CA 3.36Å; F106-G110 PolarHBondContact O-N 3.48Å | ||
| 111 | E | 84.6 | Confident | 88.8 | Confident | 111 Ų | 111 | 53.8 Ų | 53.8 | 52% | 0.519 | 27% | 0.274 | S | S | . | . | S | Bend | trans | -69.3 | -34 | 178.2 | -61.4 | -179.3 | 179.2 | 0 | 0 | 111.7 | I64 F66 F106 Y113 | I64-E111 HydrophobicContact CG2-CG 4.29Å; I64-E111 WeakPolarHBondContact CG2-OE1 3.27Å; F66-E111 HydrophobicContact CZ-CG 4.46Å; F106-E111 HydrophobicContact CD2-CG 3.93Å; F106-E111 HydrophobicContact CE2-CG 3.69Å; E111-Y113 VanDerWaalsContact O-CD1 3.3Å; E111-Y113 WeakPolarHBondContact O-CD1 3.38Å; E111-Y113 PolarHBondContact O-N 2.88Å |
| 112 | D | 87.5 | Confident | 89 | Confident | 82 Ų | 82 | 50.7 Ų | 50.7 | 44% | 0.439 | 26% | 0.259 | S | S | . | . | trans | -83 | 40.8 | -179.5 | -49 | -44.7 | 0 | 0 | 0 | 113.1 | D114 E115 R116 | D112-D114 VanDerWaalsContact C-N 3.27Å; D112-D114 PolarHBondContact O-N 2.93Å; D112-E115 PolarHBondContact O-N 3.31Å; D112-R116 WeakPolarHBondContact O-CG 3.47Å; D112-R116 PolarHBondContact O-N 3.49Å | ||
| 113 | Y | 85.8 | Confident | 89.3 | Confident | 4 Ų | 4 | 52.6 Ų | 52.6 | 2% | 0.016 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -66.4 | -30.8 | -174.2 | 68.7 | -91.7 | 0 | 0 | 0 | 113.1 | F66 R71 F95 P97 I105 E111 V117 L162 | F66-Y113 HydrophobicContact CD1-CE1 4.02Å; F66-Y113 HydrophobicContact CE1-CD1 4.31Å; F66-Y113 HydrophobicContact CE1-CE1 4.27Å; R71-Y113 PolarHBondContact NH2-OH 3.42Å; F95-Y113 AromaticContact CE2-CE2 4Å; F95-Y113 HydrophobicContact CE2-CE2 4Å; P97-Y113 HydrophobicContact CB-CE2 4.38Å; I105-Y113 HydrophobicContact CG2-CD1 4.03Å; I105-Y113 HydrophobicContact CG2-CD2 4.43Å; I105-Y113 HydrophobicContact CG2-CG 3.8Å; E111-Y113 VanDerWaalsContact O-CD1 3.3Å; E111-Y113 WeakPolarHBondContact O-CD1 3.38Å; E111-Y113 PolarHBondContact O-N 2.88Å; Y113-V117 WeakPolarHBondContact O-CB 3.22Å; Y113-V117 PolarHBondContact O-N 3.37Å; Y113-V117 VanDerWaalsContact O-N 3.09Å; Y113-L162 HydrophobicContact CD2-CD1 4.42Å; Y113-L162 HydrophobicContact CD2-CD2 3.54Å; Y113-L162 HydrophobicContact CE2-CD2 3.54Å |
| 114 | D | 85.8 | Confident | 89.5 | Confident | 31 Ų | 31 | 56.8 Ų | 56.8 | 17% | 0.166 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -71.6 | -39.4 | 179 | 55.5 | -9.6 | 0 | 0 | 0 | 112.3 | R71 F95 D112 L118 | R71-D114 IonicContact CZ-OD2 3.48Å; R71-D114 IonicContact NH1-OD2 2.71Å; R71-D114 PolarHBondContact NH1-OD2 2.92Å; R71-D114 IonicContact NH2-OD2 2.97Å; R71-D114 PolarHBondContact NH2-OD2 3.33Å; F95-D114 HydrophobicContact CE2-CB 3.71Å; F95-D114 HydrophobicContact CZ-CB 3.55Å; D112-D114 VanDerWaalsContact C-N 3.27Å; D112-D114 PolarHBondContact O-N 2.93Å; D114-L118 HydrophobicContact CB-CD1 4.13Å; D114-L118 WeakPolarHBondContact O-CB 3.33Å |
| 115 | E | 87.3 | Confident | 89.7 | Confident | 131 Ų | 131 | 49.4 Ų | 49.4 | 61% | 0.612 | 26% | 0.263 | S | S | * | . | H | α-helix | trans | -73.8 | -33.2 | 177.6 | -64.4 | -160.1 | 155.5 | 0 | 0 | 113.4 | D112 P119 | D112-E115 PolarHBondContact O-N 3.31Å; E115-P119 VanDerWaalsContact O-CD 3.25Å; E115-P119 WeakPolarHBondContact O-CD 3.37Å; E115-P119 WeakPolarHBondContact O-CG 3.46Å |
| 116 | R | 86.6 | Confident | 89.9 | Confident | 153 Ų | 153 | 49.3 Ų | 49.3 | 58% | 0.577 | 26% | 0.262 | S | S | * | . | H | α-helix | trans | -84 | -47.7 | -176.5 | -69.9 | -179.4 | 178.5 | 168.5 | 2.5 | 113.2 | I109 D112 | I109-R116 HydrophobicContact CG2-CB 4.28Å; I109-R116 PolarHBondContact O-NH1 3.15Å; D112-R116 WeakPolarHBondContact O-CG 3.47Å; D112-R116 PolarHBondContact O-N 3.49Å |
| 117 | V | 89.9 | Confident | 90.1 | Very high | 12 Ų | 12 | 52 Ų | 52 | 7% | 0.073 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -85 | -50.5 | -169.4 | 178.9 | 0 | 0 | 0 | 0 | 111.3 | I109 Y113 S120 I121 F160 L162 | I109-V117 HydrophobicContact CD1-CG2 3.72Å; I109-V117 HydrophobicContact CG1-CG2 4.02Å; I109-V117 HydrophobicContact CG2-CG2 3.8Å; Y113-V117 WeakPolarHBondContact O-CB 3.22Å; Y113-V117 PolarHBondContact O-N 3.37Å; Y113-V117 VanDerWaalsContact O-N 3.09Å; V117-S120 WeakPolarHBondContact O-CB 3.33Å; V117-S120 PolarHBondContact O-N 3.31Å; V117-S120 VanDerWaalsContact O-N 3.12Å; V117-I121 HydrophobicContact CG1-CD1 4.16Å; V117-I121 HydrophobicContact CG1-CG1 4.46Å; V117-I121 HydrophobicContact CG1-CG2 3.99Å; V117-I121 WeakPolarHBondContact O-CG1 3.46Å; V117-I121 PolarHBondContact O-N 2.85Å; V117-F160 HydrophobicContact CG1-CB 4.04Å; V117-F160 HydrophobicContact CG1-CD1 4.21Å; V117-F160 HydrophobicContact CG1-CD2 3.79Å; V117-F160 HydrophobicContact CG1-CE2 4.29Å; V117-F160 HydrophobicContact CG1-CG 3.74Å; V117-F160 HydrophobicContact CG2-CD1 4.46Å; V117-L162 HydrophobicContact CB-CD1 4.43Å; V117-L162 HydrophobicContact CG1-CD1 4.17Å |
| 118 | L | 90.3 | Very high | 90.4 | Very high | 1 Ų | 1 | 50 Ų | 50 | 1% | 0.005 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -59 | -48.1 | -170.1 | -66.1 | 172.1 | 0 | 0 | 0 | 113.2 | R73 F95 D114 S120 I121 T122 L162 L164 | R73-L118 HydrophobicContact CG-CD1 4.46Å; F95-L118 HydrophobicContact CD1-CD1 3.53Å; F95-L118 HydrophobicContact CD2-CD1 3.77Å; F95-L118 HydrophobicContact CE1-CD1 3.43Å; F95-L118 VanDerWaalsContact CE1-CD1 3.43Å; F95-L118 HydrophobicContact CE2-CD1 3.66Å; F95-L118 HydrophobicContact CG-CD1 3.71Å; F95-L118 HydrophobicContact CG-CD2 4.42Å; F95-L118 HydrophobicContact CZ-CD1 3.49Å; F95-L118 VanDerWaalsContact CZ-CD1 3.49Å; D114-L118 HydrophobicContact CB-CD1 4.13Å; D114-L118 WeakPolarHBondContact O-CB 3.33Å; L118-S120 VanDerWaalsContact C-N 3.27Å; L118-S120 PolarHBondContact O-N 2.96Å; L118-I121 HydrophobicContact CD2-CD1 4.43Å; L118-T122 WeakPolarHBondContact O-CB 3.45Å; L118-T122 PolarHBondContact O-N 3.27Å; L118-T122 PolarHBondContact O-OG1 2.83Å; L118-L162 HydrophobicContact CD2-CD1 3.94Å; L118-L162 HydrophobicContact CG-CD1 4.34Å; L118-L164 HydrophobicContact CD2-CD2 4.47Å |
| 119 | P | 92.3 | Very high | 90.7 | Very high | 34 Ų | 34 | 46.1 Ų | 46.1 | 22% | 0.221 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -64.5 | -33.8 | 179.7 | -22.3 | 36 | 0 | 0 | 0 | 112.5 | V75 E115 T123 | V75-P119 HydrophobicContact CG1-CB 4.37Å; E115-P119 VanDerWaalsContact O-CD 3.25Å; E115-P119 WeakPolarHBondContact O-CD 3.37Å; E115-P119 WeakPolarHBondContact O-CG 3.46Å; P119-T123 VanDerWaalsContact O-CB 3.23Å; P119-T123 WeakPolarHBondContact O-CB 3.38Å; P119-T123 PolarHBondContact O-N 3.15Å; P119-T123 PolarHBondContact O-OG1 3.38Å |
| 120 | S | 92.9 | Very high | 91.1 | Very high | 75 Ų | 75 | 45 Ų | 45 | 52% | 0.524 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -68 | -56.5 | -179.5 | -177.7 | 0 | 0 | 0 | 0 | 111.3 | V117 L118 T122 T123 E124 | V117-S120 WeakPolarHBondContact O-CB 3.33Å; V117-S120 PolarHBondContact O-N 3.31Å; V117-S120 VanDerWaalsContact O-N 3.12Å; L118-S120 VanDerWaalsContact C-N 3.27Å; L118-S120 PolarHBondContact O-N 2.96Å; S120-T122 VanDerWaalsContact C-N 3.31Å; S120-T122 PolarHBondContact O-N 3.21Å; S120-T123 PolarHBondContact O-N 3.1Å; S120-E124 PolarHBondContact O-N 2.91Å; S120-E124 VanDerWaalsContact O-N 3.08Å |
| 121 | I | 94.3 | Very high | 91.5 | Very high | 6 Ų | 6 | 46.7 Ų | 46.7 | 3% | 0.031 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -65.2 | -37.3 | -178.9 | 65.6 | 172.9 | 0 | 0 | 0 | 111.6 | V117 L118 E124 V125 L153 A157 F160 | V117-I121 HydrophobicContact CG1-CD1 4.16Å; V117-I121 HydrophobicContact CG1-CG1 4.46Å; V117-I121 HydrophobicContact CG1-CG2 3.99Å; V117-I121 WeakPolarHBondContact O-CG1 3.46Å; V117-I121 PolarHBondContact O-N 2.85Å; L118-I121 HydrophobicContact CD2-CD1 4.43Å; I121-E124 PolarHBondContact O-N 3.21Å; I121-V125 WeakPolarHBondContact O-CB 3.21Å; I121-V125 WeakPolarHBondContact O-CG2 3.39Å; I121-V125 PolarHBondContact O-N 2.91Å; I121-L153 HydrophobicContact CB-CD1 4.32Å; I121-L153 HydrophobicContact CD1-CD1 4.02Å; I121-L153 HydrophobicContact CG1-CD1 3.85Å; I121-A157 HydrophobicContact CD1-CB 4.05Å; I121-F160 HydrophobicContact CG2-CD2 4.16Å; I121-F160 HydrophobicContact CG2-CE2 3.68Å; I121-F160 HydrophobicContact CG2-CZ 4.46Å |
| 122 | T | 94.4 | Very high | 91.9 | Very high | 1 Ų | 1 | 48 Ų | 48 | 1% | 0.006 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -65.7 | -45.3 | 179.8 | -59.4 | 0 | 0 | 0 | 0 | 110.7 | V75 V77 L91 I93 L118 S120 E124 L126 | V75-T122 HydrophobicContact CB-CG2 4.14Å; V75-T122 HydrophobicContact CG1-CG2 4.15Å; V77-T122 HydrophobicContact CG2-CG2 4.47Å; L91-T122 HydrophobicContact CB-CG2 4.17Å; L91-T122 HydrophobicContact CD2-CG2 3.49Å; L91-T122 VanDerWaalsContact CD2-CG2 3.49Å; L91-T122 HydrophobicContact CG-CG2 4.48Å; I93-T122 HydrophobicContact CD1-CG2 4.1Å; I93-T122 WeakPolarHBondContact CD1-OG1 3.38Å; L118-T122 WeakPolarHBondContact O-CB 3.45Å; L118-T122 PolarHBondContact O-N 3.27Å; L118-T122 PolarHBondContact O-OG1 2.83Å; S120-T122 VanDerWaalsContact C-N 3.31Å; S120-T122 PolarHBondContact O-N 3.21Å; T122-E124 VanDerWaalsContact C-N 3.32Å; T122-E124 PolarHBondContact O-N 3.44Å; T122-L126 WeakPolarHBondContact O-CB 3.37Å; T122-L126 PolarHBondContact O-N 3.17Å |
| 123 | T | 94.3 | Very high | 92.2 | Very high | 41 Ų | 41 | 45.1 Ų | 45.1 | 25% | 0.252 | 23% | 0.227 | S | C | . | . | H | α-helix | trans | -63.8 | -40.6 | 178.8 | -60.8 | 0 | 0 | 0 | 0 | 111.2 | V77 P119 S120 K127 | V77-T123 HydrophobicContact CG1-CG2 4.1Å; P119-T123 VanDerWaalsContact O-CB 3.23Å; P119-T123 WeakPolarHBondContact O-CB 3.38Å; P119-T123 PolarHBondContact O-N 3.15Å; P119-T123 PolarHBondContact O-OG1 3.38Å; S120-T123 PolarHBondContact O-N 3.1Å; T123-K127 HydrophobicContact CG2-CD 3.96Å; T123-K127 VanDerWaalsContact O-CB 3.31Å; T123-K127 WeakPolarHBondContact O-CB 3.32Å; T123-K127 WeakPolarHBondContact O-CD 3.2Å; T123-K127 WeakPolarHBondContact O-CG 3.24Å; T123-K127 PolarHBondContact O-N 3.25Å; T123-K127 VanDerWaalsContact O-N 3.12Å |
| 124 | E | 94.7 | Very high | 92.6 | Very high | 94 Ų | 94 | 47.4 Ų | 47.4 | 44% | 0.439 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -63.5 | -55.1 | 177.9 | -174.3 | -167.5 | 145.7 | 0 | 0 | 111.9 | S120 I121 T122 L126 K127 S128 R156 | S120-E124 PolarHBondContact O-N 2.91Å; S120-E124 VanDerWaalsContact O-N 3.08Å; I121-E124 PolarHBondContact O-N 3.21Å; T122-E124 VanDerWaalsContact C-N 3.32Å; T122-E124 PolarHBondContact O-N 3.44Å; E124-L126 PolarHBondContact O-N 2.93Å; E124-K127 PolarHBondContact O-N 2.99Å; E124-S128 PolarHBondContact O-N 3.37Å; E124-R156 IonicContact OE1-CZ 2.84Å; E124-R156 IonicContact OE1-NE 2.7Å; E124-R156 IonicContact OE1-NH2 3.59Å; E124-R156 PolarHBondContact OE1-NH2 2.98Å |
| 125 | V | 95.3 | Very high | 92.9 | Very high | 4 Ų | 4 | 45.9 Ų | 45.9 | 2% | 0.024 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -64.2 | -43 | -177.7 | 173.2 | 0 | 0 | 0 | 0 | 110.9 | I121 K127 S128 V129 D152 L153 R156 | I121-V125 WeakPolarHBondContact O-CB 3.21Å; I121-V125 WeakPolarHBondContact O-CG2 3.39Å; I121-V125 PolarHBondContact O-N 2.91Å; V125-K127 VanDerWaalsContact C-N 3.33Å; V125-K127 PolarHBondContact O-N 3.1Å; V125-S128 PolarHBondContact O-N 3.03Å; V125-S128 PolarHBondContact O-OG 3.18Å; V125-V129 HydrophobicContact CG1-CG2 4.23Å; V125-V129 WeakPolarHBondContact O-CG2 3.31Å; V125-V129 PolarHBondContact O-N 3.41Å; V125-D152 HydrophobicContact CG1-CB 3.63Å; V125-L153 HydrophobicContact CB-CD1 4.22Å; V125-L153 HydrophobicContact CG1-CB 4.26Å; V125-L153 HydrophobicContact CG2-CD1 4.11Å; V125-R156 HydrophobicContact CG2-CG 3.88Å |
| 126 | L | 94.4 | Very high | 93 | Very high | 0 Ų | 0 | 41.4 Ų | 41.4 | 0% | 0 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -64.2 | -41.4 | 180 | -164.1 | 75.1 | 0 | 0 | 0 | 111.3 | V77 I89 T122 E124 S128 V130 V149 L169 | V77-L126 HydrophobicContact CB-CD2 3.55Å; V77-L126 HydrophobicContact CG1-CD2 3.81Å; V77-L126 HydrophobicContact CG2-CD2 3.99Å; I89-L126 HydrophobicContact CB-CD2 3.92Å; I89-L126 HydrophobicContact CD1-CD2 4.34Å; I89-L126 HydrophobicContact CG2-CD1 4.43Å; I89-L126 HydrophobicContact CG2-CD2 3.96Å; T122-L126 WeakPolarHBondContact O-CB 3.37Å; T122-L126 PolarHBondContact O-N 3.17Å; E124-L126 PolarHBondContact O-N 2.93Å; L126-S128 VanDerWaalsContact C-N 3.34Å; L126-S128 PolarHBondContact O-N 3.14Å; L126-V130 HydrophobicContact CD1-CG2 4.19Å; L126-V130 HydrophobicContact CG-CG2 4.07Å; L126-V130 WeakPolarHBondContact O-CB 3.36Å; L126-V130 WeakPolarHBondContact O-CG2 3.39Å; L126-V130 PolarHBondContact O-N 3.15Å; L126-V149 HydrophobicContact CD1-CG1 4.13Å; L126-V149 HydrophobicContact CD1-CG2 3.98Å; L126-L169 HydrophobicContact CD1-CD2 4.02Å |
| 127 | K | 93.9 | Very high | 93.2 | Very high | 98 Ų | 98 | 37 Ų | 37 | 43% | 0.426 | 21% | 0.206 | S | C | . | . | H | α-helix | trans | -62.9 | -40.5 | 175.2 | -76.2 | 176.1 | 177.2 | -179 | 0 | 112.1 | T79 T123 E124 V125 A131 | T79-K127 WeakPolarHBondContact OG1-CG 3.34Å; T123-K127 HydrophobicContact CG2-CD 3.96Å; T123-K127 VanDerWaalsContact O-CB 3.31Å; T123-K127 WeakPolarHBondContact O-CB 3.32Å; T123-K127 WeakPolarHBondContact O-CD 3.2Å; T123-K127 WeakPolarHBondContact O-CG 3.24Å; T123-K127 PolarHBondContact O-N 3.25Å; T123-K127 VanDerWaalsContact O-N 3.12Å; E124-K127 PolarHBondContact O-N 2.99Å; V125-K127 VanDerWaalsContact C-N 3.33Å; V125-K127 PolarHBondContact O-N 3.1Å; K127-A131 WeakPolarHBondContact O-CB 3.36Å; K127-A131 PolarHBondContact O-N 2.92Å |
| 128 | S | 94.8 | Very high | 93.3 | Very high | 49 Ų | 49 | 36.6 Ų | 36.6 | 34% | 0.343 | 20% | 0.204 | S | C | . | . | H | α-helix | trans | -71 | -37.3 | -177.7 | 75.4 | 0 | 0 | 0 | 0 | 112.9 | E124 V125 L126 R132 | E124-S128 PolarHBondContact O-N 3.37Å; V125-S128 PolarHBondContact O-N 3.03Å; V125-S128 PolarHBondContact O-OG 3.18Å; L126-S128 VanDerWaalsContact C-N 3.34Å; L126-S128 PolarHBondContact O-N 3.14Å; S128-R132 WeakPolarHBondContact O-CG 3.03Å; S128-R132 PolarHBondContact O-NE 3.36Å |
| 129 | V | 94.1 | Very high | 93.3 | Very high | 0 Ų | 0 | 41.1 Ų | 41.1 | 0% | 0 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -76.2 | -49.1 | 178 | 178.7 | 0 | 0 | 0 | 0 | 110.5 | V125 A131 R132 F133 V145 Q148 V149 | V125-V129 HydrophobicContact CG1-CG2 4.23Å; V125-V129 WeakPolarHBondContact O-CG2 3.31Å; V125-V129 PolarHBondContact O-N 3.41Å; V129-A131 VanDerWaalsContact C-N 3.27Å; V129-A131 PolarHBondContact O-N 2.91Å; V129-R132 WeakPolarHBondContact O-CB 3.35Å; V129-R132 PolarHBondContact O-N 2.95Å; V129-F133 HydrophobicContact CG1-CD2 4.24Å; V129-F133 HydrophobicContact CG1-CE2 3.86Å; V129-F133 VanDerWaalsContact O-CD2 3.32Å; V129-F133 WeakPolarHBondContact O-CD2 3.39Å; V129-V145 HydrophobicContact CG1-CG1 4.31Å; V129-Q148 HydrophobicContact CG1-CB 4.33Å; V129-Q148 HydrophobicContact CG1-CG 4.14Å; V129-Q148 HydrophobicContact CG2-CG 4.38Å; V129-V149 HydrophobicContact CB-CG2 3.93Å; V129-V149 HydrophobicContact CG1-CG2 3.78Å; V129-V149 HydrophobicContact CG2-CG2 4.17Å |
| 130 | V | 93.5 | Very high | 93.2 | Very high | 1 Ų | 1 | 44.7 Ų | 44.7 | 1% | 0.006 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -64.2 | -31.9 | -176.4 | 175.2 | 0 | 0 | 0 | 0 | 112.1 | T79 I89 L126 R132 F133 L138 | T79-V130 HydrophobicContact CG2-CB 3.81Å; T79-V130 HydrophobicContact CG2-CG1 3.57Å; T79-V130 HydrophobicContact CG2-CG2 4.12Å; I89-V130 HydrophobicContact CD1-CG1 4.33Å; I89-V130 HydrophobicContact CD1-CG2 3.71Å; L126-V130 HydrophobicContact CD1-CG2 4.19Å; L126-V130 HydrophobicContact CG-CG2 4.07Å; L126-V130 WeakPolarHBondContact O-CB 3.36Å; L126-V130 WeakPolarHBondContact O-CG2 3.39Å; L126-V130 PolarHBondContact O-N 3.15Å; V130-R132 PolarHBondContact O-N 3.32Å; V130-R132 VanDerWaalsContact O-N 3.1Å; V130-F133 PolarHBondContact O-N 2.99Å; V130-F133 VanDerWaalsContact O-N 3.17Å; V130-F133 VanDerWaalsContact O-O 3.12Å; V130-L138 HydrophobicContact CG1-CD1 3.8Å; V130-L138 HydrophobicContact CG1-CD2 4.3Å; V130-L138 HydrophobicContact CG2-CD2 4.45Å |
| 131 | A | 94 | Very high | 93.2 | Very high | 52 Ų | 52 | 45.3 Ų | 45.3 | 43% | 0.43 | 24% | 0.243 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -64.2 | -12.6 | 174.8 | 0 | 0 | 0 | 0 | 0 | 114.2 | K82 K127 V129 | K82-A131 WeakPolarHBondContact CB-O 3.49Å; K127-A131 WeakPolarHBondContact O-CB 3.36Å; K127-A131 PolarHBondContact O-N 2.92Å; V129-A131 VanDerWaalsContact C-N 3.27Å; V129-A131 PolarHBondContact O-N 2.91Å |
| 132 | R | 94.3 | Very high | 93 | Very high | 139 Ų | 139 | 49.7 Ų | 49.7 | 53% | 0.525 | 26% | 0.259 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -90.3 | -18.1 | 177.6 | -59.3 | 173.6 | -174.8 | 175.4 | 1.3 | 113.2 | K82 S128 V129 V130 | K82-R132 WeakPolarHBondContact CD-O 3.47Å; S128-R132 WeakPolarHBondContact O-CG 3.03Å; S128-R132 PolarHBondContact O-NE 3.36Å; V129-R132 WeakPolarHBondContact O-CB 3.35Å; V129-R132 PolarHBondContact O-N 2.95Å; V130-R132 PolarHBondContact O-N 3.32Å; V130-R132 VanDerWaalsContact O-N 3.1Å |
| 133 | F | 94.5 | Very high | 92.9 | Very high | 21 Ų | 21 | 55 Ų | 55 | 9% | 0.092 | 28% | 0.284 | C | S | . | . | S | Bend | trans | -110.8 | 146.1 | -174.9 | -67.5 | -80.7 | 0 | 0 | 0 | 111.6 | K82 V129 V130 E137 L138 L144 V145 Q148 | K82-F133 VanDerWaalsContact CB-O 3.25Å; K82-F133 WeakPolarHBondContact CB-O 3.29Å; K82-F133 PolarHBondContact N-O 3.03Å; V129-F133 HydrophobicContact CG1-CD2 4.24Å; V129-F133 HydrophobicContact CG1-CE2 3.86Å; V129-F133 VanDerWaalsContact O-CD2 3.32Å; V129-F133 WeakPolarHBondContact O-CD2 3.39Å; V130-F133 PolarHBondContact O-N 2.99Å; V130-F133 VanDerWaalsContact O-N 3.17Å; V130-F133 VanDerWaalsContact O-O 3.12Å; F133-E137 HydrophobicContact CB-CB 4.42Å; F133-E137 HydrophobicContact CD1-CB 4.28Å; F133-L138 HydrophobicContact CB-CD2 3.8Å; F133-L138 HydrophobicContact CB-CG 4.27Å; F133-L138 HydrophobicContact CG-CD2 4.46Å; F133-L144 HydrophobicContact CE1-CD2 3.7Å; F133-L144 HydrophobicContact CZ-CD2 3.5Å; F133-V145 HydrophobicContact CD1-CG2 4.16Å; F133-V145 HydrophobicContact CD2-CG2 3.97Å; F133-V145 HydrophobicContact CE1-CG2 4.21Å; F133-V145 HydrophobicContact CE2-CG2 4.03Å; F133-V145 HydrophobicContact CG-CG2 4.04Å; F133-V145 HydrophobicContact CZ-CG2 4.15Å; F133-Q148 VanDerWaalsContact CE2-OE1 3.3Å; F133-Q148 VanDerWaalsContact CZ-OE1 3.27Å |
| 134 | D | 94 | Very high | 92.9 | Very high | 52 Ų | 52 | 57.1 Ų | 57.1 | 28% | 0.278 | 29% | 0.293 | S | S | . | . | trans | -78.8 | 154.3 | 173.3 | -62.9 | -34.4 | 0 | 0 | 0 | 110.4 | K82 G136 E137 L138 | K82-D134 WeakPolarHBondContact CB-OD1 3.33Å; K82-D134 WeakPolarHBondContact CD-OD1 3.38Å; K82-D134 WeakPolarHBondContact CG-OD1 3.47Å; K82-D134 IonicContact NZ-OD1 3.77Å; K82-D134 IonicContact NZ-OD2 3.81Å; D134-G136 PolarHBondContact O-N 3.29Å; D134-G136 VanDerWaalsContact O-N 3.14Å; D134-E137 HydrophobicContact CB-CG 4.29Å; D134-E137 PolarHBondContact N-OE2 3.37Å; D134-E137 WeakPolarHBondContact O-CB 3.12Å; D134-E137 PolarHBondContact O-N 3.48Å; D134-L138 PolarHBondContact O-N 2.49Å | ||
| 135 | A | 91 | Very high | 92.8 | Very high | 0 Ų | 0 | 52.8 Ų | 52.8 | 0% | 0 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -53.9 | -37.1 | -178.3 | 0 | 0 | 0 | 0 | 0 | 113.7 | D83 Q85 L138 F174 F178 | D83-A135 PolarHBondContact OD1-N 3.27Å; Q85-A135 HydrophobicContact CB-CB 4.25Å; Q85-A135 HydrophobicContact CG-CB 4.34Å; A135-L138 PolarHBondContact O-N 2.91Å; A135-F174 HydrophobicContact CB-CD1 4.08Å; A135-F174 HydrophobicContact CB-CE1 3.58Å; A135-F174 HydrophobicContact CB-CZ 4.35Å; A135-F174 VanDerWaalsContact O-CZ 3.24Å; A135-F174 WeakPolarHBondContact O-CZ 3.5Å; A135-F178 HydrophobicContact CB-CE1 3.91Å; A135-F178 HydrophobicContact CB-CE2 4.08Å; A135-F178 HydrophobicContact CB-CZ 3.53Å |
| 136 | G | 89.3 | Confident | 92.7 | Very high | 37 Ų | 37 | 53.6 Ų | 53.6 | 38% | 0.381 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -69 | -31.2 | 176.1 | 0 | 0 | 0 | 0 | 0 | 114.2 | D134 I139 T140 | D134-G136 PolarHBondContact O-N 3.29Å; D134-G136 VanDerWaalsContact O-N 3.14Å; G136-I139 PolarHBondContact O-N 2.91Å; G136-T140 PolarHBondContact O-N 2.89Å; G136-T140 VanDerWaalsContact O-N 3.1Å; G136-T140 PolarHBondContact O-OG1 3.05Å |
| 137 | E | 92.2 | Very high | 92.6 | Very high | 60 Ų | 60 | 60.8 Ų | 60.8 | 28% | 0.28 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -72.6 | -33.6 | 177.4 | -63.5 | 179.9 | 142.4 | 0 | 0 | 111.2 | F133 D134 I139 T140 Q141 | F133-E137 HydrophobicContact CB-CB 4.42Å; F133-E137 HydrophobicContact CD1-CB 4.28Å; D134-E137 HydrophobicContact CB-CG 4.29Å; D134-E137 PolarHBondContact N-OE2 3.37Å; D134-E137 WeakPolarHBondContact O-CB 3.12Å; D134-E137 PolarHBondContact O-N 3.48Å; E137-I139 PolarHBondContact O-N 2.97Å; E137-T140 WeakPolarHBondContact CA-OG1 3.14Å; E137-T140 PolarHBondContact O-N 3.28Å; E137-Q141 WeakPolarHBondContact O-CA 3.5Å; E137-Q141 WeakPolarHBondContact O-CB 3.17Å; E137-Q141 PolarHBondContact O-N 3.38Å |
| 138 | L | 91.2 | Very high | 92.6 | Very high | 3 Ų | 3 | 58.8 Ų | 58.8 | 2% | 0.016 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -61.8 | -26.3 | 174.7 | -62 | 174.7 | 0 | 0 | 0 | 112.9 | V87 V130 F133 D134 A135 V145 L172 F174 | V87-L138 HydrophobicContact CG1-CD1 4.45Å; V87-L138 HydrophobicContact CG2-CD1 4Å; V130-L138 HydrophobicContact CG1-CD1 3.8Å; V130-L138 HydrophobicContact CG1-CD2 4.3Å; V130-L138 HydrophobicContact CG2-CD2 4.45Å; F133-L138 HydrophobicContact CB-CD2 3.8Å; F133-L138 HydrophobicContact CB-CG 4.27Å; F133-L138 HydrophobicContact CG-CD2 4.46Å; D134-L138 PolarHBondContact O-N 2.49Å; A135-L138 PolarHBondContact O-N 2.91Å; L138-V145 HydrophobicContact CD2-CG1 4.03Å; L138-V145 HydrophobicContact CD2-CG2 4.05Å; L138-L172 HydrophobicContact CB-CD1 4.09Å; L138-F174 HydrophobicContact CB-CZ 4.35Å; L138-F174 HydrophobicContact CD1-CE1 4.38Å |
| 139 | I | 89.3 | Confident | 92.7 | Very high | 96 Ų | 96 | 56.5 Ų | 56.5 | 49% | 0.492 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -84.1 | -50.9 | 175 | -56.8 | 174.3 | 0 | 0 | 0 | 110.4 | G136 E137 F174 | G136-I139 PolarHBondContact O-N 2.91Å; E137-I139 PolarHBondContact O-N 2.97Å; I139-F174 HydrophobicContact CD1-CD2 4.31Å; I139-F174 HydrophobicContact CD1-CE2 3.46Å; I139-F174 VanDerWaalsContact CD1-CE2 3.46Å; I139-F174 HydrophobicContact CD1-CZ 3.93Å; I139-F174 HydrophobicContact CG1-CE2 3.46Å; I139-F174 VanDerWaalsContact CG1-CE2 3.46Å; I139-F174 HydrophobicContact CG1-CZ 3.66Å |
| 140 | T | 90.6 | Very high | 92.7 | Very high | 110 Ų | 110 | 58 Ų | 58 | 68% | 0.675 | 29% | 0.293 | S | S | * | . | H | α-helix | trans | -79.1 | -36.2 | -170.4 | 52.5 | 0 | 0 | 0 | 0 | 113.3 | G136 E137 | G136-T140 PolarHBondContact O-N 2.89Å; G136-T140 VanDerWaalsContact O-N 3.1Å; G136-T140 PolarHBondContact O-OG1 3.05Å; E137-T140 WeakPolarHBondContact CA-OG1 3.14Å; E137-T140 PolarHBondContact O-N 3.28Å |
| 141 | Q | 93.1 | Very high | 92.8 | Very high | 87 Ų | 87 | 63 Ų | 63 | 41% | 0.407 | 32% | 0.32 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -112.7 | 32.2 | -176.7 | -58.5 | -174.1 | 6.6 | 0 | 0 | 112.4 | E137 E143 L144 V145 | E137-Q141 WeakPolarHBondContact O-CA 3.5Å; E137-Q141 WeakPolarHBondContact O-CB 3.17Å; E137-Q141 PolarHBondContact O-N 3.38Å; Q141-E143 PolarHBondContact O-N 3.5Å; Q141-E143 VanDerWaalsContact O-N 3.11Å; Q141-L144 HydrophobicContact CB-CB 4.4Å; Q141-L144 WeakPolarHBondContact O-CB 3.31Å; Q141-L144 PolarHBondContact O-N 3.2Å; Q141-V145 PolarHBondContact O-N 3.1Å |
| 142 | R | 91.1 | Very high | 92.9 | Very high | 99 Ų | 99 | 62.7 Ų | 62.7 | 37% | 0.374 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -51.8 | -38.6 | -176.7 | -171.4 | -176.6 | -168.1 | -132 | 12.6 | 114.1 | V145 S146 L169 T170 | R142-V145 PolarHBondContact O-N 3.21Å; R142-S146 WeakPolarHBondContact O-CB 3.46Å; R142-S146 PolarHBondContact O-N 2.93Å; R142-L169 HydrophobicContact CG-CD1 4.36Å; R142-L169 VanDerWaalsContact CZ-O 3.24Å; R142-L169 PolarHBondContact NH1-O 2.9Å; R142-L169 PolarHBondContact NH2-O 3.5Å; R142-T170 PolarHBondContact NH2-O 3.34Å |
| 143 | E | 91.7 | Very high | 92.9 | Very high | 111 Ų | 111 | 56.2 Ų | 56.2 | 52% | 0.519 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -63.5 | -41.8 | 179.7 | -179.3 | 60.8 | -161.3 | 0 | 0 | 111.9 | Q141 S146 R147 | Q141-E143 PolarHBondContact O-N 3.5Å; Q141-E143 VanDerWaalsContact O-N 3.11Å; E143-S146 PolarHBondContact O-N 3.01Å; E143-R147 WeakPolarHBondContact O-CG 3.2Å; E143-R147 PolarHBondContact O-N 2.94Å; E143-R147 IonicContact OE1-CZ 3.81Å; E143-R147 VanDerWaalsContact OE1-CZ 3.23Å; E143-R147 IonicContact OE1-NE 2.81Å; E143-R147 PolarHBondContact OE1-NE 3.01Å; E143-R147 IonicContact OE1-NH2 3.23Å; E143-R147 PolarHBondContact OE1-NH2 3.48Å |
| 144 | L | 93.1 | Very high | 92.9 | Very high | 86 Ų | 86 | 57.1 Ų | 57.1 | 45% | 0.45 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -65.1 | -44.9 | 177.9 | -176.5 | 150.5 | 0 | 0 | 0 | 110.6 | F133 Q141 S146 R147 Q148 | F133-L144 HydrophobicContact CE1-CD2 3.7Å; F133-L144 HydrophobicContact CZ-CD2 3.5Å; Q141-L144 HydrophobicContact CB-CB 4.4Å; Q141-L144 WeakPolarHBondContact O-CB 3.31Å; Q141-L144 PolarHBondContact O-N 3.2Å; L144-S146 PolarHBondContact O-N 3.41Å; L144-R147 PolarHBondContact O-N 2.77Å; L144-Q148 PolarHBondContact O-N 3.33Å |
| 145 | V | 93.1 | Very high | 93 | Very high | 4 Ų | 4 | 61.3 Ų | 61.3 | 2% | 0.024 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -62.4 | -43.6 | 176.3 | -178.6 | 0 | 0 | 0 | 0 | 110.7 | V129 F133 L138 Q141 R142 R147 Q148 V149 L169 | V129-V145 HydrophobicContact CG1-CG1 4.31Å; F133-V145 HydrophobicContact CD1-CG2 4.16Å; F133-V145 HydrophobicContact CD2-CG2 3.97Å; F133-V145 HydrophobicContact CE1-CG2 4.21Å; F133-V145 HydrophobicContact CE2-CG2 4.03Å; F133-V145 HydrophobicContact CG-CG2 4.04Å; F133-V145 HydrophobicContact CZ-CG2 4.15Å; L138-V145 HydrophobicContact CD2-CG1 4.03Å; L138-V145 HydrophobicContact CD2-CG2 4.05Å; Q141-V145 PolarHBondContact O-N 3.1Å; R142-V145 PolarHBondContact O-N 3.21Å; V145-R147 VanDerWaalsContact C-N 3.34Å; V145-R147 PolarHBondContact O-N 3.28Å; V145-Q148 PolarHBondContact O-N 3.18Å; V145-V149 HydrophobicContact CG1-CG2 4.33Å; V145-V149 VanDerWaalsContact O-CG2 3.29Å; V145-V149 WeakPolarHBondContact O-CG2 3.41Å; V145-V149 PolarHBondContact O-N 3.24Å; V145-L169 HydrophobicContact CG1-CD1 4.3Å |
| 146 | S | 92.7 | Very high | 93.2 | Very high | 21 Ų | 21 | 67 Ų | 67 | 15% | 0.147 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -61.1 | -42 | 179.2 | -160.4 | 0 | 0 | 0 | 0 | 112.1 | R142 E143 L144 S150 | R142-S146 WeakPolarHBondContact O-CB 3.46Å; R142-S146 PolarHBondContact O-N 2.93Å; E143-S146 PolarHBondContact O-N 3.01Å; L144-S146 PolarHBondContact O-N 3.41Å; S146-S150 WeakPolarHBondContact O-CB 3.19Å; S146-S150 PolarHBondContact O-N 3.12Å |
| 147 | R | 93.6 | Very high | 93.4 | Very high | 151 Ų | 151 | 65.3 Ų | 65.3 | 57% | 0.57 | 32% | 0.315 | S | S | * | . | H | α-helix | trans | -64.2 | -47.8 | 176.3 | -71.9 | 177 | -167.4 | 175.4 | 3.2 | 111.7 | E143 L144 V145 V149 S150 D151 | E143-R147 WeakPolarHBondContact O-CG 3.2Å; E143-R147 PolarHBondContact O-N 2.94Å; E143-R147 IonicContact OE1-CZ 3.81Å; E143-R147 VanDerWaalsContact OE1-CZ 3.23Å; E143-R147 IonicContact OE1-NE 2.81Å; E143-R147 PolarHBondContact OE1-NE 3.01Å; E143-R147 IonicContact OE1-NH2 3.23Å; E143-R147 PolarHBondContact OE1-NH2 3.48Å; L144-R147 PolarHBondContact O-N 2.77Å; V145-R147 VanDerWaalsContact C-N 3.34Å; V145-R147 PolarHBondContact O-N 3.28Å; R147-V149 VanDerWaalsContact C-N 3.33Å; R147-V149 PolarHBondContact O-N 2.97Å; R147-S150 WeakPolarHBondContact O-CA 3.24Å; R147-S150 WeakPolarHBondContact O-CB 3.49Å; R147-S150 PolarHBondContact O-N 3.46Å; R147-D151 PolarHBondContact O-N 2.92Å |
| 148 | Q | 94.6 | Very high | 93.4 | Very high | 55 Ų | 55 | 66.3 Ų | 66.3 | 26% | 0.257 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -62.1 | -41 | 179.7 | -171.2 | 166.2 | 21 | 0 | 0 | 112.3 | V129 F133 L144 V145 S150 D151 D152 | V129-Q148 HydrophobicContact CG1-CB 4.33Å; V129-Q148 HydrophobicContact CG1-CG 4.14Å; V129-Q148 HydrophobicContact CG2-CG 4.38Å; F133-Q148 VanDerWaalsContact CE2-OE1 3.3Å; F133-Q148 VanDerWaalsContact CZ-OE1 3.27Å; L144-Q148 PolarHBondContact O-N 3.33Å; V145-Q148 PolarHBondContact O-N 3.18Å; Q148-S150 VanDerWaalsContact C-N 3.34Å; Q148-D151 PolarHBondContact O-N 2.94Å; Q148-D152 WeakPolarHBondContact O-CB 3.37Å; Q148-D152 PolarHBondContact O-N 3.22Å; Q148-D152 VanDerWaalsContact O-N 3.11Å |
| 149 | V | 95.3 | Very high | 93.4 | Very high | 1 Ų | 1 | 70.7 Ų | 70.7 | 1% | 0.006 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -62.4 | -42.8 | 172.7 | 172.7 | 0 | 0 | 0 | 0 | 110.9 | L91 L126 V129 V145 R147 L153 V167 | L91-V149 HydrophobicContact CD1-CG1 4.28Å; L91-V149 HydrophobicContact CD2-CG1 4.23Å; L126-V149 HydrophobicContact CD1-CG1 4.13Å; L126-V149 HydrophobicContact CD1-CG2 3.98Å; V129-V149 HydrophobicContact CB-CG2 3.93Å; V129-V149 HydrophobicContact CG1-CG2 3.78Å; V129-V149 HydrophobicContact CG2-CG2 4.17Å; V145-V149 HydrophobicContact CG1-CG2 4.33Å; V145-V149 VanDerWaalsContact O-CG2 3.29Å; V145-V149 WeakPolarHBondContact O-CG2 3.41Å; V145-V149 PolarHBondContact O-N 3.24Å; R147-V149 VanDerWaalsContact C-N 3.33Å; R147-V149 PolarHBondContact O-N 2.97Å; V149-L153 WeakPolarHBondContact O-CB 3.33Å; V149-L153 PolarHBondContact O-N 3.46Å; V149-V167 HydrophobicContact CG1-CG1 4.48Å |
| 150 | S | 94.9 | Very high | 93.5 | Very high | 31 Ų | 31 | 70.1 Ų | 70.1 | 22% | 0.217 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -61.4 | -45.4 | 179 | -176.3 | 0 | 0 | 0 | 0 | 112 | S146 R147 Q148 T154 | S146-S150 WeakPolarHBondContact O-CB 3.19Å; S146-S150 PolarHBondContact O-N 3.12Å; R147-S150 WeakPolarHBondContact O-CA 3.24Å; R147-S150 WeakPolarHBondContact O-CB 3.49Å; R147-S150 PolarHBondContact O-N 3.46Å; Q148-S150 VanDerWaalsContact C-N 3.34Å; S150-T154 WeakPolarHBondContact O-CB 3.45Å; S150-T154 PolarHBondContact O-N 3.36Å; S150-T154 PolarHBondContact O-OG1 3.11Å |
| 151 | D | 95.1 | Very high | 93.5 | Very high | 107 Ų | 107 | 64.9 Ų | 64.9 | 57% | 0.572 | 31% | 0.312 | S | S | * | . | H | α-helix | trans | -65.2 | -52.6 | -178.6 | -66.5 | -21.6 | 0 | 0 | 0 | 111 | R147 Q148 L153 T154 E155 | R147-D151 PolarHBondContact O-N 2.92Å; Q148-D151 PolarHBondContact O-N 2.94Å; D151-L153 VanDerWaalsContact C-N 3.33Å; D151-L153 PolarHBondContact O-N 3.39Å; D151-T154 PolarHBondContact O-N 3.46Å; D151-E155 PolarHBondContact O-N 3.3Å |
| 152 | D | 95.6 | Very high | 93.5 | Very high | 46 Ų | 46 | 60.8 Ų | 60.8 | 25% | 0.246 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -62.2 | -40.8 | 179.9 | -73.6 | 4.3 | 0 | 0 | 0 | 111.2 | V125 Q148 R156 | V125-D152 HydrophobicContact CG1-CB 3.63Å; Q148-D152 WeakPolarHBondContact O-CB 3.37Å; Q148-D152 PolarHBondContact O-N 3.22Å; Q148-D152 VanDerWaalsContact O-N 3.11Å; D152-R156 WeakPolarHBondContact O-CG 3.32Å; D152-R156 PolarHBondContact O-N 3.24Å; D152-R156 VanDerWaalsContact O-N 3.12Å |
| 153 | L | 95.5 | Very high | 93.7 | Very high | 2 Ų | 2 | 58 Ų | 58 | 1% | 0.01 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -69.9 | -36.6 | 179.1 | -168.8 | 65.7 | 0 | 0 | 0 | 111.6 | L91 I93 I121 V125 V149 D151 R156 A157 L164 V167 | L91-L153 HydrophobicContact CD2-CD2 3.79Å; I93-L153 HydrophobicContact CD1-CD2 4.08Å; I93-L153 HydrophobicContact CG1-CD2 4.4Å; I121-L153 HydrophobicContact CB-CD1 4.32Å; I121-L153 HydrophobicContact CD1-CD1 4.02Å; I121-L153 HydrophobicContact CG1-CD1 3.85Å; V125-L153 HydrophobicContact CB-CD1 4.22Å; V125-L153 HydrophobicContact CG1-CB 4.26Å; V125-L153 HydrophobicContact CG2-CD1 4.11Å; V149-L153 WeakPolarHBondContact O-CB 3.33Å; V149-L153 PolarHBondContact O-N 3.46Å; D151-L153 VanDerWaalsContact C-N 3.33Å; D151-L153 PolarHBondContact O-N 3.39Å; L153-R156 PolarHBondContact O-N 3.41Å; L153-A157 WeakPolarHBondContact O-CB 3.11Å; L153-A157 PolarHBondContact O-N 3.24Å; L153-L164 HydrophobicContact CB-CD1 4.11Å; L153-L164 HydrophobicContact CD2-CD1 3.83Å; L153-L164 HydrophobicContact CG-CD1 3.6Å; L153-V167 HydrophobicContact CD2-CG1 4.08Å; L153-V167 HydrophobicContact CD2-CG2 4.19Å |
| 154 | T | 95.1 | Very high | 93.8 | Very high | 40 Ų | 40 | 53.6 Ų | 53.6 | 25% | 0.245 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -66.2 | -42.6 | 176.9 | -62 | 0 | 0 | 0 | 0 | 111.1 | S150 D151 R156 A157 N158 | S150-T154 WeakPolarHBondContact O-CB 3.45Å; S150-T154 PolarHBondContact O-N 3.36Å; S150-T154 PolarHBondContact O-OG1 3.11Å; D151-T154 PolarHBondContact O-N 3.46Å; T154-R156 PolarHBondContact O-N 2.99Å; T154-A157 PolarHBondContact O-N 2.81Å; T154-N158 WeakPolarHBondContact O-CB 3.23Å; T154-N158 VanDerWaalsContact O-CG 3.28Å; T154-N158 PolarHBondContact O-N 3.49Å; T154-N158 PolarHBondContact O-ND2 3.06Å |
| 155 | E | 94.9 | Very high | 93.8 | Very high | 140 Ų | 140 | 52.8 Ų | 52.8 | 65% | 0.654 | 26% | 0.26 | S | S | * | . | H | α-helix | trans | -59.7 | -47.1 | 174.7 | -172.5 | -178.7 | 172.6 | 0 | 0 | 111.4 | D151 T159 | D151-E155 PolarHBondContact O-N 3.3Å; E155-T159 PolarHBondContact O-OG1 3.04Å |
| 156 | R | 94.8 | Very high | 93.8 | Very high | 121 Ų | 121 | 56.2 Ų | 56.2 | 46% | 0.457 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -63.1 | -46.7 | 176.7 | -70.6 | -60.1 | -142.5 | -167.1 | 6.4 | 112.2 | E124 V125 D152 L153 T154 N158 T159 F160 | E124-R156 IonicContact OE1-CZ 2.84Å; E124-R156 IonicContact OE1-NE 2.7Å; E124-R156 IonicContact OE1-NH2 3.59Å; E124-R156 PolarHBondContact OE1-NH2 2.98Å; V125-R156 HydrophobicContact CG2-CG 3.88Å; D152-R156 WeakPolarHBondContact O-CG 3.32Å; D152-R156 PolarHBondContact O-N 3.24Å; D152-R156 VanDerWaalsContact O-N 3.12Å; L153-R156 PolarHBondContact O-N 3.41Å; T154-R156 PolarHBondContact O-N 2.99Å; R156-N158 VanDerWaalsContact C-N 3.33Å; R156-N158 PolarHBondContact O-N 2.89Å; R156-T159 WeakPolarHBondContact O-CB 3.46Å; R156-T159 PolarHBondContact O-N 3.39Å; R156-F160 VanDerWaalsContact O-CD2 3.32Å; R156-F160 WeakPolarHBondContact O-CD2 3.3Å |
| 157 | A | 93.6 | Very high | 93.9 | Very high | 0 Ų | 0 | 55.6 Ų | 55.6 | 0% | 0 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -63 | -37.8 | -178.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | I121 L153 T154 T159 F160 G161 L162 L164 | I121-A157 HydrophobicContact CD1-CB 4.05Å; L153-A157 WeakPolarHBondContact O-CB 3.11Å; L153-A157 PolarHBondContact O-N 3.24Å; T154-A157 PolarHBondContact O-N 2.81Å; A157-T159 PolarHBondContact O-N 3.42Å; A157-F160 CarbonylContact O-C 3.57Å; A157-F160 PolarHBondContact O-N 2.84Å; A157-G161 PolarHBondContact O-N 3.37Å; A157-L162 CarbonylContact C-O 3.56Å; A157-L162 VanDerWaalsContact C-O 3.31Å; A157-L162 HydrophobicContact CB-CB 4.21Å; A157-L162 PolarHBondContact O-N 3.12Å; A157-L164 HydrophobicContact CB-CD1 3.84Å; A157-L164 HydrophobicContact CB-CD2 4.06Å; A157-L164 HydrophobicContact CB-CG 3.8Å |
| 158 | N | 92.8 | Very high | 93.7 | Very high | 82 Ų | 82 | 49.9 Ų | 49.9 | 44% | 0.439 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -60.1 | -32.1 | 176.5 | -81.4 | -39.1 | 0 | 0 | 0 | 112.7 | T154 R156 F160 G161 | T154-N158 WeakPolarHBondContact O-CB 3.23Å; T154-N158 VanDerWaalsContact O-CG 3.28Å; T154-N158 PolarHBondContact O-N 3.49Å; T154-N158 PolarHBondContact O-ND2 3.06Å; R156-N158 VanDerWaalsContact C-N 3.33Å; R156-N158 PolarHBondContact O-N 2.89Å; N158-F160 PolarHBondContact O-N 3.32Å; N158-G161 PolarHBondContact O-N 3.11Å; N158-G161 VanDerWaalsContact O-N 3.1Å |
| 159 | T | 91.7 | Very high | 93.6 | Very high | 95 Ų | 95 | 47.8 Ų | 47.8 | 58% | 0.583 | 25% | 0.248 | S | C | * | . | H | α-helix | trans | -64.3 | -29.5 | 176.7 | -56.2 | 0 | 0 | 0 | 0 | 112.1 | E155 R156 A157 | E155-T159 PolarHBondContact O-OG1 3.04Å; R156-T159 WeakPolarHBondContact O-CB 3.46Å; R156-T159 PolarHBondContact O-N 3.39Å; A157-T159 PolarHBondContact O-N 3.42Å |
| 160 | F | 90.8 | Very high | 93.3 | Very high | 84 Ų | 84 | 50.1 Ų | 50.1 | 37% | 0.368 | 26% | 0.262 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -94.1 | 5.1 | 176.7 | -62.9 | -76.8 | 0 | 0 | 0 | 113.3 | I109 V117 I121 R156 A157 N158 | I109-F160 HydrophobicContact CD1-CB 4.48Å; I109-F160 HydrophobicContact CD1-CD1 4.34Å; V117-F160 HydrophobicContact CG1-CB 4.04Å; V117-F160 HydrophobicContact CG1-CD1 4.21Å; V117-F160 HydrophobicContact CG1-CD2 3.79Å; V117-F160 HydrophobicContact CG1-CE2 4.29Å; V117-F160 HydrophobicContact CG1-CG 3.74Å; V117-F160 HydrophobicContact CG2-CD1 4.46Å; I121-F160 HydrophobicContact CG2-CD2 4.16Å; I121-F160 HydrophobicContact CG2-CE2 3.68Å; I121-F160 HydrophobicContact CG2-CZ 4.46Å; R156-F160 VanDerWaalsContact O-CD2 3.32Å; R156-F160 WeakPolarHBondContact O-CD2 3.3Å; A157-F160 CarbonylContact O-C 3.57Å; A157-F160 PolarHBondContact O-N 2.84Å; N158-F160 PolarHBondContact O-N 3.32Å |
| 161 | G | 91 | Very high | 92.9 | Very high | 0 Ų | 0 | 54.7 Ų | 54.7 | 0% | 0 | 28% | 0.28 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 72.8 | 27.5 | -179 | 0 | 0 | 0 | 0 | 0 | 113.7 | V98 Q101 I105 A157 N158 | V98-G161 WeakPolarHBondContact CB-O 3.34Å; V98-G161 VanDerWaalsContact CG2-O 3.27Å; V98-G161 WeakPolarHBondContact CG2-O 3.36Å; V98-G161 PolarHBondContact N-O 2.95Å; Q101-G161 VanDerWaalsContact OE1-CA 3.3Å; I105-G161 WeakPolarHBondContact CD1-O 3.49Å; A157-G161 PolarHBondContact O-N 3.37Å; N158-G161 PolarHBondContact O-N 3.11Å; N158-G161 VanDerWaalsContact O-N 3.1Å |
| 162 | L | 93.4 | Very high | 92.7 | Very high | 0 Ų | 0 | 51.5 Ų | 51.5 | 0% | 0 | 26% | 0.263 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -107.8 | 135.4 | 175 | -58.9 | 179.3 | 0 | 0 | 0 | 110.2 | P97 Y113 V117 L118 A157 | P97-L162 HydrophobicContact CB-CD2 4.31Å; Y113-L162 HydrophobicContact CD2-CD1 4.42Å; Y113-L162 HydrophobicContact CD2-CD2 3.54Å; Y113-L162 HydrophobicContact CE2-CD2 3.54Å; V117-L162 HydrophobicContact CB-CD1 4.43Å; V117-L162 HydrophobicContact CG1-CD1 4.17Å; L118-L162 HydrophobicContact CD2-CD1 3.94Å; L118-L162 HydrophobicContact CG-CD1 4.34Å; A157-L162 CarbonylContact C-O 3.56Å; A157-L162 VanDerWaalsContact C-O 3.31Å; A157-L162 HydrophobicContact CB-CB 4.21Å; A157-L162 PolarHBondContact O-N 3.12Å |
| 163 | I | 94.2 | Very high | 92.5 | Very high | 42 Ų | 42 | 53 Ų | 53 | 22% | 0.215 | 27% | 0.273 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -100.9 | 130.2 | 172.8 | -55.8 | 173.5 | 0 | 0 | 0 | 107.6 | F95 R96 V98 | F95-I163 CarbonylContact C-O 3.57Å; F95-I163 VanDerWaalsContact CA-O 3.25Å; F95-I163 WeakPolarHBondContact CA-O 3.5Å; R96-I163 HydrophobicContact CG-CB 4.04Å; R96-I163 PolarHBondContact N-O 3.23Å; R96-I163 PolarHBondContact O-N 3.01Å; V98-I163 HydrophobicContact CG2-CD1 3.82Å; V98-I163 HydrophobicContact CG2-CG1 3.49Å; V98-I163 VanDerWaalsContact CG2-CG1 3.49Å |
| 164 | L | 94.8 | Very high | 92.3 | Very high | 18 Ų | 18 | 54.3 Ų | 54.3 | 9% | 0.094 | 28% | 0.279 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -99.1 | 117.7 | 170.8 | -50.9 | -176.6 | 0 | 0 | 0 | 107.7 | I93 L94 F95 L118 L153 A157 V167 | I93-L164 HydrophobicContact CG2-CD2 3.68Å; L94-L164 CarbonylContact O-C 3.52Å; L94-L164 WeakPolarHBondContact O-CA 3.48Å; F95-L164 HydrophobicContact CB-CD2 3.7Å; L118-L164 HydrophobicContact CD2-CD2 4.47Å; L153-L164 HydrophobicContact CB-CD1 4.11Å; L153-L164 HydrophobicContact CD2-CD1 3.83Å; L153-L164 HydrophobicContact CG-CD1 3.6Å; A157-L164 HydrophobicContact CB-CD1 3.84Å; A157-L164 HydrophobicContact CB-CD2 4.06Å; A157-L164 HydrophobicContact CB-CG 3.8Å; L164-V167 HydrophobicContact CB-CG2 4.03Å; L164-V167 HydrophobicContact CD1-CG2 3.83Å |
| 165 | D | 93.1 | Very high | 92 | Very high | 68 Ų | 68 | 54.1 Ų | 54.1 | 36% | 0.364 | 28% | 0.284 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -85.4 | -32.1 | 178 | -61.4 | -51.7 | 0 | 0 | 0 | 111 | S70 L94 R96 | S70-D165 VanDerWaalsContact CB-OD2 3.29Å; S70-D165 WeakPolarHBondContact CB-OD2 3.44Å; S70-D165 PolarHBondContact OG-OD2 2.92Å; L94-D165 HydrophobicContact CD2-CB 4.05Å; L94-D165 HydrophobicContact CG-CB 4.26Å; L94-D165 PolarHBondContact O-N 3.39Å; R96-D165 WeakPolarHBondContact CD-OD2 3.48Å; R96-D165 IonicContact CZ-OD1 3.69Å; R96-D165 IonicContact NE-OD1 3.63Å; R96-D165 PolarHBondContact NE-OD1 3.36Å; R96-D165 IonicContact NE-OD2 3.74Å; R96-D165 PolarHBondContact NE-OD2 3.38Å; R96-D165 IonicContact NH2-OD1 2.66Å |
| 166 | D | 92.9 | Very high | 91.8 | Very high | 77 Ų | 77 | 54.8 Ų | 54.8 | 41% | 0.412 | 29% | 0.285 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -152.4 | 142.4 | 175.7 | 179.6 | 48.7 | 0 | 0 | 0 | 111 | L94 S168 | L94-D166 HydrophobicContact CB-CB 4Å; L94-D166 PolarHBondContact N-O 2.92Å; L94-D166 PolarHBondContact O-N 3.11Å; D166-S168 PolarHBondContact OD2-OG 2.92Å |
| 167 | V | 93.6 | Very high | 91.5 | Very high | 8 Ų | 8 | 56.9 Ų | 56.9 | 5% | 0.048 | 30% | 0.3 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -135.2 | 114.5 | 175.7 | -179.4 | 0 | 0 | 0 | 0 | 108.2 | L91 I93 V149 L153 L164 | L91-V167 HydrophobicContact CD1-CG1 3.81Å; L91-V167 HydrophobicContact CD2-CG1 3.76Å; L91-V167 HydrophobicContact CG-CG1 3.97Å; I93-V167 HydrophobicContact CG2-CG2 4.42Å; V149-V167 HydrophobicContact CG1-CG1 4.48Å; L153-V167 HydrophobicContact CD2-CG1 4.08Å; L153-V167 HydrophobicContact CD2-CG2 4.19Å; L164-V167 HydrophobicContact CB-CG2 4.03Å; L164-V167 HydrophobicContact CD1-CG2 3.83Å |
| 168 | S | 91.1 | Very high | 91.3 | Very high | 30 Ų | 30 | 58.6 Ų | 58.6 | 21% | 0.21 | 31% | 0.308 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -131.7 | 133 | -177.1 | 47.5 | 0 | 0 | 0 | 0 | 112.5 | R92 D166 T170 | R92-S168 PolarHBondContact N-O 2.7Å; R92-S168 PolarHBondContact O-N 2.86Å; D166-S168 PolarHBondContact OD2-OG 2.92Å; S168-T170 PolarHBondContact O-N 3.42Å |
| 169 | L | 91.8 | Very high | 91.1 | Very high | 11 Ų | 11 | 57.2 Ų | 57.2 | 6% | 0.058 | 30% | 0.303 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -71.7 | 124 | 166.5 | -60.9 | 165.3 | 0 | 0 | 0 | 107.4 | I89 L91 L126 R142 V145 | I89-L169 HydrophobicContact CG2-CD2 3.57Å; L91-L169 HydrophobicContact CD1-CD2 3.49Å; L91-L169 VanDerWaalsContact CD1-CD2 3.49Å; L91-L169 HydrophobicContact CD1-CG 4.03Å; L126-L169 HydrophobicContact CD1-CD2 4.02Å; R142-L169 HydrophobicContact CG-CD1 4.36Å; R142-L169 VanDerWaalsContact CZ-O 3.24Å; R142-L169 PolarHBondContact NH1-O 2.9Å; R142-L169 PolarHBondContact NH2-O 3.5Å; V145-L169 HydrophobicContact CG1-CD1 4.3Å |
| 170 | T | 88.1 | Confident | 91.1 | Very high | 50 Ų | 50 | 56.5 Ų | 56.5 | 31% | 0.307 | 29% | 0.292 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.6 | -64.6 | -178.3 | 50.4 | 0 | 0 | 0 | 0 | 111.4 | T90 R92 R142 S168 | T90-T170 WeakPolarHBondContact CB-OG1 3.25Å; T90-T170 PolarHBondContact O-N 3.22Å; T90-T170 PolarHBondContact O-OG1 2.83Å; R92-T170 HydrophobicContact CB-CG2 3.61Å; R142-T170 PolarHBondContact NH2-O 3.34Å; S168-T170 PolarHBondContact O-N 3.42Å |
| 171 | H | 87.3 | Confident | 91 | Very high | 127 Ų | 127 | 54.8 Ų | 54.8 | 59% | 0.588 | 29% | 0.294 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -109.5 | 133.9 | 179.6 | -61.7 | -72 | 0 | 0 | 0 | 110.1 | I89 T90 | I89-H171 CarbonylContact C-O 3.56Å; I89-H171 VanDerWaalsContact CA-O 3.3Å; I89-H171 WeakPolarHBondContact CA-O 3.21Å; T90-H171 PolarHBondContact N-O 3.49Å |
| 172 | L | 90.4 | Very high | 90.9 | Very high | 41 Ų | 41 | 57 Ų | 57 | 22% | 0.215 | 31% | 0.307 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -136.8 | 115.5 | 174.3 | -172.2 | 148.1 | 0 | 0 | 0 | 107.6 | V87 N88 I89 L138 F174 | V87-L172 HydrophobicContact CG1-CD1 4.35Å; V87-L172 HydrophobicContact CG1-CD2 4Å; V87-L172 HydrophobicContact CG1-CG 3.86Å; N88-L172 WeakPolarHBondContact O-CA 3.4Å; I89-L172 HydrophobicContact CD1-CD1 4.21Å; I89-L172 HydrophobicContact CG1-CD1 4.09Å; I89-L172 HydrophobicContact CG1-CG 4.1Å; L138-L172 HydrophobicContact CB-CD1 4.09Å; L172-F174 HydrophobicContact CD2-CD2 4.02Å; L172-F174 HydrophobicContact CD2-CE1 4.12Å; L172-F174 HydrophobicContact CD2-CE2 3.18Å; L172-F174 HydrophobicContact CD2-CZ 3.27Å |
| 173 | T | 91.8 | Very high | 90.8 | Very high | 76 Ų | 76 | 62.2 Ų | 62.2 | 47% | 0.466 | 33% | 0.332 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -131.5 | 135.3 | -178.1 | 59.4 | 0 | 0 | 0 | 0 | 109.5 | N88 | N88-T173 WeakPolarHBondContact CB-OG1 3.33Å; N88-T173 PolarHBondContact N-O 2.97Å; N88-T173 PolarHBondContact O-N 3.12Å |
| 174 | F | 91.2 | Very high | 90.8 | Very high | 31 Ų | 31 | 66.4 Ų | 66.4 | 14% | 0.136 | 35% | 0.352 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -94.1 | 166.8 | 173.8 | -58.5 | -83.9 | 0 | 0 | 0 | 111 | V87 A135 L138 I139 L172 F178 | V87-F174 HydrophobicContact CB-CD1 4.41Å; V87-F174 HydrophobicContact CB-CE1 4.42Å; V87-F174 HydrophobicContact CG1-CD1 4.06Å; V87-F174 HydrophobicContact CG1-CE1 3.87Å; V87-F174 HydrophobicContact CG1-CZ 4.44Å; V87-F174 HydrophobicContact CG2-CD1 3.76Å; V87-F174 HydrophobicContact CG2-CE1 3.67Å; A135-F174 HydrophobicContact CB-CD1 4.08Å; A135-F174 HydrophobicContact CB-CE1 3.58Å; A135-F174 HydrophobicContact CB-CZ 4.35Å; A135-F174 VanDerWaalsContact O-CZ 3.24Å; A135-F174 WeakPolarHBondContact O-CZ 3.5Å; L138-F174 HydrophobicContact CB-CZ 4.35Å; L138-F174 HydrophobicContact CD1-CE1 4.38Å; I139-F174 HydrophobicContact CD1-CD2 4.31Å; I139-F174 HydrophobicContact CD1-CE2 3.46Å; I139-F174 VanDerWaalsContact CD1-CE2 3.46Å; I139-F174 HydrophobicContact CD1-CZ 3.93Å; I139-F174 HydrophobicContact CG1-CE2 3.46Å; I139-F174 VanDerWaalsContact CG1-CE2 3.46Å; I139-F174 HydrophobicContact CG1-CZ 3.66Å; L172-F174 HydrophobicContact CD2-CD2 4.02Å; L172-F174 HydrophobicContact CD2-CE1 4.12Å; L172-F174 HydrophobicContact CD2-CE2 3.18Å; L172-F174 HydrophobicContact CD2-CZ 3.27Å; F174-F178 HydrophobicContact CB-CB 4.39Å; F174-F178 HydrophobicContact CB-CD1 3.76Å; F174-F178 HydrophobicContact CB-CG 4.46Å; F174-F178 HydrophobicContact CD1-CD1 4.07Å; F174-F178 HydrophobicContact CD1-CE1 4.16Å; F174-F178 HydrophobicContact CD2-CD1 4.38Å; F174-F178 HydrophobicContact CD2-CE1 4.47Å; F174-F178 HydrophobicContact CE1-CE1 4.5Å; F174-F178 AromaticContact CG-CD1 3.81Å; F174-F178 HydrophobicContact CG-CD1 3.81Å; F174-F178 HydrophobicContact CG-CE1 4.14Å |
| 175 | G | 88.7 | Confident | 90.6 | Very high | 35 Ų | 35 | 72.7 Ų | 72.7 | 36% | 0.361 | 38% | 0.378 | S | S | . | . | trans | -54.5 | 145 | 167.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | N86 E177 F178 T179 | N86-G175 PolarHBondContact O-N 3.27Å; G175-E177 VanDerWaalsContact C-N 3.26Å; G175-E177 PolarHBondContact O-N 2.86Å; G175-F178 PolarHBondContact O-N 3.42Å; G175-F178 VanDerWaalsContact O-N 3.11Å; G175-T179 PolarHBondContact O-N 3.04Å; G175-T179 PolarHBondContact O-OG1 3.26Å | ||
| 176 | K | 90.1 | Very high | 90.6 | Very high | 155 Ų | 155 | 74.6 Ų | 74.6 | 67% | 0.674 | 39% | 0.385 | S | S | * | . | H | α-helix | trans | -54.1 | -42.7 | -176.4 | -169 | -178.5 | -175.4 | -101.1 | 0 | 112.4 | F178 T179 E180 | K176-F178 VanDerWaalsContact C-N 3.34Å; K176-F178 PolarHBondContact O-N 2.82Å; K176-T179 PolarHBondContact O-N 2.66Å; K176-E180 VanDerWaalsContact CE-OE1 3.24Å; K176-E180 WeakPolarHBondContact CE-OE1 3.33Å; K176-E180 WeakPolarHBondContact CG-OE1 3.25Å; K176-E180 IonicContact NZ-OE1 3.68Å; K176-E180 PolarHBondContact NZ-OE1 2.99Å; K176-E180 WeakPolarHBondContact O-CG 3.48Å; K176-E180 PolarHBondContact O-N 3.18Å |
| 177 | E | 88.8 | Confident | 90.8 | Very high | 165 Ų | 165 | 74.4 Ų | 74.4 | 77% | 0.771 | 39% | 0.387 | S | S | * | . | H | α-helix | trans | -60.7 | -39.9 | -179.7 | -62.4 | 172.2 | 179.4 | 0 | 0 | 112.5 | G175 A181 | G175-E177 VanDerWaalsContact C-N 3.26Å; G175-E177 PolarHBondContact O-N 2.86Å; E177-A181 WeakPolarHBondContact O-CB 3.4Å; E177-A181 PolarHBondContact O-N 3.42Å |
| 178 | F | 88.8 | Confident | 90.9 | Very high | 36 Ų | 36 | 76.5 Ų | 76.5 | 16% | 0.158 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -69.5 | -44.7 | 177.9 | -179.1 | -95.8 | 0 | 0 | 0 | 111.3 | Q85 A135 F174 G175 K176 E180 A181 V182 | Q85-F178 HydrophobicContact CG-CD2 3.87Å; Q85-F178 HydrophobicContact CG-CE2 4.1Å; A135-F178 HydrophobicContact CB-CE1 3.91Å; A135-F178 HydrophobicContact CB-CE2 4.08Å; A135-F178 HydrophobicContact CB-CZ 3.53Å; F174-F178 HydrophobicContact CB-CB 4.39Å; F174-F178 HydrophobicContact CB-CD1 3.76Å; F174-F178 HydrophobicContact CB-CG 4.46Å; F174-F178 HydrophobicContact CD1-CD1 4.07Å; F174-F178 HydrophobicContact CD1-CE1 4.16Å; F174-F178 HydrophobicContact CD2-CD1 4.38Å; F174-F178 HydrophobicContact CD2-CE1 4.47Å; F174-F178 HydrophobicContact CE1-CE1 4.5Å; F174-F178 AromaticContact CG-CD1 3.81Å; F174-F178 HydrophobicContact CG-CD1 3.81Å; F174-F178 HydrophobicContact CG-CE1 4.14Å; G175-F178 PolarHBondContact O-N 3.42Å; G175-F178 VanDerWaalsContact O-N 3.11Å; K176-F178 VanDerWaalsContact C-N 3.34Å; K176-F178 PolarHBondContact O-N 2.82Å; F178-E180 VanDerWaalsContact C-N 3.34Å; F178-E180 PolarHBondContact O-N 3.38Å; F178-A181 PolarHBondContact O-N 2.66Å; F178-V182 HydrophobicContact CD1-CG2 4.01Å; F178-V182 HydrophobicContact CE1-CG2 3.59Å; F178-V182 HydrophobicContact CE2-CG2 4.21Å; F178-V182 HydrophobicContact CG-CG2 4.49Å; F178-V182 HydrophobicContact CZ-CG2 3.71Å; F178-V182 WeakPolarHBondContact O-CG2 3.25Å; F178-V182 PolarHBondContact O-N 2.82Å |
| 179 | T | 89.1 | Confident | 91.1 | Very high | 53 Ų | 53 | 80.1 Ų | 80.1 | 33% | 0.325 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -58.9 | -46.7 | 177 | -54.5 | 0 | 0 | 0 | 0 | 110.9 | G175 K176 A181 V182 E183 | G175-T179 PolarHBondContact O-N 3.04Å; G175-T179 PolarHBondContact O-OG1 3.26Å; K176-T179 PolarHBondContact O-N 2.66Å; T179-A181 PolarHBondContact O-N 3.42Å; T179-V182 PolarHBondContact O-N 3.49Å; T179-E183 WeakPolarHBondContact O-CG 3.29Å; T179-E183 PolarHBondContact O-N 2.88Å |
| 180 | E | 92 | Very high | 91.3 | Very high | 79 Ų | 79 | 85.6 Ų | 85.6 | 37% | 0.369 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -60.9 | -43.1 | 176.1 | -72.5 | 175.1 | -178 | 0 | 0 | 112 | K176 F178 V182 E183 M184 | K176-E180 VanDerWaalsContact CE-OE1 3.24Å; K176-E180 WeakPolarHBondContact CE-OE1 3.33Å; K176-E180 WeakPolarHBondContact CG-OE1 3.25Å; K176-E180 IonicContact NZ-OE1 3.68Å; K176-E180 PolarHBondContact NZ-OE1 2.99Å; K176-E180 WeakPolarHBondContact O-CG 3.48Å; K176-E180 PolarHBondContact O-N 3.18Å; F178-E180 VanDerWaalsContact C-N 3.34Å; F178-E180 PolarHBondContact O-N 3.38Å; E180-V182 PolarHBondContact O-N 3.43Å; E180-E183 PolarHBondContact O-N 3.47Å; E180-M184 WeakPolarHBondContact O-CB 3.29Å; E180-M184 WeakPolarHBondContact O-CG 3.27Å; E180-M184 PolarHBondContact O-N 2.91Å |
| 181 | A | 89.4 | Confident | 91.7 | Very high | 49 Ų | 49 | 89.3 Ų | 89.3 | 41% | 0.405 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -64.7 | -38.6 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | E177 F178 T179 K185 | E177-A181 WeakPolarHBondContact O-CB 3.4Å; E177-A181 PolarHBondContact O-N 3.42Å; F178-A181 PolarHBondContact O-N 2.66Å; T179-A181 PolarHBondContact O-N 3.42Å; A181-K185 WeakPolarHBondContact O-CB 3.38Å; A181-K185 PolarHBondContact O-N 3.4Å |
| 182 | V | 88.8 | Confident | 92.1 | Very high | 45 Ų | 45 | 85.7 Ų | 85.7 | 27% | 0.273 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -67.2 | -44.1 | 175.8 | 171.5 | 0 | 0 | 0 | 0 | 110.8 | F178 T179 E180 K185 Q186 | F178-V182 HydrophobicContact CD1-CG2 4.01Å; F178-V182 HydrophobicContact CE1-CG2 3.59Å; F178-V182 HydrophobicContact CE2-CG2 4.21Å; F178-V182 HydrophobicContact CG-CG2 4.49Å; F178-V182 HydrophobicContact CZ-CG2 3.71Å; F178-V182 WeakPolarHBondContact O-CG2 3.25Å; F178-V182 PolarHBondContact O-N 2.82Å; T179-V182 PolarHBondContact O-N 3.49Å; E180-V182 PolarHBondContact O-N 3.43Å; V182-K185 PolarHBondContact O-N 2.9Å; V182-Q186 WeakPolarHBondContact O-CG 3.44Å; V182-Q186 PolarHBondContact O-N 3Å |
| 183 | E | 90.3 | Very high | 92.4 | Very high | 111 Ų | 111 | 89.1 Ų | 89.1 | 52% | 0.519 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -60.4 | -47.4 | 175.3 | -73.9 | 176.4 | -179.7 | 0 | 0 | 111.2 | T179 E180 K185 Q186 V187 | T179-E183 WeakPolarHBondContact O-CG 3.29Å; T179-E183 PolarHBondContact O-N 2.88Å; E180-E183 PolarHBondContact O-N 3.47Å; E183-K185 VanDerWaalsContact C-N 3.31Å; E183-K185 PolarHBondContact O-N 2.71Å; E183-Q186 PolarHBondContact O-N 3.39Å; E183-Q186 VanDerWaalsContact O-N 3.15Å; E183-V187 WeakPolarHBondContact O-CG2 3.44Å; E183-V187 PolarHBondContact O-N 3.39Å |
| 184 | M | 93.9 | Very high | 92.6 | Very high | 129 Ų | 129 | 94.8 Ų | 94.8 | 64% | 0.635 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -59.1 | -41.6 | 175.7 | -75.3 | -168.9 | -66.9 | 0 | 0 | 112.2 | E180 V187 A188 | E180-M184 WeakPolarHBondContact O-CB 3.29Å; E180-M184 WeakPolarHBondContact O-CG 3.27Å; E180-M184 PolarHBondContact O-N 2.91Å; M184-V187 PolarHBondContact O-N 2.96Å; M184-A188 WeakPolarHBondContact O-CB 3.33Å; M184-A188 PolarHBondContact O-N 2.9Å |
| 185 | K | 92.4 | Very high | 92.8 | Very high | 150 Ų | 150 | 95.9 Ų | 95.9 | 65% | 0.652 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -64 | -40.8 | 176.3 | -174.6 | 179.7 | 178.4 | -177.9 | 0 | 111.7 | A181 V182 E183 A188 Q189 | A181-K185 WeakPolarHBondContact O-CB 3.38Å; A181-K185 PolarHBondContact O-N 3.4Å; V182-K185 PolarHBondContact O-N 2.9Å; E183-K185 VanDerWaalsContact C-N 3.31Å; E183-K185 PolarHBondContact O-N 2.71Å; K185-A188 PolarHBondContact O-N 3.44Å; K185-Q189 VanDerWaalsContact O-CB 3.3Å; K185-Q189 WeakPolarHBondContact O-CB 3.36Å; K185-Q189 PolarHBondContact O-N 2.82Å |
| 186 | Q | 92.6 | Very high | 93.2 | Very high | 108 Ų | 108 | 103.4 Ų | 103.4 | 51% | 0.505 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -64.8 | -43.8 | 176.8 | -73.5 | 178.7 | 6.1 | 0 | 0 | 111.5 | V182 E183 Q189 Q190 | V182-Q186 WeakPolarHBondContact O-CG 3.44Å; V182-Q186 PolarHBondContact O-N 3Å; E183-Q186 PolarHBondContact O-N 3.39Å; E183-Q186 VanDerWaalsContact O-N 3.15Å; Q186-Q189 PolarHBondContact O-N 2.87Å; Q186-Q190 WeakPolarHBondContact O-CB 3.47Å; Q186-Q190 VanDerWaalsContact O-CG 3.3Å; Q186-Q190 WeakPolarHBondContact O-CG 3.39Å; Q186-Q190 PolarHBondContact O-N 3.46Å |
| 187 | V | 96.1 | Very high | 93.6 | Very high | 73 Ų | 73 | 102.5 Ų | 102.5 | 44% | 0.442 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -61 | -50 | 175.7 | 173.6 | 0 | 0 | 0 | 0 | 110.3 | E183 M184 Q189 Q190 E191 | E183-V187 WeakPolarHBondContact O-CG2 3.44Å; E183-V187 PolarHBondContact O-N 3.39Å; M184-V187 PolarHBondContact O-N 2.96Å; V187-Q189 VanDerWaalsContact C-N 3.28Å; V187-Q189 PolarHBondContact O-N 3.01Å; V187-Q190 PolarHBondContact O-N 3.08Å; V187-E191 HydrophobicContact CG1-CG 4.39Å; V187-E191 WeakPolarHBondContact O-CB 3.39Å; V187-E191 WeakPolarHBondContact O-CG 3.5Å; V187-E191 PolarHBondContact O-N 2.7Å |
| 188 | A | 95.8 | Very high | 94 | Very high | 53 Ų | 53 | 98.8 Ų | 98.8 | 44% | 0.438 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -60.5 | -37.6 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | M184 K185 A192 | M184-A188 WeakPolarHBondContact O-CB 3.33Å; M184-A188 PolarHBondContact O-N 2.9Å; K185-A188 PolarHBondContact O-N 3.44Å; A188-A192 WeakPolarHBondContact O-CB 3.3Å; A188-A192 PolarHBondContact O-N 3.35Å |
| 189 | Q | 95.6 | Very high | 94.4 | Very high | 106 Ų | 106 | 101 Ų | 101 | 50% | 0.495 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -68.5 | -43 | 176.7 | -174.1 | 167.5 | -13.5 | 0 | 0 | 112 | K185 Q186 V187 E191 A192 E193 | K185-Q189 VanDerWaalsContact O-CB 3.3Å; K185-Q189 WeakPolarHBondContact O-CB 3.36Å; K185-Q189 PolarHBondContact O-N 2.82Å; Q186-Q189 PolarHBondContact O-N 2.87Å; V187-Q189 VanDerWaalsContact C-N 3.28Å; V187-Q189 PolarHBondContact O-N 3.01Å; Q189-E191 VanDerWaalsContact C-N 3.34Å; Q189-A192 PolarHBondContact O-N 3.05Å; Q189-E193 WeakPolarHBondContact O-CG 3.36Å; Q189-E193 PolarHBondContact O-N 2.92Å |
| 190 | Q | 96.1 | Very high | 94.7 | Very high | 126 Ų | 126 | 103.5 Ų | 103.5 | 59% | 0.589 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -63.7 | -39.6 | 174.5 | -72.8 | 176.3 | 6.8 | 0 | 0 | 112 | Q186 V187 E193 R194 | Q186-Q190 WeakPolarHBondContact O-CB 3.47Å; Q186-Q190 VanDerWaalsContact O-CG 3.3Å; Q186-Q190 WeakPolarHBondContact O-CG 3.39Å; Q186-Q190 PolarHBondContact O-N 3.46Å; V187-Q190 PolarHBondContact O-N 3.08Å; Q190-E193 PolarHBondContact O-N 2.83Å; Q190-R194 VanDerWaalsContact O-CB 3.32Å; Q190-R194 WeakPolarHBondContact O-CB 3.21Å; Q190-R194 PolarHBondContact O-N 3.1Å |
| 191 | E | 95.9 | Very high | 95 | Very high | 128 Ų | 128 | 105.4 Ų | 105.4 | 60% | 0.598 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -63.8 | -42.2 | 174.9 | -75.2 | -177.6 | 170.8 | 0 | 0 | 111.7 | V187 Q189 R194 A195 | V187-E191 HydrophobicContact CG1-CG 4.39Å; V187-E191 WeakPolarHBondContact O-CB 3.39Å; V187-E191 WeakPolarHBondContact O-CG 3.5Å; V187-E191 PolarHBondContact O-N 2.7Å; Q189-E191 VanDerWaalsContact C-N 3.34Å; E191-R194 PolarHBondContact O-N 3.28Å; E191-A195 WeakPolarHBondContact O-CB 3.45Å; E191-A195 PolarHBondContact O-N 3.32Å |
| 192 | A | 96.3 | Very high | 95.3 | Very high | 51 Ų | 51 | 105.5 Ų | 105.5 | 42% | 0.421 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -64.3 | -42.7 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | A188 Q189 A195 R196 | A188-A192 WeakPolarHBondContact O-CB 3.3Å; A188-A192 PolarHBondContact O-N 3.35Å; Q189-A192 PolarHBondContact O-N 3.05Å; A192-A195 PolarHBondContact O-N 2.8Å; A192-R196 WeakPolarHBondContact O-CG 3.36Å; A192-R196 PolarHBondContact O-N 2.89Å |
| 193 | E | 96.8 | Very high | 95.8 | Very high | 113 Ų | 113 | 109.3 Ų | 109.3 | 53% | 0.528 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -62.9 | -43.1 | 174.8 | -75.9 | 174.9 | -168 | 0 | 0 | 111.5 | Q189 Q190 A195 R196 F197 | Q189-E193 WeakPolarHBondContact O-CG 3.36Å; Q189-E193 PolarHBondContact O-N 2.92Å; Q190-E193 PolarHBondContact O-N 2.83Å; E193-A195 PolarHBondContact O-N 3.43Å; E193-R196 PolarHBondContact O-N 3.48Å; E193-F197 PolarHBondContact O-N 3.04Å |
| 194 | R | 96.1 | Very high | 96.1 | Very high | 194 Ų | 194 | 109.8 Ų | 109.8 | 73% | 0.732 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -62.4 | -43.7 | 175.1 | -173.6 | 178.5 | -176 | 173.9 | 1.7 | 111.8 | Q190 E191 R196 F197 V198 | Q190-R194 VanDerWaalsContact O-CB 3.32Å; Q190-R194 WeakPolarHBondContact O-CB 3.21Å; Q190-R194 PolarHBondContact O-N 3.1Å; E191-R194 PolarHBondContact O-N 3.28Å; R194-R196 VanDerWaalsContact C-N 3.34Å; R194-R196 PolarHBondContact O-N 2.83Å; R194-F197 PolarHBondContact O-N 2.83Å; R194-V198 WeakPolarHBondContact O-CG2 3.4Å; R194-V198 PolarHBondContact O-N 2.64Å |
| 195 | A | 96.3 | Very high | 96.2 | Very high | 55 Ų | 55 | 109.3 Ų | 109.3 | 46% | 0.455 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -61.7 | -42.8 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.2 | E191 A192 E193 F197 V198 V199 | E191-A195 WeakPolarHBondContact O-CB 3.45Å; E191-A195 PolarHBondContact O-N 3.32Å; A192-A195 PolarHBondContact O-N 2.8Å; E193-A195 PolarHBondContact O-N 3.43Å; A195-F197 PolarHBondContact O-N 2.82Å; A195-V198 PolarHBondContact O-N 2.86Å; A195-V199 WeakPolarHBondContact O-CG2 3.33Å; A195-V199 PolarHBondContact O-N 3.02Å |
| 196 | R | 96.9 | Very high | 96.4 | Very high | 193 Ų | 193 | 109 Ų | 109 | 73% | 0.728 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -58.7 | -46.4 | 173.3 | -74.8 | -179.9 | -179.4 | -153.5 | 0.8 | 111.8 | A192 E193 R194 V198 V199 E200 | A192-R196 WeakPolarHBondContact O-CG 3.36Å; A192-R196 PolarHBondContact O-N 2.89Å; E193-R196 PolarHBondContact O-N 3.48Å; R194-R196 VanDerWaalsContact C-N 3.34Å; R194-R196 PolarHBondContact O-N 2.83Å; R196-V198 VanDerWaalsContact C-N 3.3Å; R196-V198 PolarHBondContact O-N 3Å; R196-V199 PolarHBondContact O-N 2.83Å; R196-E200 WeakPolarHBondContact O-CB 3.47Å; R196-E200 PolarHBondContact O-N 3.12Å |
| 197 | F | 97.1 | Very high | 96.6 | Very high | 136 Ų | 136 | 108.7 Ų | 108.7 | 60% | 0.596 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -63.1 | -35.7 | 178.3 | -173.9 | -101.7 | 0 | 0 | 0 | 112.8 | E193 R194 A195 K201 | E193-F197 PolarHBondContact O-N 3.04Å; R194-F197 PolarHBondContact O-N 2.83Å; A195-F197 PolarHBondContact O-N 2.82Å; F197-K201 VanDerWaalsContact O-CB 3.23Å; F197-K201 WeakPolarHBondContact O-CB 3.47Å; F197-K201 PolarHBondContact O-N 3.35Å |
| 198 | V | 97.4 | Very high | 96.7 | Very high | 86 Ų | 86 | 108 Ų | 108 | 52% | 0.521 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -65.9 | -43.2 | 175.1 | 171 | 0 | 0 | 0 | 0 | 111.3 | R194 A195 R196 K201 A202 | R194-V198 WeakPolarHBondContact O-CG2 3.4Å; R194-V198 PolarHBondContact O-N 2.64Å; A195-V198 PolarHBondContact O-N 2.86Å; R196-V198 VanDerWaalsContact C-N 3.3Å; R196-V198 PolarHBondContact O-N 3Å; V198-K201 PolarHBondContact O-N 3.04Å; V198-A202 WeakPolarHBondContact O-CB 3.48Å; V198-A202 PolarHBondContact O-N 3.39Å |
| 199 | V | 96.8 | Very high | 96.7 | Very high | 83 Ų | 83 | 108.3 Ų | 108.3 | 50% | 0.503 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -63.1 | -48.6 | 176.3 | 173.7 | 0 | 0 | 0 | 0 | 110.4 | A195 R196 K201 A202 E203 | A195-V199 WeakPolarHBondContact O-CG2 3.33Å; A195-V199 PolarHBondContact O-N 3.02Å; R196-V199 PolarHBondContact O-N 2.83Å; V199-K201 VanDerWaalsContact C-N 3.33Å; V199-K201 PolarHBondContact O-N 3.18Å; V199-A202 WeakPolarHBondContact O-CB 3.45Å; V199-A202 PolarHBondContact O-N 2.83Å; V199-A202 VanDerWaalsContact O-N 3.09Å; V199-E203 PolarHBondContact O-N 3.3Å |
| 200 | E | 97.3 | Very high | 96.8 | Very high | 106 Ų | 106 | 106.4 Ų | 106.4 | 50% | 0.495 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -60 | -43.5 | 178.1 | -173.6 | 176.2 | -177 | 0 | 0 | 111.4 | R196 A202 E203 Q204 | R196-E200 WeakPolarHBondContact O-CB 3.47Å; R196-E200 PolarHBondContact O-N 3.12Å; E200-A202 VanDerWaalsContact C-N 3.32Å; E200-A202 PolarHBondContact O-N 2.91Å; E200-E203 PolarHBondContact O-N 3.48Å; E200-Q204 VanDerWaalsContact O-CG 3.29Å; E200-Q204 WeakPolarHBondContact O-CG 3.38Å; E200-Q204 PolarHBondContact O-N 2.56Å |
| 201 | K | 97.4 | Very high | 96.8 | Very high | 118 Ų | 118 | 105 Ų | 105 | 51% | 0.513 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -59.7 | -41.7 | 174.4 | -177.2 | 177.9 | 178.6 | 179.8 | 0 | 112 | F197 V198 V199 Q204 Q205 | F197-K201 VanDerWaalsContact O-CB 3.23Å; F197-K201 WeakPolarHBondContact O-CB 3.47Å; F197-K201 PolarHBondContact O-N 3.35Å; V198-K201 PolarHBondContact O-N 3.04Å; V199-K201 VanDerWaalsContact C-N 3.33Å; V199-K201 PolarHBondContact O-N 3.18Å; K201-Q204 PolarHBondContact O-N 2.98Å; K201-Q205 WeakPolarHBondContact O-CB 3.3Å; K201-Q205 VanDerWaalsContact O-CG 3.28Å; K201-Q205 WeakPolarHBondContact O-CG 3.33Å; K201-Q205 PolarHBondContact O-N 3.38Å |
| 202 | A | 96.4 | Very high | 96.8 | Very high | 51 Ų | 51 | 102 Ų | 102 | 42% | 0.421 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -66.5 | -38.7 | 178.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | V198 V199 E200 Q205 K206 | V198-A202 WeakPolarHBondContact O-CB 3.48Å; V198-A202 PolarHBondContact O-N 3.39Å; V199-A202 WeakPolarHBondContact O-CB 3.45Å; V199-A202 PolarHBondContact O-N 2.83Å; V199-A202 VanDerWaalsContact O-N 3.09Å; E200-A202 VanDerWaalsContact C-N 3.32Å; E200-A202 PolarHBondContact O-N 2.91Å; A202-Q205 PolarHBondContact O-N 2.96Å; A202-K206 WeakPolarHBondContact O-CB 3.24Å; A202-K206 PolarHBondContact O-N 3.19Å |
| 203 | E | 97.5 | Very high | 96.8 | Very high | 126 Ų | 126 | 102.2 Ų | 102.2 | 59% | 0.589 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -63.8 | -45.8 | 173.9 | -72.2 | -179.1 | 167.3 | 0 | 0 | 111.8 | V199 E200 Q205 K206 Q207 | V199-E203 PolarHBondContact O-N 3.3Å; E200-E203 PolarHBondContact O-N 3.48Å; E203-Q205 VanDerWaalsContact C-N 3.34Å; E203-Q205 PolarHBondContact O-N 2.97Å; E203-K206 WeakPolarHBondContact O-CB 3.45Å; E203-K206 PolarHBondContact O-N 2.94Å; E203-Q207 PolarHBondContact O-N 2.81Å |
| 204 | Q | 97.1 | Very high | 96.8 | Very high | 121 Ų | 121 | 102.2 Ų | 102.2 | 57% | 0.565 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -62.3 | -40.9 | 176.1 | -66.7 | -62.7 | -19.3 | 0 | 0 | 111.8 | E200 K201 Q207 A208 | E200-Q204 VanDerWaalsContact O-CG 3.29Å; E200-Q204 WeakPolarHBondContact O-CG 3.38Å; E200-Q204 PolarHBondContact O-N 2.56Å; K201-Q204 PolarHBondContact O-N 2.98Å; Q204-Q207 PolarHBondContact O-N 3.08Å; Q204-A208 WeakPolarHBondContact O-CB 3.39Å; Q204-A208 PolarHBondContact O-N 3.46Å |
| 205 | Q | 96.4 | Very high | 96.8 | Very high | 119 Ų | 119 | 94.6 Ų | 94.6 | 56% | 0.556 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -63.9 | -41.9 | 175.2 | -77.4 | 179.3 | -18.4 | 0 | 0 | 112.3 | K201 A202 E203 A208 A209 | K201-Q205 WeakPolarHBondContact O-CB 3.3Å; K201-Q205 VanDerWaalsContact O-CG 3.28Å; K201-Q205 WeakPolarHBondContact O-CG 3.33Å; K201-Q205 PolarHBondContact O-N 3.38Å; A202-Q205 PolarHBondContact O-N 2.96Å; E203-Q205 VanDerWaalsContact C-N 3.34Å; E203-Q205 PolarHBondContact O-N 2.97Å; Q205-A208 PolarHBondContact O-N 2.93Å; Q205-A209 WeakPolarHBondContact O-CB 3.16Å; Q205-A209 PolarHBondContact O-N 3.24Å |
| 206 | K | 96.9 | Very high | 96.7 | Very high | 144 Ų | 144 | 97 Ų | 97 | 63% | 0.626 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -61.2 | -46.6 | 174.8 | 179.3 | -175 | 174.7 | -173 | 0 | 111 | A202 E203 A209 I210 | A202-K206 WeakPolarHBondContact O-CB 3.24Å; A202-K206 PolarHBondContact O-N 3.19Å; E203-K206 WeakPolarHBondContact O-CB 3.45Å; E203-K206 PolarHBondContact O-N 2.94Å; K206-A209 PolarHBondContact O-N 3.44Å; K206-I210 HydrophobicContact CG-CD1 4.17Å; K206-I210 WeakPolarHBondContact O-CG1 3.28Å; K206-I210 PolarHBondContact O-N 2.78Å |
| 207 | Q | 97.1 | Very high | 96.6 | Very high | 100 Ų | 100 | 91 Ų | 91 | 47% | 0.467 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -62.8 | -43.7 | 178.7 | -170.1 | 62.8 | 26.7 | 0 | 0 | 111.2 | E203 Q204 A209 I210 I211 | E203-Q207 PolarHBondContact O-N 2.81Å; Q204-Q207 PolarHBondContact O-N 3.08Å; Q207-A209 VanDerWaalsContact C-N 3.33Å; Q207-A209 PolarHBondContact O-N 2.94Å; Q207-I210 PolarHBondContact O-N 2.63Å; Q207-I211 HydrophobicContact CG-CD1 3.95Å; Q207-I211 VanDerWaalsContact O-CG1 3.3Å; Q207-I211 WeakPolarHBondContact O-CG1 3.47Å; Q207-I211 PolarHBondContact O-N 2.89Å |
| 208 | A | 96.7 | Very high | 96.5 | Very high | 59 Ų | 59 | 90.4 Ų | 90.4 | 49% | 0.488 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -60.7 | -40.4 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | Q204 Q205 I211 S212 | Q204-A208 WeakPolarHBondContact O-CB 3.39Å; Q204-A208 PolarHBondContact O-N 3.46Å; Q205-A208 PolarHBondContact O-N 2.93Å; A208-I211 PolarHBondContact O-N 3.21Å; A208-S212 WeakPolarHBondContact O-CB 3.15Å; A208-S212 PolarHBondContact O-N 3.49Å |
| 209 | A | 96.7 | Very high | 96.3 | Very high | 59 Ų | 59 | 88.4 Ų | 88.4 | 49% | 0.488 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -66 | -40.3 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | Q205 K206 Q207 S212 A213 | Q205-A209 WeakPolarHBondContact O-CB 3.16Å; Q205-A209 PolarHBondContact O-N 3.24Å; K206-A209 PolarHBondContact O-N 3.44Å; Q207-A209 VanDerWaalsContact C-N 3.33Å; Q207-A209 PolarHBondContact O-N 2.94Å; A209-S212 PolarHBondContact O-N 3.44Å; A209-A213 WeakPolarHBondContact O-CB 3.4Å; A209-A213 PolarHBondContact O-N 3.43Å |
| 210 | I | 97.3 | Very high | 96 | Very high | 67 Ų | 67 | 87.1 Ų | 87.1 | 34% | 0.344 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -63.4 | -49.6 | 175.1 | -66.8 | 167 | 0 | 0 | 0 | 110.1 | K206 Q207 S212 A213 E214 | K206-I210 HydrophobicContact CG-CD1 4.17Å; K206-I210 WeakPolarHBondContact O-CG1 3.28Å; K206-I210 PolarHBondContact O-N 2.78Å; Q207-I210 PolarHBondContact O-N 2.63Å; I210-S212 VanDerWaalsContact C-N 3.29Å; I210-S212 PolarHBondContact O-N 3.37Å; I210-A213 PolarHBondContact O-N 3.09Å; I210-E214 HydrophobicContact CG2-CG 4.4Å; I210-E214 WeakPolarHBondContact O-CB 3.31Å; I210-E214 WeakPolarHBondContact O-CG 3.46Å; I210-E214 PolarHBondContact O-N 2.91Å |
| 211 | I | 96.9 | Very high | 95.7 | Very high | 95 Ų | 95 | 86.9 Ų | 86.9 | 49% | 0.487 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -60.2 | -40.8 | 178.7 | -67.6 | 168.3 | 0 | 0 | 0 | 110.8 | Q207 A208 G215 | Q207-I211 HydrophobicContact CG-CD1 3.95Å; Q207-I211 VanDerWaalsContact O-CG1 3.3Å; Q207-I211 WeakPolarHBondContact O-CG1 3.47Å; Q207-I211 PolarHBondContact O-N 2.89Å; A208-I211 PolarHBondContact O-N 3.21Å; I211-G215 PolarHBondContact O-N 3.27Å |
| 212 | S | 96.2 | Very high | 95.3 | Very high | 65 Ų | 65 | 87 Ų | 87 | 46% | 0.455 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -63.4 | -46.6 | 175.9 | -167.8 | 0 | 0 | 0 | 0 | 111.6 | A208 A209 I210 E214 G215 D216 | A208-S212 WeakPolarHBondContact O-CB 3.15Å; A208-S212 PolarHBondContact O-N 3.49Å; A209-S212 PolarHBondContact O-N 3.44Å; I210-S212 VanDerWaalsContact C-N 3.29Å; I210-S212 PolarHBondContact O-N 3.37Å; S212-E214 PolarHBondContact O-N 3.33Å; S212-G215 PolarHBondContact O-N 3.3Å; S212-D216 WeakPolarHBondContact O-CB 3.24Å; S212-D216 VanDerWaalsContact O-CG 3.26Å; S212-D216 PolarHBondContact O-N 3.03Å |
| 213 | A | 95.6 | Very high | 94.8 | Very high | 57 Ų | 57 | 89.4 Ų | 89.4 | 47% | 0.471 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -65.5 | -38.4 | 179.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | A209 I210 D216 S217 | A209-A213 WeakPolarHBondContact O-CB 3.4Å; A209-A213 PolarHBondContact O-N 3.43Å; I210-A213 PolarHBondContact O-N 3.09Å; A213-D216 PolarHBondContact O-N 3.01Å; A213-S217 WeakPolarHBondContact O-CB 3.48Å; A213-S217 PolarHBondContact O-N 2.97Å |
| 214 | E | 96.4 | Very high | 94.3 | Very high | 113 Ų | 113 | 85.9 Ų | 85.9 | 53% | 0.528 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -64.1 | -43 | 172.1 | -73.7 | 176.8 | 176.9 | 0 | 0 | 111.3 | I210 S212 S217 Q218 | I210-E214 HydrophobicContact CG2-CG 4.4Å; I210-E214 WeakPolarHBondContact O-CB 3.31Å; I210-E214 WeakPolarHBondContact O-CG 3.46Å; I210-E214 PolarHBondContact O-N 2.91Å; S212-E214 PolarHBondContact O-N 3.33Å; E214-S217 PolarHBondContact O-N 2.93Å; E214-Q218 WeakPolarHBondContact O-CB 3.42Å; E214-Q218 VanDerWaalsContact O-CG 3.3Å; E214-Q218 WeakPolarHBondContact O-CG 3.38Å; E214-Q218 PolarHBondContact O-N 3.42Å |
| 215 | G | 96.7 | Very high | 93.8 | Very high | 34 Ų | 34 | 84.3 Ų | 84.3 | 35% | 0.351 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -60 | -46.3 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | I211 S212 Q218 A219 | I211-G215 PolarHBondContact O-N 3.27Å; S212-G215 PolarHBondContact O-N 3.3Å; G215-Q218 PolarHBondContact O-N 2.94Å; G215-A219 WeakPolarHBondContact O-CB 3.3Å; G215-A219 PolarHBondContact O-N 2.93Å |
| 216 | D | 94.6 | Very high | 93.2 | Very high | 105 Ų | 105 | 81.4 Ų | 81.4 | 56% | 0.561 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -64.3 | -40.5 | 177.2 | -69.7 | -24.1 | 0 | 0 | 0 | 111.5 | S212 A213 A219 A220 | S212-D216 WeakPolarHBondContact O-CB 3.24Å; S212-D216 VanDerWaalsContact O-CG 3.26Å; S212-D216 PolarHBondContact O-N 3.03Å; A213-D216 PolarHBondContact O-N 3.01Å; D216-A219 PolarHBondContact O-N 3.01Å; D216-A220 VanDerWaalsContact O-CB 3.22Å; D216-A220 WeakPolarHBondContact O-CB 3.17Å; D216-A220 PolarHBondContact O-N 3.48Å |
| 217 | S | 95.3 | Very high | 92.4 | Very high | 67 Ų | 67 | 77.5 Ų | 77.5 | 47% | 0.469 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -65.2 | -45.8 | 176.2 | -179.5 | 0 | 0 | 0 | 0 | 111.8 | A213 E214 A220 L221 | A213-S217 WeakPolarHBondContact O-CB 3.48Å; A213-S217 PolarHBondContact O-N 2.97Å; E214-S217 PolarHBondContact O-N 2.93Å; S217-A220 PolarHBondContact O-N 3.24Å; S217-L221 VanDerWaalsContact O-CG 3.31Å; S217-L221 WeakPolarHBondContact O-CG 3.43Å; S217-L221 PolarHBondContact O-N 3.42Å |
| 218 | Q | 94.5 | Very high | 91.6 | Very high | 124 Ų | 124 | 80.5 Ų | 80.5 | 58% | 0.579 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -64.3 | -42.3 | 176.2 | -72.5 | 178.6 | 14.4 | 0 | 0 | 111.5 | E214 G215 L221 L222 | E214-Q218 WeakPolarHBondContact O-CB 3.42Å; E214-Q218 VanDerWaalsContact O-CG 3.3Å; E214-Q218 WeakPolarHBondContact O-CG 3.38Å; E214-Q218 PolarHBondContact O-N 3.42Å; G215-Q218 PolarHBondContact O-N 2.94Å; Q218-L221 PolarHBondContact O-N 2.87Å; Q218-L222 WeakPolarHBondContact O-CG 3.37Å; Q218-L222 PolarHBondContact O-N 3.3Å |
| 219 | A | 91.8 | Very high | 90.8 | Very high | 43 Ų | 43 | 86.1 Ų | 86.1 | 36% | 0.355 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -61.4 | -45.8 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.4 | G215 D216 L221 L222 I223 | G215-A219 WeakPolarHBondContact O-CB 3.3Å; G215-A219 PolarHBondContact O-N 2.93Å; D216-A219 PolarHBondContact O-N 3.01Å; A219-L221 VanDerWaalsContact C-N 3.35Å; A219-L221 PolarHBondContact O-N 3.43Å; A219-L222 PolarHBondContact O-N 3.04Å; A219-I223 WeakPolarHBondContact O-CB 3.27Å; A219-I223 VanDerWaalsContact O-CG1 3.23Å; A219-I223 WeakPolarHBondContact O-CG1 3.44Å; A219-I223 PolarHBondContact O-N 2.85Å |
| 220 | A | 90.6 | Very high | 89.8 | Confident | 57 Ų | 57 | 86 Ų | 86 | 47% | 0.471 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -62 | -40.3 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | D216 S217 I223 A224 | D216-A220 VanDerWaalsContact O-CB 3.22Å; D216-A220 WeakPolarHBondContact O-CB 3.17Å; D216-A220 PolarHBondContact O-N 3.48Å; S217-A220 PolarHBondContact O-N 3.24Å; A220-I223 PolarHBondContact O-N 2.79Å; A220-A224 VanDerWaalsContact O-CB 3.31Å; A220-A224 WeakPolarHBondContact O-CB 3.27Å; A220-A224 PolarHBondContact O-N 2.85Å |
| 221 | L | 92.1 | Very high | 88.7 | Confident | 101 Ų | 101 | 84.5 Ų | 84.5 | 53% | 0.529 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -64.1 | -43.9 | 174.6 | -74.3 | 168.4 | 0 | 0 | 0 | 111.9 | S217 Q218 A219 I223 A224 N225 | S217-L221 VanDerWaalsContact O-CG 3.31Å; S217-L221 WeakPolarHBondContact O-CG 3.43Å; S217-L221 PolarHBondContact O-N 3.42Å; Q218-L221 PolarHBondContact O-N 2.87Å; A219-L221 VanDerWaalsContact C-N 3.35Å; A219-L221 PolarHBondContact O-N 3.43Å; L221-I223 VanDerWaalsContact C-N 3.35Å; L221-A224 PolarHBondContact O-N 2.93Å; L221-N225 WeakPolarHBondContact O-CB 3.44Å; L221-N225 PolarHBondContact O-N 3.41Å; L221-N225 PolarHBondContact O-ND2 3.39Å |
| 222 | L | 89.3 | Confident | 87.8 | Confident | 121 Ų | 121 | 85.9 Ų | 85.9 | 63% | 0.634 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -63 | -42.2 | 175.8 | -73.7 | 168.7 | 0 | 0 | 0 | 111.6 | Q218 A219 N225 S226 | Q218-L222 WeakPolarHBondContact O-CG 3.37Å; Q218-L222 PolarHBondContact O-N 3.3Å; A219-L222 PolarHBondContact O-N 3.04Å; L222-N225 PolarHBondContact O-N 2.96Å; L222-S226 WeakPolarHBondContact O-CB 3.23Å; L222-S226 PolarHBondContact O-N 2.73Å; L222-S226 PolarHBondContact O-OG 2.93Å; L222-S226 VanDerWaalsContact O-OG 3.07Å |
| 223 | I | 86.3 | Confident | 86.9 | Confident | 100 Ų | 100 | 85.3 Ų | 85.3 | 51% | 0.513 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -62.9 | -47 | 175.2 | -69.2 | 166.1 | 0 | 0 | 0 | 110.1 | A219 A220 L221 N225 S226 L227 | A219-I223 WeakPolarHBondContact O-CB 3.27Å; A219-I223 VanDerWaalsContact O-CG1 3.23Å; A219-I223 WeakPolarHBondContact O-CG1 3.44Å; A219-I223 PolarHBondContact O-N 2.85Å; A220-I223 PolarHBondContact O-N 2.79Å; L221-I223 VanDerWaalsContact C-N 3.35Å; I223-N225 PolarHBondContact O-N 3.23Å; I223-S226 WeakPolarHBondContact CA-OG 3.31Å; I223-S226 PolarHBondContact O-N 2.87Å; I223-S226 PolarHBondContact O-OG 2.82Å; I223-L227 HydrophobicContact CG2-CD1 3.66Å; I223-L227 VanDerWaalsContact O-CD1 3.27Å; I223-L227 WeakPolarHBondContact O-CD1 3.49Å; I223-L227 PolarHBondContact O-N 2.86Å |
| 224 | A | 85.5 | Confident | 86.1 | Confident | 52 Ų | 52 | 86 Ų | 86 | 43% | 0.43 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -60.2 | -45.1 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | A220 L221 L227 Q228 | A220-A224 VanDerWaalsContact O-CB 3.31Å; A220-A224 WeakPolarHBondContact O-CB 3.27Å; A220-A224 PolarHBondContact O-N 2.85Å; L221-A224 PolarHBondContact O-N 2.93Å; A224-L227 PolarHBondContact O-N 2.94Å; A224-Q228 WeakPolarHBondContact O-CB 3.21Å; A224-Q228 PolarHBondContact O-N 2.82Å |
| 225 | N | 86.8 | Confident | 85.4 | Confident | 88 Ų | 88 | 82.6 Ų | 82.6 | 47% | 0.471 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -61.9 | -44.6 | 176.1 | -69.6 | -21.8 | 0 | 0 | 0 | 111.5 | L221 L222 I223 Q228 E229 | L221-N225 WeakPolarHBondContact O-CB 3.44Å; L221-N225 PolarHBondContact O-N 3.41Å; L221-N225 PolarHBondContact O-ND2 3.39Å; L222-N225 PolarHBondContact O-N 2.96Å; I223-N225 PolarHBondContact O-N 3.23Å; N225-Q228 PolarHBondContact O-N 2.88Å; N225-E229 PolarHBondContact O-N 3Å |
| 226 | S | 83.2 | Confident | 84.7 | Confident | 58 Ų | 58 | 86.8 Ų | 86.8 | 41% | 0.406 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -67.1 | -35.2 | 178.2 | 61.9 | 0 | 0 | 0 | 0 | 113.3 | L222 I223 E229 A230 | L222-S226 WeakPolarHBondContact O-CB 3.23Å; L222-S226 PolarHBondContact O-N 2.73Å; L222-S226 PolarHBondContact O-OG 2.93Å; L222-S226 VanDerWaalsContact O-OG 3.07Å; I223-S226 WeakPolarHBondContact CA-OG 3.31Å; I223-S226 PolarHBondContact O-N 2.87Å; I223-S226 PolarHBondContact O-OG 2.82Å; S226-E229 PolarHBondContact O-N 2.85Å; S226-A230 VanDerWaalsContact O-CB 3.31Å; S226-A230 WeakPolarHBondContact O-CB 3.35Å; S226-A230 PolarHBondContact O-N 2.77Å |
| 227 | L | 81.3 | Confident | 84.2 | Confident | 63 Ų | 63 | 86.5 Ų | 86.5 | 33% | 0.33 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -65.1 | -40.5 | 170.9 | -99.8 | 83.4 | 0 | 0 | 0 | 112 | I223 A224 E229 A230 G231 V235 | I223-L227 HydrophobicContact CG2-CD1 3.66Å; I223-L227 VanDerWaalsContact O-CD1 3.27Å; I223-L227 WeakPolarHBondContact O-CD1 3.49Å; I223-L227 PolarHBondContact O-N 2.86Å; A224-L227 PolarHBondContact O-N 2.94Å; L227-E229 VanDerWaalsContact C-N 3.29Å; L227-E229 PolarHBondContact O-N 2.89Å; L227-A230 PolarHBondContact O-N 3.03Å; L227-G231 PolarHBondContact O-N 3.19Å; L227-V235 HydrophobicContact CD2-CG2 3.43Å; L227-V235 VanDerWaalsContact CD2-CG2 3.43Å; L227-V235 HydrophobicContact CG-CG2 4.26Å |
| 228 | Q | 79.6 | Confident | 83.7 | Confident | 163 Ų | 163 | 91 Ų | 91 | 76% | 0.762 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -64.5 | -36 | 178.8 | -168.6 | 176.9 | -8.5 | 0 | 0 | 111.6 | A224 N225 | A224-Q228 WeakPolarHBondContact O-CB 3.21Å; A224-Q228 PolarHBondContact O-N 2.82Å; N225-Q228 PolarHBondContact O-N 2.88Å |
| 229 | E | 80.6 | Confident | 83.3 | Confident | 176 Ų | 176 | 91.5 Ų | 91.5 | 82% | 0.822 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -72.3 | -40.7 | 173.8 | -73 | -176.5 | 167.5 | 0 | 0 | 113.1 | N225 S226 L227 | N225-E229 PolarHBondContact O-N 3Å; S226-E229 PolarHBondContact O-N 2.85Å; L227-E229 VanDerWaalsContact C-N 3.29Å; L227-E229 PolarHBondContact O-N 2.89Å |
| 230 | A | 75.8 | Confident | 83.2 | Confident | 57 Ų | 57 | 95 Ų | 95 | 47% | 0.471 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -82.2 | -16.6 | -175.5 | 0 | 0 | 0 | 0 | 0 | 114.7 | S226 L227 L234 | S226-A230 VanDerWaalsContact O-CB 3.31Å; S226-A230 WeakPolarHBondContact O-CB 3.35Å; S226-A230 PolarHBondContact O-N 2.77Å; L227-A230 PolarHBondContact O-N 3.03Å; A230-L234 HydrophobicContact CB-CB 4.18Å; A230-L234 HydrophobicContact CB-CD1 3.53Å; A230-L234 HydrophobicContact CB-CG 4.46Å |
| 231 | G | 74.2 | Confident | 83.2 | Confident | 35 Ų | 35 | 96 Ų | 96 | 36% | 0.361 | 52% | 0.515 | S | S | . | . | trans | 76.9 | 179.1 | 178.5 | 0 | 0 | 0 | 0 | 0 | 114.9 | L227 G233 L234 | L227-G231 PolarHBondContact O-N 3.19Å; G231-G233 PolarHBondContact O-N 3.34Å; G231-G233 VanDerWaalsContact O-N 3.13Å; G231-L234 PolarHBondContact O-N 2.99Å | ||
| 232 | D | 77.4 | Confident | 83.2 | Confident | 124 Ų | 124 | 93.4 Ų | 93.4 | 66% | 0.663 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -64.2 | -20.6 | -170.7 | -155.1 | 24.7 | 0 | 0 | 0 | 114 | L234 V235 E236 | D232-L234 VanDerWaalsContact C-N 3.28Å; D232-L234 PolarHBondContact O-N 3.42Å; D232-V235 PolarHBondContact O-N 3.44Å; D232-E236 PolarHBondContact O-N 3.04Å |
| 233 | G | 77.4 | Confident | 83.3 | Confident | 54 Ų | 54 | 90.3 Ų | 90.3 | 56% | 0.557 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -62.9 | -30.2 | 179.2 | 0 | 0 | 0 | 0 | 0 | 114 | G231 L237 | G231-G233 PolarHBondContact O-N 3.34Å; G231-G233 VanDerWaalsContact O-N 3.13Å; G233-L237 PolarHBondContact O-N 3Å; G233-L237 VanDerWaalsContact O-N 3.08Å |
| 234 | L | 79.2 | Confident | 83.5 | Confident | 72 Ų | 72 | 92.3 Ų | 92.3 | 38% | 0.377 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -74.8 | -31.2 | 179.6 | -151.8 | 143.1 | 0 | 0 | 0 | 111.5 | A230 G231 D232 R238 | A230-L234 HydrophobicContact CB-CB 4.18Å; A230-L234 HydrophobicContact CB-CD1 3.53Å; A230-L234 HydrophobicContact CB-CG 4.46Å; G231-L234 PolarHBondContact O-N 2.99Å; D232-L234 VanDerWaalsContact C-N 3.28Å; D232-L234 PolarHBondContact O-N 3.42Å; L234-R238 HydrophobicContact CD2-CG 4.37Å; L234-R238 WeakPolarHBondContact O-CG 3.28Å; L234-R238 PolarHBondContact O-N 3.45Å; L234-R238 VanDerWaalsContact O-N 3.09Å |
| 235 | V | 82.3 | Confident | 83.7 | Confident | 41 Ų | 41 | 94.8 Ų | 94.8 | 25% | 0.248 | 51% | 0.514 | C | S | . | . | H | α-helix | trans | -68.7 | -43.4 | 174.1 | -179.9 | 0 | 0 | 0 | 0 | 110.7 | L227 D232 R238 K239 | L227-V235 HydrophobicContact CD2-CG2 3.43Å; L227-V235 VanDerWaalsContact CD2-CG2 3.43Å; L227-V235 HydrophobicContact CG-CG2 4.26Å; D232-V235 PolarHBondContact O-N 3.44Å; V235-R238 PolarHBondContact O-N 3.44Å; V235-K239 HydrophobicContact CG1-CD 4.46Å; V235-K239 WeakPolarHBondContact O-CG 3.45Å; V235-K239 PolarHBondContact O-N 3.17Å |
| 236 | E | 82 | Confident | 83.8 | Confident | 121 Ų | 121 | 95.4 Ų | 95.4 | 57% | 0.565 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -63.1 | -43.1 | 175.8 | -71.8 | -139 | 145.1 | 0 | 0 | 112.4 | D232 R238 K239 L240 | D232-E236 PolarHBondContact O-N 3.04Å; E236-R238 VanDerWaalsContact C-N 3.34Å; E236-R238 PolarHBondContact O-N 2.97Å; E236-K239 WeakPolarHBondContact O-CB 3.3Å; E236-K239 PolarHBondContact O-N 3.32Å; E236-L240 PolarHBondContact O-N 2.92Å |
| 237 | L | 83.4 | Confident | 83.9 | Confident | 99 Ų | 99 | 95.2 Ų | 95.2 | 52% | 0.518 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -59.4 | -44.9 | 175.9 | -175.7 | 66 | 0 | 0 | 0 | 111.4 | G233 K239 L240 E241 | G233-L237 PolarHBondContact O-N 3Å; G233-L237 VanDerWaalsContact O-N 3.08Å; L237-K239 VanDerWaalsContact C-N 3.35Å; L237-K239 PolarHBondContact O-N 3.49Å; L237-L240 PolarHBondContact O-N 3.23Å; L237-E241 PolarHBondContact O-N 2.89Å |
| 238 | R | 84.1 | Confident | 84.2 | Confident | 161 Ų | 161 | 97 Ų | 97 | 61% | 0.608 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -63.9 | -36.3 | 175.9 | -73.7 | -60.3 | -164.2 | 174.7 | 5.4 | 113.2 | L234 V235 E236 L240 E241 A242 | L234-R238 HydrophobicContact CD2-CG 4.37Å; L234-R238 WeakPolarHBondContact O-CG 3.28Å; L234-R238 PolarHBondContact O-N 3.45Å; L234-R238 VanDerWaalsContact O-N 3.09Å; V235-R238 PolarHBondContact O-N 3.44Å; E236-R238 VanDerWaalsContact C-N 3.34Å; E236-R238 PolarHBondContact O-N 2.97Å; R238-L240 VanDerWaalsContact C-N 3.33Å; R238-E241 WeakPolarHBondContact CD-OE2 3.41Å; R238-E241 IonicContact CZ-OE2 3.74Å; R238-E241 IonicContact NE-OE2 3.89Å; R238-E241 IonicContact NH1-OE2 2.92Å; R238-E241 PolarHBondContact NH1-OE2 3.42Å; R238-A242 WeakPolarHBondContact O-CB 3.36Å; R238-A242 PolarHBondContact O-N 3Å |
| 239 | K | 86.7 | Confident | 84.5 | Confident | 135 Ų | 135 | 95.9 Ų | 95.9 | 59% | 0.587 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -63.8 | -40.3 | 173.8 | -76.9 | 174 | -179.4 | 169.6 | 0 | 111.5 | V235 E236 L237 A243 | V235-K239 HydrophobicContact CG1-CD 4.46Å; V235-K239 WeakPolarHBondContact O-CG 3.45Å; V235-K239 PolarHBondContact O-N 3.17Å; E236-K239 WeakPolarHBondContact O-CB 3.3Å; E236-K239 PolarHBondContact O-N 3.32Å; L237-K239 VanDerWaalsContact C-N 3.35Å; L237-K239 PolarHBondContact O-N 3.49Å; K239-A243 VanDerWaalsContact O-CB 3.31Å; K239-A243 WeakPolarHBondContact O-CB 3.35Å; K239-A243 PolarHBondContact O-N 2.92Å |
| 240 | L | 90.3 | Very high | 84.6 | Confident | 117 Ų | 117 | 91.2 Ų | 91.2 | 61% | 0.613 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -66.5 | -45.8 | 176.6 | -73.5 | 167.5 | 0 | 0 | 0 | 111.6 | E236 L237 R238 A242 A243 E244 | E236-L240 PolarHBondContact O-N 2.92Å; L237-L240 PolarHBondContact O-N 3.23Å; R238-L240 VanDerWaalsContact C-N 3.33Å; L240-A242 PolarHBondContact O-N 3.3Å; L240-A243 PolarHBondContact O-N 2.8Å; L240-E244 PolarHBondContact O-N 2.87Å |
| 241 | E | 89.4 | Confident | 84.8 | Confident | 77 Ų | 77 | 92.1 Ų | 92.1 | 36% | 0.36 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -58.6 | -47.1 | 175.1 | -73.6 | 179.3 | 173.2 | 0 | 0 | 111.7 | L237 R238 A243 E244 D245 | L237-E241 PolarHBondContact O-N 2.89Å; R238-E241 WeakPolarHBondContact CD-OE2 3.41Å; R238-E241 IonicContact CZ-OE2 3.74Å; R238-E241 IonicContact NE-OE2 3.89Å; R238-E241 IonicContact NH1-OE2 2.92Å; R238-E241 PolarHBondContact NH1-OE2 3.42Å; E241-A243 VanDerWaalsContact C-N 3.32Å; E241-A243 PolarHBondContact O-N 3.5Å; E241-E244 WeakPolarHBondContact O-CB 3.42Å; E241-E244 PolarHBondContact O-N 2.95Å; E241-D245 PolarHBondContact O-N 2.83Å |
| 242 | A | 93 | Very high | 85.1 | Confident | 48 Ų | 48 | 99.2 Ų | 99.2 | 40% | 0.397 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -63.6 | -38.1 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | R238 L240 D245 I246 | R238-A242 WeakPolarHBondContact O-CB 3.36Å; R238-A242 PolarHBondContact O-N 3Å; L240-A242 PolarHBondContact O-N 3.3Å; A242-D245 PolarHBondContact O-N 3.44Å; A242-I246 WeakPolarHBondContact O-CB 3.31Å; A242-I246 WeakPolarHBondContact O-CD1 3.43Å; A242-I246 WeakPolarHBondContact O-CG1 3.26Å; A242-I246 PolarHBondContact O-N 3.38Å |
| 243 | A | 90.3 | Very high | 85.2 | Confident | 56 Ų | 56 | 95.8 Ų | 95.8 | 46% | 0.463 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -66 | -39.6 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | K239 L240 E241 A247 | K239-A243 VanDerWaalsContact O-CB 3.31Å; K239-A243 WeakPolarHBondContact O-CB 3.35Å; K239-A243 PolarHBondContact O-N 2.92Å; L240-A243 PolarHBondContact O-N 2.8Å; E241-A243 VanDerWaalsContact C-N 3.32Å; E241-A243 PolarHBondContact O-N 3.5Å; A243-A247 VanDerWaalsContact O-CB 3.27Å; A243-A247 WeakPolarHBondContact O-CB 3.43Å; A243-A247 PolarHBondContact O-N 2.87Å |
| 244 | E | 91.5 | Very high | 84.7 | Confident | 141 Ų | 141 | 105 Ų | 105 | 66% | 0.659 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -61.7 | -47.9 | 174.1 | -174.7 | 178.6 | 179.7 | 0 | 0 | 111.2 | L240 E241 I246 A247 F248 | L240-E244 PolarHBondContact O-N 2.87Å; E241-E244 WeakPolarHBondContact O-CB 3.42Å; E241-E244 PolarHBondContact O-N 2.95Å; E244-I246 PolarHBondContact O-N 2.93Å; E244-A247 PolarHBondContact O-N 3.3Å; E244-F248 WeakPolarHBondContact O-CB 3.37Å; E244-F248 PolarHBondContact O-N 2.92Å |
| 245 | D | 89.8 | Confident | 84.2 | Confident | 104 Ų | 104 | 109 Ų | 109 | 56% | 0.556 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -62.8 | -44.1 | 178.9 | -89.7 | -12.8 | 0 | 0 | 0 | 112.4 | E241 A242 F248 Q249 | E241-D245 PolarHBondContact O-N 2.83Å; A242-D245 PolarHBondContact O-N 3.44Å; D245-F248 PolarHBondContact O-N 3.44Å; D245-Q249 WeakPolarHBondContact O-CG 3.2Å; D245-Q249 PolarHBondContact O-N 2.99Å |
| 246 | I | 87.8 | Confident | 83.2 | Confident | 101 Ų | 101 | 109.8 Ų | 109.8 | 52% | 0.518 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -62 | -46.2 | 175.6 | -69.2 | 164.8 | 0 | 0 | 0 | 110.1 | A242 E244 F248 Q249 L250 | A242-I246 WeakPolarHBondContact O-CB 3.31Å; A242-I246 WeakPolarHBondContact O-CD1 3.43Å; A242-I246 WeakPolarHBondContact O-CG1 3.26Å; A242-I246 PolarHBondContact O-N 3.38Å; E244-I246 PolarHBondContact O-N 2.93Å; I246-F248 VanDerWaalsContact C-N 3.3Å; I246-F248 PolarHBondContact O-N 2.85Å; I246-Q249 PolarHBondContact O-N 2.9Å; I246-L250 HydrophobicContact CG2-CD1 3.67Å; I246-L250 HydrophobicContact CG2-CG 4.23Å; I246-L250 WeakPolarHBondContact O-CB 3.46Å; I246-L250 VanDerWaalsContact O-CG 3.25Å; I246-L250 WeakPolarHBondContact O-CG 3.46Å; I246-L250 PolarHBondContact O-N 3.12Å |
| 247 | A | 86.6 | Confident | 82.2 | Confident | 55 Ų | 55 | 109.9 Ų | 109.9 | 46% | 0.455 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -61 | -40.6 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.6 | A243 E244 L250 S251 | A243-A247 VanDerWaalsContact O-CB 3.27Å; A243-A247 WeakPolarHBondContact O-CB 3.43Å; A243-A247 PolarHBondContact O-N 2.87Å; E244-A247 PolarHBondContact O-N 3.3Å; A247-L250 PolarHBondContact O-N 2.9Å; A247-S251 WeakPolarHBondContact O-CB 3.33Å; A247-S251 PolarHBondContact O-N 2.92Å |
| 248 | F | 87.1 | Confident | 81.3 | Confident | 101 Ų | 101 | 113.3 Ų | 113.3 | 44% | 0.443 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -64 | -46.6 | 176.3 | -174.7 | -100.1 | 0 | 0 | 0 | 112.1 | E244 D245 I246 S251 R252 | E244-F248 WeakPolarHBondContact O-CB 3.37Å; E244-F248 PolarHBondContact O-N 2.92Å; D245-F248 PolarHBondContact O-N 3.44Å; I246-F248 VanDerWaalsContact C-N 3.3Å; I246-F248 PolarHBondContact O-N 2.85Å; F248-S251 PolarHBondContact O-N 3.4Å; F248-S251 PolarHBondContact O-OG 2.94Å; F248-R252 PolarHBondContact O-N 3.41Å |
| 249 | Q | 86.2 | Confident | 80.4 | Confident | 139 Ų | 139 | 111.1 Ų | 111.1 | 65% | 0.65 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -63.8 | -42.1 | 176.1 | -71.9 | -174.3 | 7.6 | 0 | 0 | 112.3 | D245 I246 R252 S253 | D245-Q249 WeakPolarHBondContact O-CG 3.2Å; D245-Q249 PolarHBondContact O-N 2.99Å; I246-Q249 PolarHBondContact O-N 2.9Å; Q249-R252 PolarHBondContact O-N 3.33Å; Q249-S253 PolarHBondContact O-N 2.9Å; Q249-S253 VanDerWaalsContact O-N 3.15Å |
| 250 | L | 81.6 | Confident | 79.2 | Confident | 78 Ų | 78 | 109.1 Ų | 109.1 | 41% | 0.408 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -63.7 | -42.3 | 176.9 | -73.7 | 171 | 0 | 0 | 0 | 111.8 | I246 A247 R252 S253 V256 | I246-L250 HydrophobicContact CG2-CD1 3.67Å; I246-L250 HydrophobicContact CG2-CG 4.23Å; I246-L250 WeakPolarHBondContact O-CB 3.46Å; I246-L250 VanDerWaalsContact O-CG 3.25Å; I246-L250 WeakPolarHBondContact O-CG 3.46Å; I246-L250 PolarHBondContact O-N 3.12Å; A247-L250 PolarHBondContact O-N 2.9Å; L250-R252 PolarHBondContact O-N 3.49Å; L250-S253 PolarHBondContact O-N 2.94Å; L250-S253 VanDerWaalsContact O-N 3.1Å; L250-S253 PolarHBondContact O-OG 3.31Å; L250-V256 HydrophobicContact CD2-CG2 3.82Å |
| 251 | S | 81.3 | Confident | 77.5 | Confident | 76 Ų | 76 | 108.9 Ų | 108.9 | 53% | 0.531 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -60.8 | -27.3 | 177.4 | 77.9 | 0 | 0 | 0 | 0 | 113.5 | A247 F248 | A247-S251 WeakPolarHBondContact O-CB 3.33Å; A247-S251 PolarHBondContact O-N 2.92Å; F248-S251 PolarHBondContact O-N 3.4Å; F248-S251 PolarHBondContact O-OG 2.94Å |
| 252 | R | 79.6 | Confident | 76.3 | Confident | 183 Ų | 183 | 109.4 Ų | 109.4 | 69% | 0.691 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -89.1 | -18.7 | 177.4 | -77 | -177.8 | 168.9 | -168.1 | -2.3 | 113.6 | F248 Q249 L250 | F248-R252 PolarHBondContact O-N 3.41Å; Q249-R252 PolarHBondContact O-N 3.33Å; L250-R252 PolarHBondContact O-N 3.49Å |
| 253 | S | 79.8 | Confident | 74.6 | Confident | 52 Ų | 52 | 114.3 Ų | 114.3 | 36% | 0.364 | 62% | 0.62 | S | S | . | * | trans | -77.6 | 130.6 | -179.2 | 74.3 | 0 | 0 | 0 | 0 | 111 | Q249 L250 N255 V256 | Q249-S253 PolarHBondContact O-N 2.9Å; Q249-S253 VanDerWaalsContact O-N 3.15Å; L250-S253 PolarHBondContact O-N 2.94Å; L250-S253 VanDerWaalsContact O-N 3.1Å; L250-S253 PolarHBondContact O-OG 3.31Å; S253-N255 VanDerWaalsContact C-N 3.26Å; S253-N255 PolarHBondContact O-N 2.71Å; S253-V256 WeakPolarHBondContact OG-CG2 3.37Å | ||
| 254 | R | 66.9 | Low | 73.2 | Confident | 247 Ų | 247 | 115.8 Ų | 115.8 | 93% | 0.932 | 64% | 0.641 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.9 | -7.3 | -172.4 | -71.8 | -179.1 | 178.9 | 175.7 | -0.8 | 115.2 | ||
| 255 | N | 68.3 | Low | 71.8 | Confident | 156 Ų | 156 | 113.3 Ų | 113.3 | 83% | 0.834 | 64% | 0.635 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -115.5 | 24.1 | -171.3 | -78.1 | 9.6 | 0 | 0 | 0 | 114.2 | S253 | S253-N255 VanDerWaalsContact C-N 3.26Å; S253-N255 PolarHBondContact O-N 2.71Å |
| 256 | V | 62 | Low | 70.2 | Confident | 58 Ų | 58 | 117.1 Ų | 117.1 | 35% | 0.352 | 66% | 0.655 | S | S | . | * | trans | -100.9 | 115.6 | 178.8 | 174.9 | 0 | 0 | 0 | 0 | 110.6 | L250 S253 Y258 | L250-V256 HydrophobicContact CD2-CG2 3.82Å; S253-V256 WeakPolarHBondContact OG-CG2 3.37Å; V256-Y258 HydrophobicContact CG1-CE2 4.15Å | ||
| 257 | T | 61.2 | Low | 69 | Low | 123 Ų | 123 | 118 Ų | 118 | 76% | 0.755 | 66% | 0.66 | S | S | * | * | P | Polyproline II helix | trans | -102.6 | 117.8 | 173.8 | -54.3 | 0 | 0 | 0 | 0 | 108.9 | L259 | T257-L259 PolarHBondContact O-N 3.3Š|
| 258 | Y | 63.9 | Low | 67.5 | Low | 172 Ų | 172 | 124.4 Ų | 124.4 | 68% | 0.675 | 68% | 0.68 | S | S | * | * | P | Polyproline II helix | trans | -76.6 | 118.3 | 176.6 | -68.5 | -89.9 | 0 | 0 | 0 | 110.1 | V256 P260 | V256-Y258 HydrophobicContact CG1-CE2 4.15Å; Y258-P260 WeakPolarHBondContact O-CD 3.42Å |
| 259 | L | 64.4 | Low | 66.1 | Low | 114 Ų | 114 | 126.4 Ų | 126.4 | 60% | 0.597 | 70% | 0.695 | S | S | * | * | P | Polyproline II helix | trans | -93.5 | 116 | 173.2 | -68 | 170.2 | 0 | 0 | 0 | 109.3 | T257 L267 | T257-L259 PolarHBondContact O-N 3.3Å; L259-L267 HydrophobicContact CD1-CD1 4.07Å |
| 260 | P | 61.6 | Low | 64.5 | Low | 94 Ų | 94 | 125.4 Ų | 125.4 | 61% | 0.61 | 70% | 0.7 | S | S | * | * | P | Polyproline II helix | trans | -69.5 | 133.3 | 174.3 | 26.4 | -30.9 | 0 | 0 | 0 | 110.5 | Y258 G262 | Y258-P260 WeakPolarHBondContact O-CD 3.42Å; P260-G262 PolarHBondContact O-N 3.46Å |
| 261 | A | 56.2 | Low | 62.9 | Low | 112 Ų | 112 | 134.5 Ų | 134.5 | 93% | 0.926 | 74% | 0.741 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.4 | 125.1 | -179.8 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||
| 262 | G | 62.4 | Low | 62 | Low | 87 Ų | 87 | 137.4 Ų | 137.4 | 90% | 0.897 | 75% | 0.751 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 120 | -3.9 | 172.5 | 0 | 0 | 0 | 0 | 0 | 116.3 | P260 | P260-G262 PolarHBondContact O-N 3.46Š|
| 263 | Q | 58.6 | Low | 61.1 | Low | 151 Ų | 151 | 135 Ų | 135 | 71% | 0.706 | 75% | 0.754 | S | S | * | * | trans | -115 | 112.3 | 177.1 | -140.7 | 173.8 | 12.3 | 0 | 0 | 110.6 | T265 | Q263-T265 PolarHBondContact O-N 3.49Š| ||
| 264 | G | 61.4 | Low | 60.1 | Low | 87 Ų | 87 | 139.6 Ų | 139.6 | 90% | 0.897 | 78% | 0.776 | S | S | * | * | trans | -71.1 | 98.4 | 176.6 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 265 | T | 60.8 | Low | 59.7 | Low | 89 Ų | 89 | 133.3 Ų | 133.3 | 55% | 0.546 | 77% | 0.767 | S | S | . | * | trans | -100.1 | 126.9 | 171 | 38.8 | 0 | 0 | 0 | 0 | 110.3 | Q263 L267 | Q263-T265 PolarHBondContact O-N 3.49Å; T265-L267 PolarHBondContact O-N 3.08Å; T265-L267 VanDerWaalsContact O-N 3.15Å | ||
| 266 | L | 56.9 | Low | 59.1 | Low | 184 Ų | 184 | 131.9 Ų | 131.9 | 96% | 0.963 | 76% | 0.763 | S | S | * | * | trans | -73.8 | 98.3 | 169.2 | -84.2 | 160.4 | 0 | 0 | 0 | 108.6 | Q268 | L266-Q268 PolarHBondContact O-N 3.27Š| ||
| 267 | L | 61.5 | Low | 58.9 | Low | 120 Ų | 120 | 136.8 Ų | 136.8 | 63% | 0.628 | 79% | 0.79 | S | S | * | * | trans | -78.3 | 106.4 | 168.8 | -93.7 | 149.6 | 0 | 0 | 0 | 108.9 | L259 T265 L269 | L259-L267 HydrophobicContact CD1-CD1 4.07Å; T265-L267 PolarHBondContact O-N 3.08Å; T265-L267 VanDerWaalsContact O-N 3.15Å; L267-L269 PolarHBondContact O-N 3.35Å | ||
| 268 | Q | 56.1 | Low | 58.8 | Low | 189 Ų | 189 | 137.8 Ų | 137.8 | 88% | 0.883 | 79% | 0.793 | S | S | * | * | trans | -80.2 | 94.6 | 166.4 | -166.1 | 166.2 | -3.7 | 0 | 0 | 107.9 | L266 | L266-Q268 PolarHBondContact O-N 3.27Š| ||
| 269 | L | 57.3 | Low | 58.4 | Low | 144 Ų | 144 | 135.2 Ų | 135.2 | 75% | 0.754 | 80% | 0.802 | S | S | * | * | trans | -64.9 | 132.9 | 169.1 | -70.5 | 164.3 | 0 | 0 | 0 | 108.5 | L267 | L267-L269 PolarHBondContact O-N 3.35Š| ||
| 270 | P | 53.6 | Low | 57.9 | Low | 117 Ų | 117 | 136.9 Ų | 136.9 | 76% | 0.76 | 82% | 0.819 | S | S | * | * | trans | -65.3 | 137.5 | 166.3 | 28.1 | -29.9 | 0 | 0 | 0 | 108.3 | ||||
| 271 | Q | 48.1 | Very low | 57.5 | Low | 269 Ų | 269 | 140.8 Ų | 140.8 | 100% | 1.257 | 84% | 0.838 | S | S | * | * | trans | -64 | 0 | 169.8 | -71.5 | -148.3 | -5 | 0 | 0 | 111.2 |
Retrieved 271 of 271 residues in 131.7 ms
(Link to these results)