| 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 | I | 63.2 | Low | 88.3 | Confident | 191 Ų | 191 | 108.8 Ų | 108.8 | 98% | 0.979 | 59% | 0.589 | S | S | * | * | 0 | -47.4 | 0 | -55.2 | 174.6 | 0 | 0 | 0 | 111.6 | T4 K5 | I1-T4 PolarHBondContact O-N 3.18Å; I1-K5 PolarHBondContact O-N 3.39Å | |||
| 2 | T | 80.3 | Confident | 89.1 | Confident | 126 Ų | 126 | 109.3 Ų | 109.3 | 77% | 0.773 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -62.1 | -42 | 179 | 48.4 | 0 | 0 | 0 | 0 | 114.3 | T4 K5 L6 | T2-T4 VanDerWaalsContact C-N 3.34Å; T2-T4 PolarHBondContact O-N 3.09Å; T2-K5 PolarHBondContact O-N 3.39Å; T2-L6 PolarHBondContact O-N 2.9Å |
| 3 | S | 78.9 | Confident | 89.7 | Confident | 91 Ų | 91 | 109.8 Ų | 109.8 | 64% | 0.636 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -60.7 | -39 | 179 | -167.6 | 0 | 0 | 0 | 0 | 113.3 | N7 | S3-N7 PolarHBondContact O-N 3.41Å; S3-N7 VanDerWaalsContact O-N 3.09Å |
| 4 | T | 89.3 | Confident | 90.3 | Very high | 88 Ų | 88 | 107.7 Ų | 107.7 | 54% | 0.54 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -69.4 | -39 | -179 | -35.9 | 0 | 0 | 0 | 0 | 111.4 | I1 T2 N7 N8 | I1-T4 PolarHBondContact O-N 3.18Å; T2-T4 VanDerWaalsContact C-N 3.34Å; T2-T4 PolarHBondContact O-N 3.09Å; T4-N7 PolarHBondContact O-N 3.08Å; T4-N8 PolarHBondContact O-N 3.46Å; T4-N8 VanDerWaalsContact O-N 3.08Å; T4-N8 PolarHBondContact O-ND2 3.34Å; T4-N8 PolarHBondContact O-OD1 2.96Å |
| 5 | K | 90.1 | Very high | 90.8 | Very high | 143 Ų | 143 | 109.4 Ų | 109.4 | 62% | 0.622 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -66.3 | -40.7 | 177.4 | -172 | 175.4 | -179 | 178.1 | 0 | 112.2 | I1 T2 N8 Q9 | I1-K5 PolarHBondContact O-N 3.39Å; T2-K5 PolarHBondContact O-N 3.39Å; K5-N8 PolarHBondContact O-N 3.47Å; K5-Q9 WeakPolarHBondContact O-CG 3.46Å; K5-Q9 PolarHBondContact O-N 3.43Å; K5-Q9 VanDerWaalsContact O-N 3.12Å |
| 6 | L | 93.7 | Very high | 91.2 | Very high | 109 Ų | 109 | 108.9 Ų | 108.9 | 57% | 0.571 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -63.2 | -44.8 | 175.2 | -170.9 | 77 | 0 | 0 | 0 | 111 | T2 N8 Q9 C10 | T2-L6 PolarHBondContact O-N 2.9Å; L6-N8 VanDerWaalsContact C-N 3.35Å; L6-N8 PolarHBondContact O-N 2.92Å; L6-Q9 WeakPolarHBondContact O-CB 3.4Å; L6-Q9 PolarHBondContact O-N 3.38Å; L6-Q9 VanDerWaalsContact O-N 3.15Å; L6-C10 PolarHBondContact O-N 2.92Å; L6-C10 PolarHBondContact O-SG 3.16Å; L6-C10 VanDerWaalsContact O-SG 3.38Å |
| 7 | N | 92.6 | Very high | 91.6 | Very high | 85 Ų | 85 | 109.8 Ų | 109.8 | 46% | 0.455 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -59.6 | -44.7 | 178.5 | -166.5 | 69.5 | 0 | 0 | 0 | 112.1 | S3 T4 Q9 C10 E11 | S3-N7 PolarHBondContact O-N 3.41Å; S3-N7 VanDerWaalsContact O-N 3.09Å; T4-N7 PolarHBondContact O-N 3.08Å; N7-Q9 VanDerWaalsContact C-N 3.31Å; N7-Q9 PolarHBondContact O-N 3.5Å; N7-C10 WeakPolarHBondContact O-CB 3.49Å; N7-C10 PolarHBondContact O-N 3.38Å; N7-C10 VanDerWaalsContact O-N 3.16Å; N7-E11 PolarHBondContact ND2-OE1 3.42Å; N7-E11 PolarHBondContact O-N 3.38Å |
| 8 | N | 94.9 | Very high | 92 | Very high | 88 Ų | 88 | 105.4 Ų | 105.4 | 47% | 0.471 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -62.4 | -37.5 | 176.6 | -65.2 | -14.1 | 0 | 0 | 0 | 112.4 | T4 K5 L6 E11 L12 | T4-N8 PolarHBondContact O-N 3.46Å; T4-N8 VanDerWaalsContact O-N 3.08Å; T4-N8 PolarHBondContact O-ND2 3.34Å; T4-N8 PolarHBondContact O-OD1 2.96Å; K5-N8 PolarHBondContact O-N 3.47Å; L6-N8 VanDerWaalsContact C-N 3.35Å; L6-N8 PolarHBondContact O-N 2.92Å; N8-E11 PolarHBondContact O-N 2.96Å; N8-L12 WeakPolarHBondContact O-CB 3.44Å; N8-L12 PolarHBondContact O-N 2.94Å |
| 9 | Q | 95.6 | Very high | 92.3 | Very high | 106 Ų | 106 | 104.3 Ų | 104.3 | 50% | 0.495 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -66.4 | -40.4 | 174.7 | -74.4 | -177.1 | -27.2 | 0 | 0 | 111.8 | K5 L6 N7 L12 L13 | K5-Q9 WeakPolarHBondContact O-CG 3.46Å; K5-Q9 PolarHBondContact O-N 3.43Å; K5-Q9 VanDerWaalsContact O-N 3.12Å; L6-Q9 WeakPolarHBondContact O-CB 3.4Å; L6-Q9 PolarHBondContact O-N 3.38Å; L6-Q9 VanDerWaalsContact O-N 3.15Å; N7-Q9 VanDerWaalsContact C-N 3.31Å; N7-Q9 PolarHBondContact O-N 3.5Å; Q9-L12 PolarHBondContact O-N 3.3Å; Q9-L13 WeakPolarHBondContact O-CB 3.49Å; Q9-L13 VanDerWaalsContact O-CG 3.29Å; Q9-L13 WeakPolarHBondContact O-CG 3.43Å; Q9-L13 PolarHBondContact O-N 3.19Å |
| 10 | C | 95.4 | Very high | 92.6 | Very high | 70 Ų | 70 | 104.2 Ų | 104.2 | 47% | 0.473 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -63.4 | -42.8 | 175 | -68.8 | 0 | 0 | 0 | 0 | 112.2 | L6 N7 L13 S14 | L6-C10 PolarHBondContact O-N 2.92Å; L6-C10 PolarHBondContact O-SG 3.16Å; L6-C10 VanDerWaalsContact O-SG 3.38Å; N7-C10 WeakPolarHBondContact O-CB 3.49Å; N7-C10 PolarHBondContact O-N 3.38Å; N7-C10 VanDerWaalsContact O-N 3.16Å; C10-L13 PolarHBondContact O-N 3.42Å; C10-S14 WeakPolarHBondContact O-CB 2.83Å; C10-S14 PolarHBondContact O-N 3.04Å |
| 11 | E | 96.9 | Very high | 92.8 | Very high | 100 Ų | 100 | 103.6 Ų | 103.6 | 47% | 0.467 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -62.2 | -46.4 | 176.4 | -77.1 | 174.5 | -167.6 | 0 | 0 | 111.9 | N7 N8 L13 S14 Q15 | N7-E11 PolarHBondContact ND2-OE1 3.42Å; N7-E11 PolarHBondContact O-N 3.38Å; N8-E11 PolarHBondContact O-N 2.96Å; E11-L13 PolarHBondContact O-N 3.15Å; E11-S14 PolarHBondContact O-N 3.49Å; E11-Q15 WeakPolarHBondContact O-CG 3.39Å; E11-Q15 PolarHBondContact O-N 3.22Å |
| 12 | L | 98 | Very high | 94.5 | Very high | 114 Ų | 114 | 98.8 Ų | 98.8 | 60% | 0.597 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -61.7 | -44.6 | 177.3 | -179 | 63.9 | 0 | 0 | 0 | 111.8 | N8 Q9 S14 Q15 L16 | N8-L12 WeakPolarHBondContact O-CB 3.44Å; N8-L12 PolarHBondContact O-N 2.94Å; Q9-L12 PolarHBondContact O-N 3.3Å; L12-S14 VanDerWaalsContact C-N 3.29Å; L12-S14 PolarHBondContact O-N 2.99Å; L12-Q15 PolarHBondContact O-N 3.29Å; L12-L16 PolarHBondContact O-N 2.91Å |
| 13 | L | 97.6 | Very high | 95.3 | Very high | 117 Ų | 117 | 97.8 Ų | 97.8 | 61% | 0.613 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -61.5 | -39.1 | 176.1 | -75.8 | 170.5 | 0 | 0 | 0 | 111.6 | Q9 C10 E11 L16 K17 | Q9-L13 WeakPolarHBondContact O-CB 3.49Å; Q9-L13 VanDerWaalsContact O-CG 3.29Å; Q9-L13 WeakPolarHBondContact O-CG 3.43Å; Q9-L13 PolarHBondContact O-N 3.19Å; C10-L13 PolarHBondContact O-N 3.42Å; E11-L13 PolarHBondContact O-N 3.15Å; L13-L16 PolarHBondContact O-N 3.47Å; L13-K17 VanDerWaalsContact O-CB 3.29Å; L13-K17 WeakPolarHBondContact O-CB 3.5Å; L13-K17 PolarHBondContact O-N 3.49Å |
| 14 | S | 97.3 | Very high | 96.2 | Very high | 80 Ų | 80 | 97.9 Ų | 97.9 | 56% | 0.559 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -67.6 | -38.2 | 178 | -158.6 | 0 | 0 | 0 | 0 | 112.1 | C10 E11 L12 G18 | C10-S14 WeakPolarHBondContact O-CB 2.83Å; C10-S14 PolarHBondContact O-N 3.04Å; E11-S14 PolarHBondContact O-N 3.49Å; L12-S14 VanDerWaalsContact C-N 3.29Å; L12-S14 PolarHBondContact O-N 2.99Å; S14-G18 PolarHBondContact O-N 3.12Å |
| 15 | Q | 97.8 | Very high | 96.7 | Very high | 133 Ų | 133 | 99.9 Ų | 99.9 | 62% | 0.621 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -65.3 | -46.5 | 173.7 | -72.3 | 177.3 | 12.8 | 0 | 0 | 111.6 | E11 L12 K17 G18 N19 | E11-Q15 WeakPolarHBondContact O-CG 3.39Å; E11-Q15 PolarHBondContact O-N 3.22Å; L12-Q15 PolarHBondContact O-N 3.29Å; Q15-K17 VanDerWaalsContact C-N 3.31Å; Q15-K17 PolarHBondContact O-N 3.41Å; Q15-G18 PolarHBondContact O-N 3.35Å; Q15-N19 PolarHBondContact O-N 2.93Å |
| 16 | L | 98.1 | Very high | 97.1 | Very high | 101 Ų | 101 | 98 Ų | 98 | 53% | 0.529 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -61.2 | -43.1 | 178.3 | -163.3 | 86.2 | 0 | 0 | 0 | 111.1 | L12 L13 N19 L20 | L12-L16 PolarHBondContact O-N 2.91Å; L13-L16 PolarHBondContact O-N 3.47Å; L16-N19 PolarHBondContact O-N 2.99Å; L16-L20 WeakPolarHBondContact O-CG 3.35Å; L16-L20 PolarHBondContact O-N 2.91Å |
| 17 | K | 97.6 | Very high | 97.3 | Very high | 124 Ų | 124 | 97.5 Ų | 97.5 | 54% | 0.539 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -59.6 | -48 | 174.5 | 178.7 | -179.7 | 169.4 | -179 | 0 | 111.4 | L13 Q15 N19 L20 E21 | L13-K17 VanDerWaalsContact O-CB 3.29Å; L13-K17 WeakPolarHBondContact O-CB 3.5Å; L13-K17 PolarHBondContact O-N 3.49Å; Q15-K17 VanDerWaalsContact C-N 3.31Å; Q15-K17 PolarHBondContact O-N 3.41Å; K17-N19 VanDerWaalsContact C-N 3.3Å; K17-N19 PolarHBondContact O-N 3.45Å; K17-L20 PolarHBondContact O-N 2.99Å; K17-E21 WeakPolarHBondContact CE-OE1 3.29Å; K17-E21 HydrophobicContact CG-CG 4.47Å; K17-E21 IonicContact NZ-OE1 3.8Å; K17-E21 WeakPolarHBondContact O-CB 3.29Å; K17-E21 WeakPolarHBondContact O-CG 3.42Å; K17-E21 PolarHBondContact O-N 3.15Å |
| 18 | G | 98.3 | Very high | 97.6 | Very high | 31 Ų | 31 | 98.1 Ų | 98.1 | 32% | 0.32 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -59.3 | -41.3 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | S14 Q15 E21 E22 | S14-G18 PolarHBondContact O-N 3.12Å; Q15-G18 PolarHBondContact O-N 3.35Å; G18-E21 PolarHBondContact O-N 3.43Å; G18-E22 PolarHBondContact O-N 3.16Å |
| 19 | N | 98.2 | Very high | 97.8 | Very high | 84 Ų | 84 | 98.3 Ų | 98.3 | 45% | 0.449 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -63.2 | -47.7 | 176.3 | -170.5 | 15.9 | 0 | 0 | 0 | 111.7 | Q15 L16 K17 E21 E22 E23 | Q15-N19 PolarHBondContact O-N 2.93Å; L16-N19 PolarHBondContact O-N 2.99Å; K17-N19 VanDerWaalsContact C-N 3.3Å; K17-N19 PolarHBondContact O-N 3.45Å; N19-E21 VanDerWaalsContact C-N 3.3Å; N19-E21 PolarHBondContact O-N 2.93Å; N19-E22 PolarHBondContact O-N 3Å; N19-E22 VanDerWaalsContact O-N 3.15Å; N19-E23 PolarHBondContact O-N 3.33Å |
| 20 | L | 98.2 | Very high | 97.9 | Very high | 102 Ų | 102 | 99 Ų | 99 | 53% | 0.534 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -61.7 | -38.2 | 176.4 | -70.2 | 172.8 | 0 | 0 | 0 | 112.3 | L16 K17 E22 N24 | L16-L20 WeakPolarHBondContact O-CG 3.35Å; L16-L20 PolarHBondContact O-N 2.91Å; K17-L20 PolarHBondContact O-N 2.99Å; L20-E22 VanDerWaalsContact C-N 3.33Å; L20-N24 WeakPolarHBondContact O-CB 3.45Å; L20-N24 PolarHBondContact O-N 3.37Å |
| 21 | E | 97.9 | Very high | 98.1 | Very high | 92 Ų | 92 | 100.2 Ų | 100.2 | 43% | 0.43 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -65.7 | -36.7 | 175.7 | -75 | 176.2 | 176.3 | 0 | 0 | 112 | K17 G18 N19 R25 | K17-E21 WeakPolarHBondContact CE-OE1 3.29Å; K17-E21 HydrophobicContact CG-CG 4.47Å; K17-E21 IonicContact NZ-OE1 3.8Å; K17-E21 WeakPolarHBondContact O-CB 3.29Å; K17-E21 WeakPolarHBondContact O-CG 3.42Å; K17-E21 PolarHBondContact O-N 3.15Å; G18-E21 PolarHBondContact O-N 3.43Å; N19-E21 VanDerWaalsContact C-N 3.3Å; N19-E21 PolarHBondContact O-N 2.93Å; E21-R25 WeakPolarHBondContact O-CG 3.32Å; E21-R25 PolarHBondContact O-N 2.94Å |
| 22 | E | 98.2 | Very high | 98.2 | Very high | 91 Ų | 91 | 101.7 Ų | 101.7 | 43% | 0.425 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -70.7 | -46.3 | 176.7 | -175.4 | 158.1 | -134.6 | 0 | 0 | 112.5 | G18 N19 L20 N24 R25 H26 | G18-E22 PolarHBondContact O-N 3.16Å; N19-E22 PolarHBondContact O-N 3Å; N19-E22 VanDerWaalsContact O-N 3.15Å; L20-E22 VanDerWaalsContact C-N 3.33Å; E22-N24 VanDerWaalsContact C-N 3.27Å; E22-N24 PolarHBondContact O-N 3Å; E22-R25 WeakPolarHBondContact O-CB 3.2Å; E22-R25 PolarHBondContact O-N 3.46Å; E22-R25 VanDerWaalsContact O-N 3.16Å; E22-R25 IonicContact OE1-NH2 3.92Å; E22-H26 PolarHBondContact O-CD2 2.93Å; E22-H26 VanDerWaalsContact O-CD2 3.22Å; E22-H26 PolarHBondContact O-N 3.37Å |
| 23 | E | 97.6 | Very high | 98.2 | Very high | 105 Ų | 105 | 99.9 Ų | 99.9 | 49% | 0.491 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -59.5 | -40.2 | 173.2 | -69.7 | -168.4 | 138.4 | 0 | 0 | 111.4 | N19 H26 L27 | N19-E23 PolarHBondContact O-N 3.33Å; E23-H26 PolarHBondContact O-N 2.95Å; E23-L27 VanDerWaalsContact O-CG 3.32Å; E23-L27 WeakPolarHBondContact O-CG 3.37Å; E23-L27 PolarHBondContact O-N 3.45Å |
| 24 | N | 97.9 | Very high | 98.3 | Very high | 92 Ų | 92 | 98.8 Ų | 98.8 | 49% | 0.492 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -62.5 | -43.4 | 175.4 | -167.5 | -9.7 | 0 | 0 | 0 | 111.6 | L20 E22 H26 L27 L28 | L20-N24 WeakPolarHBondContact O-CB 3.45Å; L20-N24 PolarHBondContact O-N 3.37Å; E22-N24 VanDerWaalsContact C-N 3.27Å; E22-N24 PolarHBondContact O-N 3Å; N24-H26 VanDerWaalsContact C-N 3.35Å; N24-H26 PolarHBondContact O-N 3.36Å; N24-L27 PolarHBondContact O-N 3.22Å; N24-L28 WeakPolarHBondContact O-CG 3.33Å; N24-L28 PolarHBondContact O-N 3.24Å |
| 25 | R | 98.6 | Very high | 98.3 | Very high | 131 Ų | 131 | 100.8 Ų | 100.8 | 49% | 0.494 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -58 | -46.2 | 172.3 | -74.4 | -168.9 | -58 | -96.4 | 2.5 | 111.8 | E21 E22 L27 L28 D29 | E21-R25 WeakPolarHBondContact O-CG 3.32Å; E21-R25 PolarHBondContact O-N 2.94Å; E22-R25 WeakPolarHBondContact O-CB 3.2Å; E22-R25 PolarHBondContact O-N 3.46Å; E22-R25 VanDerWaalsContact O-N 3.16Å; E22-R25 IonicContact OE1-NH2 3.92Å; R25-L27 PolarHBondContact O-N 2.89Å; R25-L28 PolarHBondContact O-N 2.97Å; R25-D29 PolarHBondContact O-N 3.48Å |
| 26 | H | 98.7 | Very high | 98.3 | Very high | 102 Ų | 102 | 99.7 Ų | 99.7 | 47% | 0.472 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -63 | -40.6 | 178.7 | -71.9 | -48.1 | 0 | 0 | 0 | 113.1 | E22 E23 N24 L28 D29 Q30 | E22-H26 PolarHBondContact O-CD2 2.93Å; E22-H26 VanDerWaalsContact O-CD2 3.22Å; E22-H26 PolarHBondContact O-N 3.37Å; E23-H26 PolarHBondContact O-N 2.95Å; N24-H26 VanDerWaalsContact C-N 3.35Å; N24-H26 PolarHBondContact O-N 3.36Å; H26-L28 VanDerWaalsContact C-N 3.33Å; H26-D29 PolarHBondContact O-N 3.39Å; H26-Q30 WeakPolarHBondContact O-CG 3.47Å; H26-Q30 PolarHBondContact O-N 3.35Å |
| 27 | L | 98.7 | Very high | 98.4 | Very high | 99 Ų | 99 | 99.9 Ų | 99.9 | 52% | 0.518 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -63.4 | -40.8 | 175.5 | -71.6 | 172 | 0 | 0 | 0 | 111.4 | E23 N24 R25 Q30 I31 | E23-L27 VanDerWaalsContact O-CG 3.32Å; E23-L27 WeakPolarHBondContact O-CG 3.37Å; E23-L27 PolarHBondContact O-N 3.45Å; N24-L27 PolarHBondContact O-N 3.22Å; R25-L27 PolarHBondContact O-N 2.89Å; L27-Q30 PolarHBondContact O-N 2.98Å; L27-I31 VanDerWaalsContact O-CG1 3.27Å; L27-I31 WeakPolarHBondContact O-CG1 3.42Å; L27-I31 PolarHBondContact O-N 3.47Å |
| 28 | L | 98.6 | Very high | 98.4 | Very high | 99 Ų | 99 | 99 Ų | 99 | 52% | 0.518 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -63.5 | -42.4 | 175.6 | -70.5 | 171.8 | 0 | 0 | 0 | 112.1 | N24 R25 H26 Q30 I31 Q32 | N24-L28 WeakPolarHBondContact O-CG 3.33Å; N24-L28 PolarHBondContact O-N 3.24Å; R25-L28 PolarHBondContact O-N 2.97Å; H26-L28 VanDerWaalsContact C-N 3.33Å; L28-Q30 VanDerWaalsContact C-N 3.34Å; L28-Q30 PolarHBondContact O-N 3.32Å; L28-I31 PolarHBondContact O-N 2.9Å; L28-Q32 PolarHBondContact O-N 3.3Å |
| 29 | D | 98.6 | Very high | 98.4 | Very high | 91 Ų | 91 | 105.2 Ų | 105.2 | 49% | 0.487 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -63.3 | -39.4 | 175.8 | -76.3 | -8.2 | 0 | 0 | 0 | 111.9 | R25 H26 Q32 T33 | R25-D29 PolarHBondContact O-N 3.48Å; H26-D29 PolarHBondContact O-N 3.39Å; D29-Q32 PolarHBondContact O-N 2.91Å; D29-T33 WeakPolarHBondContact O-CB 3.49Å; D29-T33 PolarHBondContact O-N 2.98Å; D29-T33 PolarHBondContact O-OG1 2.87Å |
| 30 | Q | 98.7 | Very high | 98.4 | Very high | 120 Ų | 120 | 104 Ų | 104 | 56% | 0.561 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -64.4 | -43.5 | 174.3 | -73.5 | 179.1 | 11.4 | 0 | 0 | 111.7 | H26 L27 L28 Q32 T33 L34 | H26-Q30 WeakPolarHBondContact O-CG 3.47Å; H26-Q30 PolarHBondContact O-N 3.35Å; L27-Q30 PolarHBondContact O-N 2.98Å; L28-Q30 VanDerWaalsContact C-N 3.34Å; L28-Q30 PolarHBondContact O-N 3.32Å; Q30-Q32 VanDerWaalsContact C-N 3.33Å; Q30-Q32 PolarHBondContact O-N 2.93Å; Q30-T33 PolarHBondContact O-N 3.45Å; Q30-L34 WeakPolarHBondContact O-CB 3.41Å; Q30-L34 WeakPolarHBondContact O-CG 3.41Å; Q30-L34 PolarHBondContact O-N 3.26Å |
| 31 | I | 98.4 | Very high | 98.4 | Very high | 97 Ų | 97 | 104.1 Ų | 104.1 | 50% | 0.497 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -60.4 | -45.1 | 175.5 | -70.8 | 164.6 | 0 | 0 | 0 | 110.3 | L27 L28 T33 L34 M35 | L27-I31 VanDerWaalsContact O-CG1 3.27Å; L27-I31 WeakPolarHBondContact O-CG1 3.42Å; L27-I31 PolarHBondContact O-N 3.47Å; L28-I31 PolarHBondContact O-N 2.9Å; I31-T33 VanDerWaalsContact C-N 3.34Å; I31-T33 PolarHBondContact O-N 3.24Å; I31-L34 PolarHBondContact O-N 2.84Å; I31-M35 WeakPolarHBondContact O-CB 3.34Å; I31-M35 PolarHBondContact O-N 2.95Å |
| 32 | Q | 98.6 | Very high | 98.5 | Very high | 131 Ų | 131 | 104.8 Ų | 104.8 | 61% | 0.612 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -62.9 | -42.7 | 178.3 | -173.2 | 176.4 | 59.4 | 0 | 0 | 111.5 | L28 D29 Q30 M35 L36 | L28-Q32 PolarHBondContact O-N 3.3Å; D29-Q32 PolarHBondContact O-N 2.91Å; Q30-Q32 VanDerWaalsContact C-N 3.33Å; Q30-Q32 PolarHBondContact O-N 2.93Å; Q32-M35 WeakPolarHBondContact O-CB 3.35Å; Q32-M35 PolarHBondContact O-N 2.87Å; Q32-L36 PolarHBondContact O-N 3.33Å |
| 33 | T | 98.7 | Very high | 98.5 | Very high | 75 Ų | 75 | 105.1 Ų | 105.1 | 46% | 0.46 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -62.6 | -45.9 | 176.5 | -58.6 | 0 | 0 | 0 | 0 | 111.4 | D29 Q30 I31 M35 L36 Q37 | D29-T33 WeakPolarHBondContact O-CB 3.49Å; D29-T33 PolarHBondContact O-N 2.98Å; D29-T33 PolarHBondContact O-OG1 2.87Å; Q30-T33 PolarHBondContact O-N 3.45Å; I31-T33 VanDerWaalsContact C-N 3.34Å; I31-T33 PolarHBondContact O-N 3.24Å; T33-M35 VanDerWaalsContact C-N 3.33Å; T33-M35 PolarHBondContact O-N 2.98Å; T33-L36 PolarHBondContact O-N 3.47Å; T33-Q37 WeakPolarHBondContact O-CG 3.32Å; T33-Q37 PolarHBondContact O-N 2.86Å |
| 34 | L | 98.8 | Very high | 98.5 | Very high | 94 Ų | 94 | 105.4 Ų | 105.4 | 49% | 0.492 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -63.6 | -38.1 | 176.3 | -78.6 | 168.8 | 0 | 0 | 0 | 112.3 | Q30 I31 L36 Q37 N38 | Q30-L34 WeakPolarHBondContact O-CB 3.41Å; Q30-L34 WeakPolarHBondContact O-CG 3.41Å; Q30-L34 PolarHBondContact O-N 3.26Å; I31-L34 PolarHBondContact O-N 2.84Å; L34-L36 VanDerWaalsContact C-N 3.34Å; L34-Q37 PolarHBondContact O-N 3.36Å; L34-N38 WeakPolarHBondContact O-CB 3.45Å; L34-N38 PolarHBondContact O-N 3.1Å; L34-N38 PolarHBondContact O-ND2 3.3Å |
| 35 | M | 98.3 | Very high | 98.5 | Very high | 123 Ų | 123 | 104.7 Ų | 104.7 | 61% | 0.606 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -62.6 | -43.9 | 175.4 | -171.3 | -163.1 | -50.2 | 0 | 0 | 110.8 | I31 Q32 T33 N38 R39 | I31-M35 WeakPolarHBondContact O-CB 3.34Å; I31-M35 PolarHBondContact O-N 2.95Å; Q32-M35 WeakPolarHBondContact O-CB 3.35Å; Q32-M35 PolarHBondContact O-N 2.87Å; T33-M35 VanDerWaalsContact C-N 3.33Å; T33-M35 PolarHBondContact O-N 2.98Å; M35-N38 PolarHBondContact O-N 3.4Å; M35-R39 PolarHBondContact O-N 3.26Å |
| 36 | L | 98.7 | Very high | 98.4 | Very high | 109 Ų | 109 | 100.8 Ų | 100.8 | 57% | 0.571 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -63.7 | -45.1 | 176.4 | -177 | 62.9 | 0 | 0 | 0 | 111.4 | Q32 T33 L34 N38 R39 T40 | Q32-L36 PolarHBondContact O-N 3.33Å; T33-L36 PolarHBondContact O-N 3.47Å; L34-L36 VanDerWaalsContact C-N 3.34Å; L36-N38 PolarHBondContact O-N 3.46Å; L36-R39 WeakPolarHBondContact O-CB 3.44Å; L36-R39 PolarHBondContact O-N 2.92Å; L36-T40 PolarHBondContact O-N 3.37Å; L36-T40 PolarHBondContact O-OG1 3.19Å; L36-T40 VanDerWaalsContact O-OG1 3.1Å |
| 37 | Q | 98.6 | Very high | 98.4 | Very high | 106 Ų | 106 | 102 Ų | 102 | 50% | 0.495 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -59.5 | -45.2 | 176.1 | -73.6 | 177.1 | -17.8 | 0 | 0 | 112 | T33 L34 R39 T40 L41 | T33-Q37 WeakPolarHBondContact O-CG 3.32Å; T33-Q37 PolarHBondContact O-N 2.86Å; L34-Q37 PolarHBondContact O-N 3.36Å; Q37-R39 VanDerWaalsContact C-N 3.32Å; Q37-R39 PolarHBondContact O-N 2.91Å; Q37-T40 PolarHBondContact O-N 2.96Å; Q37-L41 WeakPolarHBondContact O-CB 3.27Å; Q37-L41 WeakPolarHBondContact O-CG 3.37Å; Q37-L41 PolarHBondContact O-N 3.48Å |
| 38 | N | 98.2 | Very high | 98.3 | Very high | 105 Ų | 105 | 101.1 Ų | 101.1 | 56% | 0.561 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -61.3 | -41.1 | 176.6 | -85.9 | -66.9 | 0 | 0 | 0 | 112.1 | L34 M35 L36 L41 L42 | L34-N38 WeakPolarHBondContact O-CB 3.45Å; L34-N38 PolarHBondContact O-N 3.1Å; L34-N38 PolarHBondContact O-ND2 3.3Å; M35-N38 PolarHBondContact O-N 3.4Å; L36-N38 PolarHBondContact O-N 3.46Å; N38-L41 PolarHBondContact O-N 3.33Å; N38-L42 WeakPolarHBondContact O-CB 3.45Å; N38-L42 PolarHBondContact O-N 3.3Å |
| 39 | R | 98.3 | Very high | 98.3 | Very high | 162 Ų | 162 | 101.4 Ų | 101.4 | 61% | 0.611 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -60.4 | -50.8 | 174.9 | 177.5 | -178.9 | 170.9 | 173.4 | -0.4 | 111.3 | M35 L36 Q37 L41 L42 E43 | M35-R39 PolarHBondContact O-N 3.26Å; L36-R39 WeakPolarHBondContact O-CB 3.44Å; L36-R39 PolarHBondContact O-N 2.92Å; Q37-R39 VanDerWaalsContact C-N 3.32Å; Q37-R39 PolarHBondContact O-N 2.91Å; R39-L41 VanDerWaalsContact C-N 3.33Å; R39-L41 PolarHBondContact O-N 3.41Å; R39-L42 WeakPolarHBondContact O-CB 3.45Å; R39-L42 PolarHBondContact O-N 2.93Å; R39-E43 WeakPolarHBondContact CG-OE1 3.36Å; R39-E43 IonicContact CZ-OE1 3.61Å; R39-E43 IonicContact NE-OE1 2.87Å; R39-E43 PolarHBondContact NE-OE1 2.9Å; R39-E43 IonicContact NH2-OE1 3.45Å; R39-E43 PolarHBondContact NH2-OE1 2.96Å; R39-E43 WeakPolarHBondContact O-CG 3.41Å; R39-E43 PolarHBondContact O-N 3.44Å |
| 40 | T | 98.4 | Very high | 98.3 | Very high | 58 Ų | 58 | 101.3 Ų | 101.3 | 36% | 0.356 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -61.6 | -41.5 | -180 | -55.7 | 0 | 0 | 0 | 0 | 111.8 | L36 Q37 L42 E43 Q44 | L36-T40 PolarHBondContact O-N 3.37Å; L36-T40 PolarHBondContact O-OG1 3.19Å; L36-T40 VanDerWaalsContact O-OG1 3.1Å; Q37-T40 PolarHBondContact O-N 2.96Å; T40-L42 VanDerWaalsContact C-N 3.32Å; T40-L42 PolarHBondContact O-N 3.18Å; T40-E43 PolarHBondContact O-N 3.23Å; T40-Q44 WeakPolarHBondContact O-CG 3.39Å; T40-Q44 PolarHBondContact O-N 2.94Å |
| 41 | L | 98.6 | Very high | 98.2 | Very high | 105 Ų | 105 | 101 Ų | 101 | 55% | 0.55 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -62.8 | -39.8 | 176.2 | -75.6 | 171.7 | 0 | 0 | 0 | 112 | Q37 N38 R39 N45 | Q37-L41 WeakPolarHBondContact O-CB 3.27Å; Q37-L41 WeakPolarHBondContact O-CG 3.37Å; Q37-L41 PolarHBondContact O-N 3.48Å; N38-L41 PolarHBondContact O-N 3.33Å; R39-L41 VanDerWaalsContact C-N 3.33Å; R39-L41 PolarHBondContact O-N 3.41Å; L41-N45 WeakPolarHBondContact O-CB 3.27Å; L41-N45 PolarHBondContact O-N 2.95Å |
| 42 | L | 98.4 | Very high | 98.2 | Very high | 106 Ų | 106 | 101.3 Ų | 101.3 | 56% | 0.555 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -64.7 | -43.9 | 175.9 | -176.1 | 64.3 | 0 | 0 | 0 | 111.2 | N38 R39 T40 N45 M46 | N38-L42 WeakPolarHBondContact O-CB 3.45Å; N38-L42 PolarHBondContact O-N 3.3Å; R39-L42 WeakPolarHBondContact O-CB 3.45Å; R39-L42 PolarHBondContact O-N 2.93Å; T40-L42 VanDerWaalsContact C-N 3.32Å; T40-L42 PolarHBondContact O-N 3.18Å; L42-N45 WeakPolarHBondContact O-CB 3.47Å; L42-N45 PolarHBondContact O-N 3.42Å; L42-M46 WeakPolarHBondContact O-CG 3.26Å; L42-M46 PolarHBondContact O-N 3.32Å |
| 43 | E | 98.1 | Very high | 98.2 | Very high | 98 Ų | 98 | 99 Ų | 99 | 46% | 0.458 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -58.9 | -49.5 | 175.7 | -73 | 172.5 | -172.7 | 0 | 0 | 111 | R39 T40 N45 M46 E47 | R39-E43 WeakPolarHBondContact CG-OE1 3.36Å; R39-E43 IonicContact CZ-OE1 3.61Å; R39-E43 IonicContact NE-OE1 2.87Å; R39-E43 PolarHBondContact NE-OE1 2.9Å; R39-E43 IonicContact NH2-OE1 3.45Å; R39-E43 PolarHBondContact NH2-OE1 2.96Å; R39-E43 WeakPolarHBondContact O-CG 3.41Å; R39-E43 PolarHBondContact O-N 3.44Å; T40-E43 PolarHBondContact O-N 3.23Å; E43-N45 VanDerWaalsContact C-N 3.3Å; E43-N45 PolarHBondContact O-N 2.92Å; E43-M46 PolarHBondContact O-N 3.46Å; E43-E47 PolarHBondContact O-N 2.98Å |
| 44 | Q | 98.4 | Very high | 98.2 | Very high | 110 Ų | 110 | 98.5 Ų | 98.5 | 51% | 0.514 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -59.3 | -38.3 | 175.5 | -72.8 | 179.8 | -15.7 | 0 | 0 | 112.8 | T40 S48 | T40-Q44 WeakPolarHBondContact O-CG 3.39Å; T40-Q44 PolarHBondContact O-N 2.94Å; Q44-S48 VanDerWaalsContact O-CB 3.28Å; Q44-S48 WeakPolarHBondContact O-CB 3.12Å; Q44-S48 PolarHBondContact O-N 2.83Å |
| 45 | N | 98.1 | Very high | 98.1 | Very high | 77 Ų | 77 | 97.9 Ų | 97.9 | 41% | 0.412 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -65.6 | -40 | 178.4 | -170.6 | -100.1 | 0 | 0 | 0 | 112.1 | L41 L42 E43 K49 | L41-N45 WeakPolarHBondContact O-CB 3.27Å; L41-N45 PolarHBondContact O-N 2.95Å; L42-N45 WeakPolarHBondContact O-CB 3.47Å; L42-N45 PolarHBondContact O-N 3.42Å; E43-N45 VanDerWaalsContact C-N 3.3Å; E43-N45 PolarHBondContact O-N 2.92Å; N45-K49 WeakPolarHBondContact O-CG 3.28Å; N45-K49 PolarHBondContact O-N 2.99Å; N45-K49 VanDerWaalsContact O-N 3.13Å; N45-K49 VanDerWaalsContact OD1-CE 3.27Å; N45-K49 WeakPolarHBondContact OD1-CE 3.18Å; N45-K49 PolarHBondContact OD1-NZ 3.48Å |
| 46 | M | 97 | Very high | 98.1 | Very high | 50 Ų | 50 | 95.9 Ų | 95.9 | 25% | 0.246 | 48% | 0.476 | C | S | . | . | H | α-helix | trans | -69.6 | -43.9 | 177.8 | -68.3 | -57.2 | -56 | 0 | 0 | 111.3 | L42 E43 S48 K49 D50 M192 | L42-M46 WeakPolarHBondContact O-CG 3.26Å; L42-M46 PolarHBondContact O-N 3.32Å; E43-M46 PolarHBondContact O-N 3.46Å; M46-S48 PolarHBondContact O-N 2.88Å; M46-K49 PolarHBondContact O-N 2.94Å; M46-D50 PolarHBondContact O-N 3.29Å; M46-M192 HydrophobicContact CE-CE 3.4Å; M46-M192 HydrophobicContact CE-SD 3.88Å; M46-M192 HydrophobicContact CG-CE 3.7Å; M46-M192 HydrophobicContact CG-SD 4.08Å; M46-M192 HydrophobicContact SD-CE 3.5Å; M46-M192 VanDerWaalsContact SD-CE 3.5Å; M46-M192 HydrophobicContact SD-SD 4.44Å |
| 47 | E | 97.6 | Very high | 98.1 | Very high | 128 Ų | 128 | 97.3 Ų | 97.3 | 60% | 0.598 | 47% | 0.474 | S | S | * | . | H | α-helix | trans | -61.4 | -43.8 | 176.2 | -174.3 | 173.5 | -158.5 | 0 | 0 | 111.7 | E43 K49 D50 L51 | E43-E47 PolarHBondContact O-N 2.98Å; E47-K49 VanDerWaalsContact C-N 3.33Å; E47-K49 PolarHBondContact O-N 3.36Å; E47-D50 PolarHBondContact O-N 2.92Å; E47-L51 HydrophobicContact CG-CD1 4.19Å; E47-L51 WeakPolarHBondContact O-CD1 3.32Å; E47-L51 PolarHBondContact O-N 3.24Å |
| 48 | S | 97.6 | Very high | 98.1 | Very high | 80 Ų | 80 | 98 Ų | 98 | 56% | 0.559 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -60.3 | -41.3 | 175.9 | 179.9 | 0 | 0 | 0 | 0 | 112.3 | Q44 M46 L51 F52 | Q44-S48 VanDerWaalsContact O-CB 3.28Å; Q44-S48 WeakPolarHBondContact O-CB 3.12Å; Q44-S48 PolarHBondContact O-N 2.83Å; M46-S48 PolarHBondContact O-N 2.88Å; S48-L51 PolarHBondContact O-N 2.83Å; S48-F52 PolarHBondContact O-N 3.31Å |
| 49 | K | 98.3 | Very high | 98.1 | Very high | 104 Ų | 104 | 99 Ų | 99 | 45% | 0.452 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -65.4 | -41.6 | 174.7 | -78 | 170.7 | 175.4 | 158.6 | 0 | 112.1 | N45 M46 E47 F52 H53 | N45-K49 WeakPolarHBondContact O-CG 3.28Å; N45-K49 PolarHBondContact O-N 2.99Å; N45-K49 VanDerWaalsContact O-N 3.13Å; N45-K49 VanDerWaalsContact OD1-CE 3.27Å; N45-K49 WeakPolarHBondContact OD1-CE 3.18Å; N45-K49 PolarHBondContact OD1-NZ 3.48Å; M46-K49 PolarHBondContact O-N 2.94Å; E47-K49 VanDerWaalsContact C-N 3.33Å; E47-K49 PolarHBondContact O-N 3.36Å; K49-F52 WeakPolarHBondContact O-CB 3.46Å; K49-F52 PolarHBondContact O-N 2.88Å; K49-H53 PolarHBondContact O-CD2 3.29Å; K49-H53 PolarHBondContact O-N 3.2Å |
| 50 | D | 97.6 | Very high | 98.1 | Very high | 90 Ų | 90 | 95.4 Ų | 95.4 | 48% | 0.481 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -64 | -42.1 | 178.3 | -76.7 | -16.9 | 0 | 0 | 0 | 111.4 | M46 E47 F52 H53 V54 | M46-D50 PolarHBondContact O-N 3.29Å; E47-D50 PolarHBondContact O-N 2.92Å; D50-F52 PolarHBondContact O-N 2.81Å; D50-H53 PolarHBondContact O-N 3.45Å; D50-V54 WeakPolarHBondContact O-CG2 3.45Å; D50-V54 PolarHBondContact O-N 3.49Å |
| 51 | L | 98.1 | Very high | 98.1 | Very high | 114 Ų | 114 | 97.5 Ų | 97.5 | 60% | 0.597 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -57.8 | -48.2 | 172.1 | -101.5 | 69.9 | 0 | 0 | 0 | 111.6 | E47 S48 H53 V54 E55 | E47-L51 HydrophobicContact CG-CD1 4.19Å; E47-L51 WeakPolarHBondContact O-CD1 3.32Å; E47-L51 PolarHBondContact O-N 3.24Å; S48-L51 PolarHBondContact O-N 2.83Å; L51-H53 VanDerWaalsContact C-N 3.27Å; L51-H53 PolarHBondContact O-N 3.49Å; L51-V54 PolarHBondContact O-N 3.2Å; L51-V54 VanDerWaalsContact O-N 3.14Å; L51-E55 WeakPolarHBondContact O-CB 3.28Å; L51-E55 PolarHBondContact O-N 3.05Å |
| 52 | F | 98.3 | Very high | 98.1 | Very high | 103 Ų | 103 | 98.8 Ų | 98.8 | 45% | 0.452 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -57.9 | -40.1 | 176.9 | 176.5 | -99.5 | 0 | 0 | 0 | 112 | S48 K49 D50 E55 Q56 | S48-F52 PolarHBondContact O-N 3.31Å; K49-F52 WeakPolarHBondContact O-CB 3.46Å; K49-F52 PolarHBondContact O-N 2.88Å; D50-F52 PolarHBondContact O-N 2.81Å; F52-E55 PolarHBondContact O-N 3.24Å; F52-Q56 HydrophobicContact CD1-CG 4.17Å; F52-Q56 HydrophobicContact CE1-CG 3.76Å; F52-Q56 HydrophobicContact CE2-CG 4.13Å; F52-Q56 HydrophobicContact CZ-CG 3.75Å; F52-Q56 VanDerWaalsContact CZ-NE2 3.32Å; F52-Q56 WeakPolarHBondContact O-CB 3.4Å; F52-Q56 VanDerWaalsContact O-CG 3.25Å; F52-Q56 WeakPolarHBondContact O-CG 3.37Å; F52-Q56 PolarHBondContact O-N 3.44Å |
| 53 | H | 98 | Very high | 98.1 | Very high | 81 Ų | 81 | 98.2 Ų | 98.2 | 38% | 0.375 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -69.8 | -36 | 177.1 | -72.3 | -51.6 | 0 | 0 | 0 | 113.4 | K49 D50 L51 R57 | K49-H53 PolarHBondContact O-CD2 3.29Å; K49-H53 PolarHBondContact O-N 3.2Å; D50-H53 PolarHBondContact O-N 3.45Å; L51-H53 VanDerWaalsContact C-N 3.27Å; L51-H53 PolarHBondContact O-N 3.49Å; H53-R57 WeakPolarHBondContact O-CG 3.5Å; H53-R57 PolarHBondContact O-N 2.92Å; H53-R57 VanDerWaalsContact O-N 3.15Å; H53-R57 PolarHBondContact O-NE 2.92Å; H53-R57 VanDerWaalsContact O-NE 3.11Å |
| 54 | V | 98.3 | Very high | 98.1 | Very high | 65 Ų | 65 | 96.9 Ų | 96.9 | 39% | 0.394 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -63.2 | -47.2 | 171.2 | 172.1 | 0 | 0 | 0 | 0 | 110.3 | D50 L51 Q56 R57 Q58 | D50-V54 WeakPolarHBondContact O-CG2 3.45Å; D50-V54 PolarHBondContact O-N 3.49Å; L51-V54 PolarHBondContact O-N 3.2Å; L51-V54 VanDerWaalsContact O-N 3.14Å; V54-Q56 PolarHBondContact O-N 2.92Å; V54-R57 WeakPolarHBondContact O-CB 3.16Å; V54-R57 PolarHBondContact O-N 3.23Å; V54-R57 VanDerWaalsContact O-N 3.14Å; V54-Q58 WeakPolarHBondContact O-CG 3.44Å; V54-Q58 PolarHBondContact O-N 3.46Å |
| 55 | E | 97.9 | Very high | 98.1 | Very high | 82 Ų | 82 | 94.9 Ų | 94.9 | 38% | 0.383 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -62.5 | -45.1 | -179.4 | -158 | -166 | -175.7 | 0 | 0 | 111.9 | L51 F52 R57 Q58 Y59 | L51-E55 WeakPolarHBondContact O-CB 3.28Å; L51-E55 PolarHBondContact O-N 3.05Å; F52-E55 PolarHBondContact O-N 3.24Å; E55-R57 VanDerWaalsContact C-N 3.28Å; E55-R57 PolarHBondContact O-N 3.49Å; E55-Q58 WeakPolarHBondContact O-CB 3.4Å; E55-Q58 PolarHBondContact O-N 3.05Å; E55-Q58 VanDerWaalsContact O-N 3.07Å; E55-Y59 HydrophobicContact CB-CE2 4.45Å; E55-Y59 HydrophobicContact CG-CD2 4.19Å; E55-Y59 HydrophobicContact CG-CE2 3.49Å; E55-Y59 VanDerWaalsContact CG-CE2 3.49Å; E55-Y59 VanDerWaalsContact O-CD2 3.22Å; E55-Y59 WeakPolarHBondContact O-CD2 3.38Å; E55-Y59 PolarHBondContact O-N 3.4Å; E55-Y59 WeakPolarHBondContact OE1-CE2 3.27Å; E55-Y59 PolarHBondContact OE1-OH 3.43Å |
| 56 | Q | 98.3 | Very high | 98.2 | Very high | 81 Ų | 81 | 95.2 Ų | 95.2 | 38% | 0.379 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -56.4 | -41.6 | 173.2 | -77.3 | -70 | -17.2 | 0 | 0 | 112.5 | F52 V54 Y59 I60 | F52-Q56 HydrophobicContact CD1-CG 4.17Å; F52-Q56 HydrophobicContact CE1-CG 3.76Å; F52-Q56 HydrophobicContact CE2-CG 4.13Å; F52-Q56 HydrophobicContact CZ-CG 3.75Å; F52-Q56 VanDerWaalsContact CZ-NE2 3.32Å; F52-Q56 WeakPolarHBondContact O-CB 3.4Å; F52-Q56 VanDerWaalsContact O-CG 3.25Å; F52-Q56 WeakPolarHBondContact O-CG 3.37Å; F52-Q56 PolarHBondContact O-N 3.44Å; V54-Q56 PolarHBondContact O-N 2.92Å; Q56-Y59 PolarHBondContact O-N 3.13Å; Q56-I60 WeakPolarHBondContact O-CD1 3.41Å; Q56-I60 VanDerWaalsContact O-CG1 3.28Å; Q56-I60 WeakPolarHBondContact O-CG1 3.36Å; Q56-I60 PolarHBondContact O-N 3.15Å |
| 57 | R | 98.2 | Very high | 98.2 | Very high | 138 Ų | 138 | 100.3 Ų | 100.3 | 52% | 0.521 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -63.1 | -43.8 | 174.8 | -78.9 | 177.5 | -74.4 | -145 | 0.5 | 111.4 | H53 V54 E55 Y59 I60 D61 | H53-R57 WeakPolarHBondContact O-CG 3.5Å; H53-R57 PolarHBondContact O-N 2.92Å; H53-R57 VanDerWaalsContact O-N 3.15Å; H53-R57 PolarHBondContact O-NE 2.92Å; H53-R57 VanDerWaalsContact O-NE 3.11Å; V54-R57 WeakPolarHBondContact O-CB 3.16Å; V54-R57 PolarHBondContact O-N 3.23Å; V54-R57 VanDerWaalsContact O-N 3.14Å; E55-R57 VanDerWaalsContact C-N 3.28Å; E55-R57 PolarHBondContact O-N 3.49Å; R57-Y59 VanDerWaalsContact C-N 3.34Å; R57-Y59 PolarHBondContact O-N 2.93Å; R57-I60 WeakPolarHBondContact O-CB 3.36Å; R57-I60 PolarHBondContact O-N 2.93Å; R57-I60 VanDerWaalsContact O-N 3.15Å; R57-D61 PolarHBondContact O-N 3.11Å |
| 58 | Q | 98.5 | Very high | 98.3 | Very high | 120 Ų | 120 | 100.4 Ų | 100.4 | 56% | 0.561 | 47% | 0.472 | S | S | * | . | H | α-helix | trans | -59.6 | -42.6 | 176.3 | -67.9 | 179.6 | 13.9 | 0 | 0 | 112.3 | V54 E55 I60 D61 K62 | V54-Q58 WeakPolarHBondContact O-CG 3.44Å; V54-Q58 PolarHBondContact O-N 3.46Å; E55-Q58 WeakPolarHBondContact O-CB 3.4Å; E55-Q58 PolarHBondContact O-N 3.05Å; E55-Q58 VanDerWaalsContact O-N 3.07Å; Q58-I60 VanDerWaalsContact C-N 3.33Å; Q58-I60 PolarHBondContact O-N 2.86Å; Q58-D61 PolarHBondContact O-N 3.14Å; Q58-K62 WeakPolarHBondContact O-CB 3.49Å; Q58-K62 PolarHBondContact O-N 3.2Å |
| 59 | Y | 98.5 | Very high | 98.3 | Very high | 127 Ų | 127 | 100.7 Ų | 100.7 | 50% | 0.498 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -63.2 | -39.8 | 175.7 | -69.6 | -52.7 | 0 | 0 | 0 | 112.4 | E55 Q56 R57 K62 L63 | E55-Y59 HydrophobicContact CB-CE2 4.45Å; E55-Y59 HydrophobicContact CG-CD2 4.19Å; E55-Y59 HydrophobicContact CG-CE2 3.49Å; E55-Y59 VanDerWaalsContact CG-CE2 3.49Å; E55-Y59 VanDerWaalsContact O-CD2 3.22Å; E55-Y59 WeakPolarHBondContact O-CD2 3.38Å; E55-Y59 PolarHBondContact O-N 3.4Å; E55-Y59 WeakPolarHBondContact OE1-CE2 3.27Å; E55-Y59 PolarHBondContact OE1-OH 3.43Å; Q56-Y59 PolarHBondContact O-N 3.13Å; R57-Y59 VanDerWaalsContact C-N 3.34Å; R57-Y59 PolarHBondContact O-N 2.93Å; Y59-K62 PolarHBondContact O-N 3.5Å; Y59-L63 WeakPolarHBondContact O-CB 3.42Å; Y59-L63 VanDerWaalsContact O-CG 3.28Å; Y59-L63 WeakPolarHBondContact O-CG 3.47Å; Y59-L63 PolarHBondContact O-N 2.78Å |
| 60 | I | 98.3 | Very high | 98.3 | Very high | 86 Ų | 86 | 101.5 Ų | 101.5 | 44% | 0.441 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -62.9 | -45.3 | 175.3 | -69.3 | 164 | 0 | 0 | 0 | 110.7 | Q56 R57 Q58 K62 L63 N64 | Q56-I60 WeakPolarHBondContact O-CD1 3.41Å; Q56-I60 VanDerWaalsContact O-CG1 3.28Å; Q56-I60 WeakPolarHBondContact O-CG1 3.36Å; Q56-I60 PolarHBondContact O-N 3.15Å; R57-I60 WeakPolarHBondContact O-CB 3.36Å; R57-I60 PolarHBondContact O-N 2.93Å; R57-I60 VanDerWaalsContact O-N 3.15Å; Q58-I60 VanDerWaalsContact C-N 3.33Å; Q58-I60 PolarHBondContact O-N 2.86Å; I60-K62 VanDerWaalsContact C-N 3.35Å; I60-K62 PolarHBondContact O-N 3.41Å; I60-L63 PolarHBondContact O-N 2.87Å; I60-N64 WeakPolarHBondContact CG2-ND2 3.44Å; I60-N64 WeakPolarHBondContact O-CB 3.49Å; I60-N64 PolarHBondContact O-N 3.14Å; I60-N64 PolarHBondContact O-ND2 2.91Å |
| 61 | D | 98.4 | Very high | 98.3 | Very high | 103 Ų | 103 | 103.2 Ų | 103.2 | 55% | 0.551 | 47% | 0.474 | S | S | * | . | H | α-helix | trans | -63.9 | -41.4 | 178.9 | -68.2 | -22.1 | 0 | 0 | 0 | 111.3 | R57 Q58 L63 N64 E65 | R57-D61 PolarHBondContact O-N 3.11Å; Q58-D61 PolarHBondContact O-N 3.14Å; D61-L63 PolarHBondContact O-N 2.93Å; D61-N64 PolarHBondContact O-N 3.15Å; D61-E65 PolarHBondContact O-N 3.06Å |
| 62 | K | 98.6 | Very high | 98.3 | Very high | 132 Ų | 132 | 101.9 Ų | 101.9 | 57% | 0.574 | 46% | 0.463 | S | S | * | . | H | α-helix | trans | -61.5 | -44.6 | 174.2 | -174 | 63.7 | 177.3 | -173 | 0 | 112 | Q58 Y59 I60 N64 E65 L66 | Q58-K62 WeakPolarHBondContact O-CB 3.49Å; Q58-K62 PolarHBondContact O-N 3.2Å; Y59-K62 PolarHBondContact O-N 3.5Å; I60-K62 VanDerWaalsContact C-N 3.35Å; I60-K62 PolarHBondContact O-N 3.41Å; K62-N64 VanDerWaalsContact C-N 3.31Å; K62-N64 PolarHBondContact O-N 3.48Å; K62-E65 PolarHBondContact O-N 3Å; K62-L66 WeakPolarHBondContact O-CG 3.25Å; K62-L66 PolarHBondContact O-N 3.47Å |
| 63 | L | 98.6 | Very high | 98.3 | Very high | 93 Ų | 93 | 102 Ų | 102 | 49% | 0.487 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -62.1 | -39.5 | 175.2 | -75.9 | 170.3 | 0 | 0 | 0 | 111.8 | Y59 I60 D61 L66 R67 | Y59-L63 WeakPolarHBondContact O-CB 3.42Å; Y59-L63 VanDerWaalsContact O-CG 3.28Å; Y59-L63 WeakPolarHBondContact O-CG 3.47Å; Y59-L63 PolarHBondContact O-N 2.78Å; I60-L63 PolarHBondContact O-N 2.87Å; D61-L63 PolarHBondContact O-N 2.93Å; L63-L66 PolarHBondContact O-N 2.91Å; L63-R67 VanDerWaalsContact O-CG 3.32Å; L63-R67 WeakPolarHBondContact O-CG 3.38Å; L63-R67 PolarHBondContact O-N 2.86Å |
| 64 | N | 98.4 | Very high | 98.2 | Very high | 70 Ų | 70 | 102.1 Ų | 102.1 | 37% | 0.374 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -68.2 | -39.9 | 178 | -70.9 | -29 | 0 | 0 | 0 | 111.8 | I60 D61 K62 R67 R68 | I60-N64 WeakPolarHBondContact CG2-ND2 3.44Å; I60-N64 WeakPolarHBondContact O-CB 3.49Å; I60-N64 PolarHBondContact O-N 3.14Å; I60-N64 PolarHBondContact O-ND2 2.91Å; D61-N64 PolarHBondContact O-N 3.15Å; K62-N64 VanDerWaalsContact C-N 3.31Å; K62-N64 PolarHBondContact O-N 3.48Å; N64-R67 WeakPolarHBondContact O-CB 3.44Å; N64-R67 PolarHBondContact O-N 3.43Å; N64-R67 PolarHBondContact OD1-NH1 3.3Å; N64-R67 VanDerWaalsContact OD1-NH1 3.09Å; N64-R68 PolarHBondContact O-N 2.97Å |
| 65 | E | 98.6 | Very high | 98 | Very high | 69 Ų | 69 | 104.3 Ų | 104.3 | 32% | 0.322 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -64.6 | -42.4 | 174.2 | -178.2 | 54.9 | -154.5 | 0 | 0 | 111.2 | D61 K62 R67 R68 Q69 | D61-E65 PolarHBondContact O-N 3.06Å; K62-E65 PolarHBondContact O-N 3Å; E65-R67 VanDerWaalsContact C-N 3.31Å; E65-R67 PolarHBondContact O-N 3.33Å; E65-R68 PolarHBondContact O-N 3.28Å; E65-R68 VanDerWaalsContact O-N 3.14Å; E65-R68 IonicContact OE2-CZ 3.43Å; E65-R68 IonicContact OE2-NE 3.24Å; E65-R68 PolarHBondContact OE2-NE 2.65Å; E65-R68 IonicContact OE2-NH2 3.76Å; E65-Q69 WeakPolarHBondContact O-CG 3.28Å; E65-Q69 PolarHBondContact O-N 3.5Å; E65-Q69 PolarHBondContact OE1-NE2 2.88Å |
| 66 | L | 98.5 | Very high | 97.9 | Very high | 83 Ų | 83 | 107.4 Ų | 107.4 | 44% | 0.435 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -60.9 | -39.3 | 173.9 | -72.9 | 173.2 | 0 | 0 | 0 | 112.3 | K62 L63 R68 Q69 K70 | K62-L66 WeakPolarHBondContact O-CG 3.25Å; K62-L66 PolarHBondContact O-N 3.47Å; L63-L66 PolarHBondContact O-N 2.91Å; L66-R68 VanDerWaalsContact C-N 3.35Å; L66-Q69 PolarHBondContact O-N 3.44Å; L66-K70 WeakPolarHBondContact O-CB 3.49Å; L66-K70 PolarHBondContact O-N 3.27Å |
| 67 | R | 98.3 | Very high | 97.7 | Very high | 157 Ų | 157 | 107.5 Ų | 107.5 | 59% | 0.592 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -61.5 | -42.9 | 173.2 | -75.8 | 172.1 | -179.7 | 149.1 | 3.1 | 111.8 | L63 N64 E65 K70 E71 | L63-R67 VanDerWaalsContact O-CG 3.32Å; L63-R67 WeakPolarHBondContact O-CG 3.38Å; L63-R67 PolarHBondContact O-N 2.86Å; N64-R67 WeakPolarHBondContact O-CB 3.44Å; N64-R67 PolarHBondContact O-N 3.43Å; N64-R67 PolarHBondContact OD1-NH1 3.3Å; N64-R67 VanDerWaalsContact OD1-NH1 3.09Å; E65-R67 VanDerWaalsContact C-N 3.31Å; E65-R67 PolarHBondContact O-N 3.33Å; R67-K70 WeakPolarHBondContact O-CB 3.41Å; R67-K70 PolarHBondContact O-N 3.21Å; R67-E71 PolarHBondContact O-N 2.88Å |
| 68 | R | 98.4 | Very high | 97.4 | Very high | 130 Ų | 130 | 106.8 Ų | 106.8 | 49% | 0.491 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -66.9 | -38.2 | 177.1 | -163.6 | 175.4 | 80.2 | 144.6 | 2.1 | 112 | N64 E65 L66 E71 K72 | N64-R68 PolarHBondContact O-N 2.97Å; E65-R68 PolarHBondContact O-N 3.28Å; E65-R68 VanDerWaalsContact O-N 3.14Å; E65-R68 IonicContact OE2-CZ 3.43Å; E65-R68 IonicContact OE2-NE 3.24Å; E65-R68 PolarHBondContact OE2-NE 2.65Å; E65-R68 IonicContact OE2-NH2 3.76Å; L66-R68 VanDerWaalsContact C-N 3.35Å; R68-E71 PolarHBondContact O-N 3.29Å; R68-K72 VanDerWaalsContact O-CG 3.28Å; R68-K72 WeakPolarHBondContact O-CG 3.28Å; R68-K72 PolarHBondContact O-N 3.15Å |
| 69 | Q | 98.4 | Very high | 97.1 | Very high | 86 Ų | 86 | 105 Ų | 105 | 40% | 0.402 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -64.1 | -43.6 | 173.9 | -72.1 | 177.7 | 0.2 | 0 | 0 | 111.3 | E65 L66 K72 L73 | E65-Q69 WeakPolarHBondContact O-CG 3.28Å; E65-Q69 PolarHBondContact O-N 3.5Å; E65-Q69 PolarHBondContact OE1-NE2 2.88Å; L66-Q69 PolarHBondContact O-N 3.44Å; Q69-K72 PolarHBondContact O-N 3.06Å; Q69-L73 WeakPolarHBondContact O-CG 3.45Å; Q69-L73 PolarHBondContact O-N 3.39Å |
| 70 | K | 98 | Very high | 96.8 | Very high | 121 Ų | 121 | 104 Ų | 104 | 53% | 0.526 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -58.5 | -49.3 | 173.8 | 177 | 178.2 | -178.8 | -72.6 | 0 | 111.4 | L66 R67 K72 L73 E74 | L66-K70 WeakPolarHBondContact O-CB 3.49Å; L66-K70 PolarHBondContact O-N 3.27Å; R67-K70 WeakPolarHBondContact O-CB 3.41Å; R67-K70 PolarHBondContact O-N 3.21Å; K70-K72 VanDerWaalsContact C-N 3.35Å; K70-K72 PolarHBondContact O-N 2.93Å; K70-L73 PolarHBondContact O-N 2.94Å; K70-L73 VanDerWaalsContact O-N 3.13Å; K70-E74 WeakPolarHBondContact CE-OE1 3.41Å; K70-E74 HydrophobicContact CG-CG 4.49Å; K70-E74 IonicContact NZ-OE1 2.62Å; K70-E74 PolarHBondContact NZ-OE1 3.26Å; K70-E74 IonicContact NZ-OE2 3.63Å; K70-E74 WeakPolarHBondContact O-CG 3.43Å; K70-E74 PolarHBondContact O-N 3.49Å |
| 71 | E | 97.7 | Very high | 96.3 | Very high | 127 Ų | 127 | 107.8 Ų | 107.8 | 59% | 0.593 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -58.7 | -44.7 | 177.7 | -178.1 | 176 | -155.2 | 0 | 0 | 111.9 | R67 R68 L73 E74 E75 | R67-E71 PolarHBondContact O-N 2.88Å; R68-E71 PolarHBondContact O-N 3.29Å; E71-L73 VanDerWaalsContact C-N 3.31Å; E71-L73 PolarHBondContact O-N 3.07Å; E71-E74 PolarHBondContact O-N 2.9Å; E71-E75 WeakPolarHBondContact O-CB 3.47Å; E71-E75 PolarHBondContact O-N 3.46Å |
| 72 | K | 97.7 | Very high | 95.4 | Very high | 86 Ų | 86 | 110.7 Ų | 110.7 | 37% | 0.374 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -62.2 | -36.9 | 175.4 | -73.6 | 171.8 | -179.9 | 177.6 | 0 | 113 | R68 Q69 K70 K76 | R68-K72 VanDerWaalsContact O-CG 3.28Å; R68-K72 WeakPolarHBondContact O-CG 3.28Å; R68-K72 PolarHBondContact O-N 3.15Å; Q69-K72 PolarHBondContact O-N 3.06Å; K70-K72 VanDerWaalsContact C-N 3.35Å; K70-K72 PolarHBondContact O-N 2.93Å; K72-K76 VanDerWaalsContact O-CG 3.3Å; K72-K76 WeakPolarHBondContact O-CG 3.48Å; K72-K76 PolarHBondContact O-N 3.41Å; K72-K76 VanDerWaalsContact O-N 3.07Å |
| 73 | L | 97.9 | Very high | 93.9 | Very high | 104 Ų | 104 | 113.3 Ų | 113.3 | 55% | 0.545 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -70.7 | -40.9 | 176.1 | -71.4 | 173.9 | 0 | 0 | 0 | 110.9 | Q69 K70 E71 K76 I77 | Q69-L73 WeakPolarHBondContact O-CG 3.45Å; Q69-L73 PolarHBondContact O-N 3.39Å; K70-L73 PolarHBondContact O-N 2.94Å; K70-L73 VanDerWaalsContact O-N 3.13Å; E71-L73 VanDerWaalsContact C-N 3.31Å; E71-L73 PolarHBondContact O-N 3.07Å; L73-K76 PolarHBondContact O-N 3.06Å; L73-I77 WeakPolarHBondContact O-CB 3.48Å; L73-I77 VanDerWaalsContact O-CG1 3.24Å; L73-I77 WeakPolarHBondContact O-CG1 3.47Å; L73-I77 PolarHBondContact O-N 3.47Å |
| 74 | E | 95.9 | Very high | 91.8 | Very high | 84 Ų | 84 | 116.8 Ų | 116.8 | 39% | 0.393 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -61.3 | -44.3 | 174.1 | -74.1 | 173.5 | 165.8 | 0 | 0 | 111.3 | K70 E71 I77 M78 | K70-E74 WeakPolarHBondContact CE-OE1 3.41Å; K70-E74 HydrophobicContact CG-CG 4.49Å; K70-E74 IonicContact NZ-OE1 2.62Å; K70-E74 PolarHBondContact NZ-OE1 3.26Å; K70-E74 IonicContact NZ-OE2 3.63Å; K70-E74 WeakPolarHBondContact O-CG 3.43Å; K70-E74 PolarHBondContact O-N 3.49Å; E71-E74 PolarHBondContact O-N 2.9Å; E74-I77 PolarHBondContact O-N 3.31Å; E74-M78 WeakPolarHBondContact O-CB 3.22Å; E74-M78 VanDerWaalsContact O-CG 3.27Å; E74-M78 WeakPolarHBondContact O-CG 3.36Å; E74-M78 PolarHBondContact O-N 2.98Å |
| 75 | E | 95.3 | Very high | 89.4 | Confident | 112 Ų | 112 | 118.4 Ų | 118.4 | 52% | 0.523 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -58.5 | -48.4 | 173.7 | -174.3 | 179.5 | -164.4 | 0 | 0 | 111.1 | E71 I77 M78 D79 | E71-E75 WeakPolarHBondContact O-CB 3.47Å; E71-E75 PolarHBondContact O-N 3.46Å; E75-I77 VanDerWaalsContact C-N 3.33Å; E75-I77 PolarHBondContact O-N 3.16Å; E75-M78 PolarHBondContact O-N 3.39Å; E75-D79 VanDerWaalsContact O-CB 3.3Å; E75-D79 WeakPolarHBondContact O-CB 3.39Å; E75-D79 PolarHBondContact O-N 3.09Å |
| 76 | K | 96.3 | Very high | 87.4 | Confident | 146 Ų | 146 | 120.2 Ų | 120.2 | 64% | 0.635 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -59.7 | -41.7 | 176.8 | -76.3 | 177.2 | 177.8 | -172.5 | 0 | 113 | K72 L73 Q80 | K72-K76 VanDerWaalsContact O-CG 3.3Å; K72-K76 WeakPolarHBondContact O-CG 3.48Å; K72-K76 PolarHBondContact O-N 3.41Å; K72-K76 VanDerWaalsContact O-N 3.07Å; L73-K76 PolarHBondContact O-N 3.06Å; K76-Q80 VanDerWaalsContact O-CB 3.32Å; K76-Q80 WeakPolarHBondContact O-CB 3.2Å; K76-Q80 PolarHBondContact O-N 3.35Å |
| 77 | I | 92.9 | Very high | 84.8 | Confident | 84 Ų | 84 | 118.6 Ų | 118.6 | 43% | 0.431 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -67.9 | -45.7 | 178.1 | -71.1 | 167.6 | 0 | 0 | 0 | 109.9 | L73 E74 E75 Q80 Y81 | L73-I77 WeakPolarHBondContact O-CB 3.48Å; L73-I77 VanDerWaalsContact O-CG1 3.24Å; L73-I77 WeakPolarHBondContact O-CG1 3.47Å; L73-I77 PolarHBondContact O-N 3.47Å; E74-I77 PolarHBondContact O-N 3.31Å; E75-I77 VanDerWaalsContact C-N 3.33Å; E75-I77 PolarHBondContact O-N 3.16Å; I77-Q80 WeakPolarHBondContact O-CB 3.28Å; I77-Q80 PolarHBondContact O-N 2.83Å; I77-Y81 HydrophobicContact CG2-CD2 3.66Å; I77-Y81 HydrophobicContact CG2-CE2 3.37Å; I77-Y81 WeakPolarHBondContact O-CD2 3.46Å; I77-Y81 PolarHBondContact O-N 2.9Å |
| 78 | M | 92.8 | Very high | 82.8 | Confident | 123 Ų | 123 | 116.1 Ų | 116.1 | 61% | 0.606 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -63.1 | -41.8 | 176.8 | -73.9 | -170.3 | -61 | 0 | 0 | 112.2 | E74 E75 Q80 Y81 K82 | E74-M78 WeakPolarHBondContact O-CB 3.22Å; E74-M78 VanDerWaalsContact O-CG 3.27Å; E74-M78 WeakPolarHBondContact O-CG 3.36Å; E74-M78 PolarHBondContact O-N 2.98Å; E75-M78 PolarHBondContact O-N 3.39Å; M78-Q80 VanDerWaalsContact C-N 3.32Å; M78-Y81 CarbonylContact O-C 3.49Å; M78-Y81 PolarHBondContact O-N 2.85Å; M78-K82 WeakPolarHBondContact O-CB 3.33Å; M78-K82 PolarHBondContact O-N 2.94Å |
| 79 | D | 91.6 | Very high | 80.8 | Confident | 83 Ų | 83 | 115.7 Ų | 115.7 | 44% | 0.444 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -64.2 | -39.7 | 176.1 | -81.7 | -19 | 0 | 0 | 0 | 111.5 | E75 K82 F83 | E75-D79 VanDerWaalsContact O-CB 3.3Å; E75-D79 WeakPolarHBondContact O-CB 3.39Å; E75-D79 PolarHBondContact O-N 3.09Å; D79-K82 PolarHBondContact O-N 3.19Å; D79-F83 PolarHBondContact O-N 3.12Å |
| 80 | Q | 92.2 | Very high | 78.8 | Confident | 106 Ų | 106 | 120 Ų | 120 | 50% | 0.495 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -56.3 | -57.2 | 168.7 | -166.8 | 173.2 | 23.7 | 0 | 0 | 108.7 | K76 I77 M78 K82 F83 Y84 | K76-Q80 VanDerWaalsContact O-CB 3.32Å; K76-Q80 WeakPolarHBondContact O-CB 3.2Å; K76-Q80 PolarHBondContact O-N 3.35Å; I77-Q80 WeakPolarHBondContact O-CB 3.28Å; I77-Q80 PolarHBondContact O-N 2.83Å; M78-Q80 VanDerWaalsContact C-N 3.32Å; Q80-K82 PolarHBondContact O-N 2.86Å; Q80-K82 VanDerWaalsContact O-N 3.15Å; Q80-F83 CarbonylContact O-C 3.17Å; Q80-F83 WeakPolarHBondContact O-CA 3.36Å; Q80-F83 WeakPolarHBondContact O-CB 3.46Å; Q80-F83 PolarHBondContact O-N 3.45Å; Q80-Y84 HydrophobicContact CB-CD2 4.46Å; Q80-Y84 HydrophobicContact CG-CD2 3.46Å; Q80-Y84 VanDerWaalsContact CG-CD2 3.46Å; Q80-Y84 HydrophobicContact CG-CE2 3.37Å; Q80-Y84 WeakPolarHBondContact O-CD2 3.32Å; Q80-Y84 PolarHBondContact O-N 2.98Å |
| 81 | Y | 87.3 | Confident | 76.8 | Confident | 164 Ų | 164 | 126.1 Ų | 126.1 | 64% | 0.643 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -57.5 | -30.6 | 177 | -75.4 | -64.5 | 0 | 0 | 0 | 114.7 | I77 M78 F83 Y84 D85 | I77-Y81 HydrophobicContact CG2-CD2 3.66Å; I77-Y81 HydrophobicContact CG2-CE2 3.37Å; I77-Y81 WeakPolarHBondContact O-CD2 3.46Å; I77-Y81 PolarHBondContact O-N 2.9Å; M78-Y81 CarbonylContact O-C 3.49Å; M78-Y81 PolarHBondContact O-N 2.85Å; Y81-F83 VanDerWaalsContact C-N 3.31Å; Y81-Y84 CarbonylContact O-C 3.6Å; Y81-Y84 PolarHBondContact O-N 3.4Å; Y81-D85 PolarHBondContact O-N 3.27Å |
| 82 | K | 80.6 | Confident | 74.9 | Confident | 165 Ų | 165 | 129.8 Ų | 129.8 | 72% | 0.717 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -69.9 | -29.9 | 175.8 | -168.6 | 177.2 | -179 | -177.8 | 0 | 112.3 | M78 D79 Q80 | M78-K82 WeakPolarHBondContact O-CB 3.33Å; M78-K82 PolarHBondContact O-N 2.94Å; D79-K82 PolarHBondContact O-N 3.19Å; Q80-K82 PolarHBondContact O-N 2.86Å; Q80-K82 VanDerWaalsContact O-N 3.15Å |
| 83 | F | 66.8 | Low | 73 | Confident | 187 Ų | 187 | 128.4 Ų | 128.4 | 82% | 0.82 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -83.6 | -27.8 | 171.2 | -135.2 | -87 | 0 | 0 | 0 | 112.4 | D79 Q80 Y81 | D79-F83 PolarHBondContact O-N 3.12Å; Q80-F83 CarbonylContact O-C 3.17Å; Q80-F83 WeakPolarHBondContact O-CA 3.36Å; Q80-F83 WeakPolarHBondContact O-CB 3.46Å; Q80-F83 PolarHBondContact O-N 3.45Å; Y81-F83 VanDerWaalsContact C-N 3.31Å |
| 84 | Y | 54.4 | Low | 71.6 | Confident | 165 Ų | 165 | 128.5 Ų | 128.5 | 65% | 0.647 | 62% | 0.617 | S | S | * | * | S | Bend | trans | -92.6 | 15.7 | 172.9 | -74.2 | -85 | 0 | 0 | 0 | 113.4 | Q80 Y81 P86 | Q80-Y84 HydrophobicContact CB-CD2 4.46Å; Q80-Y84 HydrophobicContact CG-CD2 3.46Å; Q80-Y84 VanDerWaalsContact CG-CD2 3.46Å; Q80-Y84 HydrophobicContact CG-CE2 3.37Å; Q80-Y84 WeakPolarHBondContact O-CD2 3.32Å; Q80-Y84 PolarHBondContact O-N 2.98Å; Y81-Y84 CarbonylContact O-C 3.6Å; Y81-Y84 PolarHBondContact O-N 3.4Å; Y84-P86 WeakPolarHBondContact O-CD 3.38Å |
| 85 | D | 47.8 | Very low | 70.7 | Confident | 105 Ų | 105 | 133 Ų | 133 | 56% | 0.561 | 63% | 0.63 | S | S | * | * | trans | -82.1 | 91.5 | 147.3 | -177.5 | 26.6 | 0 | 0 | 0 | 104.5 | Y81 S87 | Y81-D85 PolarHBondContact O-N 3.27Å; D85-S87 PolarHBondContact O-N 3.14Å; D85-S87 PolarHBondContact OD1-N 3.38Å | ||
| 86 | P | 57.1 | Low | 69.7 | Low | 107 Ų | 107 | 131.9 Ų | 131.9 | 70% | 0.695 | 63% | 0.627 | S | S | * | * | trans | -65 | 83.3 | 156.1 | 33.1 | -32.3 | 0 | 0 | 0 | 104.2 | Y84 | Y84-P86 WeakPolarHBondContact O-CD 3.38Š| ||
| 87 | S | 42.5 | Very low | 68.7 | Low | 49 Ų | 49 | 128.5 Ų | 128.5 | 34% | 0.343 | 62% | 0.618 | S | S | . | * | trans | -40.6 | 123.4 | 165.1 | 177.2 | 0 | 0 | 0 | 0 | 105.9 | D85 P89 | D85-S87 PolarHBondContact O-N 3.14Å; D85-S87 PolarHBondContact OD1-N 3.38Å; S87-P89 WeakPolarHBondContact O-CA 3.43Å | ||
| 88 | P | 57 | Low | 67.9 | Low | 105 Ų | 105 | 130.2 Ų | 130.2 | 68% | 0.682 | 63% | 0.628 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -43.6 | 123.4 | -173.3 | -28.8 | 31.2 | 0 | 0 | 0 | 108 | R90 | P88-R90 WeakPolarHBondContact O-CA 3.17Å; P88-R90 PolarHBondContact O-N 2.97Å |
| 89 | P | 56.1 | Low | 67.1 | Low | 120 Ų | 120 | 130.3 Ų | 130.3 | 78% | 0.779 | 63% | 0.625 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -34.8 | 101.9 | -150.8 | 13.3 | -30.6 | 0 | 0 | 0 | 108.4 | S87 R91 | S87-P89 WeakPolarHBondContact O-CA 3.43Å; P89-R91 VanDerWaalsContact C-N 3.33Å; P89-R91 PolarHBondContact O-N 3.48Å |
| 90 | R | 56.2 | Low | 66.5 | Low | 176 Ų | 176 | 131.9 Ų | 131.9 | 66% | 0.664 | 63% | 0.631 | S | S | * | * | trans | -44.9 | 108.6 | -174.3 | -91.7 | -178.8 | 142.1 | -140.4 | -1.8 | 105.7 | P88 R92 | P88-R90 WeakPolarHBondContact O-CA 3.17Å; P88-R90 PolarHBondContact O-N 2.97Å; R90-R92 HydrophobicContact CB-CB 4.4Å; R90-R92 PolarHBondContact O-N 2.87Å | ||
| 91 | R | 57.5 | Low | 65.8 | Low | 251 Ų | 251 | 134 Ų | 134 | 95% | 0.947 | 63% | 0.634 | S | S | * | * | trans | -64.9 | 28.5 | 171.6 | -78.7 | -96.4 | -166 | 117.1 | 1.2 | 110.1 | P89 G93 | P89-R91 VanDerWaalsContact C-N 3.33Å; P89-R91 PolarHBondContact O-N 3.48Å; R91-G93 PolarHBondContact O-N 3.28Å | ||
| 92 | R | 57.3 | Low | 65.3 | Low | 204 Ų | 204 | 134.2 Ų | 134.2 | 77% | 0.77 | 64% | 0.638 | S | S | * | * | trans | -76.1 | 58.6 | 158.4 | -159.4 | 169.3 | -174 | 156.8 | -1.6 | 107.3 | R90 N94 | R90-R92 HydrophobicContact CB-CB 4.4Å; R90-R92 PolarHBondContact O-N 2.87Å; R92-N94 PolarHBondContact O-N 3.24Å | ||
| 93 | G | 56.4 | Low | 64.9 | Low | 57 Ų | 57 | 131.3 Ų | 131.3 | 59% | 0.588 | 63% | 0.63 | S | S | * | * | trans | -58.1 | 136.2 | 166.7 | 0 | 0 | 0 | 0 | 0 | 107.4 | R91 W95 | R91-G93 PolarHBondContact O-N 3.28Å; G93-W95 PolarHBondContact O-N 3.26Å | ||
| 94 | N | 69.6 | Low | 65 | Low | 106 Ų | 106 | 128.1 Ų | 128.1 | 57% | 0.567 | 62% | 0.62 | S | S | * | * | trans | -46.5 | 106.4 | 167.2 | -103.2 | 16.1 | 0 | 0 | 0 | 108.3 | R92 I96 T97 L98 | R92-N94 PolarHBondContact O-N 3.24Å; N94-I96 PolarHBondContact O-N 3.47Å; N94-I96 VanDerWaalsContact O-N 3.1Å; N94-T97 WeakPolarHBondContact CB-OG1 3.3Å; N94-T97 WeakPolarHBondContact O-CA 3.17Å; N94-T97 WeakPolarHBondContact O-CB 3.42Å; N94-T97 PolarHBondContact O-N 3.32Å; N94-L98 PolarHBondContact O-N 2.85Å; N94-L98 VanDerWaalsContact O-N 3.08Å | ||
| 95 | W | 77.5 | Confident | 65.5 | Low | 178 Ų | 178 | 126.4 Ų | 126.4 | 67% | 0.674 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -59.1 | -25.5 | 178 | 66.8 | -87.7 | 0 | 0 | 0 | 110.5 | G93 L98 K99 | G93-W95 PolarHBondContact O-N 3.26Å; W95-L98 PolarHBondContact O-N 3.12Å; W95-K99 HydrophobicContact CE3-CD 4.35Å; W95-K99 HydrophobicContact CZ3-CD 3.93Å; W95-K99 VanDerWaalsContact O-CB 3.29Å; W95-K99 WeakPolarHBondContact O-CB 3.41Å; W95-K99 PolarHBondContact O-N 3.24Å |
| 96 | I | 73.2 | Confident | 66 | Low | 89 Ų | 89 | 124.8 Ų | 124.8 | 46% | 0.456 | 61% | 0.613 | S | S | . | * | H | α-helix | trans | -59.6 | -49.5 | 169.3 | -65.7 | 156 | 0 | 0 | 0 | 111.1 | N94 L98 K99 M100 | N94-I96 PolarHBondContact O-N 3.47Å; N94-I96 VanDerWaalsContact O-N 3.1Å; I96-L98 VanDerWaalsContact C-N 3.29Å; I96-L98 PolarHBondContact O-N 3.14Å; I96-K99 PolarHBondContact O-N 3.19Å; I96-M100 VanDerWaalsContact O-CG 3.28Å; I96-M100 WeakPolarHBondContact O-CG 3.48Å; I96-M100 PolarHBondContact O-N 3.03Å |
| 97 | T | 75.5 | Confident | 65.9 | Low | 74 Ų | 74 | 127.5 Ų | 127.5 | 45% | 0.454 | 61% | 0.614 | S | S | . | * | H | α-helix | trans | -63.4 | -37.2 | 176.3 | -48.7 | 0 | 0 | 0 | 0 | 111.3 | N94 R101 | N94-T97 WeakPolarHBondContact CB-OG1 3.3Å; N94-T97 WeakPolarHBondContact O-CA 3.17Å; N94-T97 WeakPolarHBondContact O-CB 3.42Å; N94-T97 PolarHBondContact O-N 3.32Å; T97-R101 VanDerWaalsContact O-CB 3.26Å; T97-R101 WeakPolarHBondContact O-CB 3.49Å; T97-R101 PolarHBondContact O-N 3.26Å |
| 98 | L | 75.8 | Confident | 66.6 | Low | 120 Ų | 120 | 131 Ų | 131 | 63% | 0.628 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -67.7 | -38.8 | 176.3 | -160.3 | 68.2 | 0 | 0 | 0 | 111.7 | N94 W95 I96 R101 K102 | N94-L98 PolarHBondContact O-N 2.85Å; N94-L98 VanDerWaalsContact O-N 3.08Å; W95-L98 PolarHBondContact O-N 3.12Å; I96-L98 VanDerWaalsContact C-N 3.29Å; I96-L98 PolarHBondContact O-N 3.14Å; L98-R101 PolarHBondContact O-N 3.05Å; L98-K102 WeakPolarHBondContact O-CB 3.33Å; L98-K102 PolarHBondContact O-N 3.03Å |
| 99 | K | 76.1 | Confident | 66.3 | Low | 126 Ų | 126 | 130.9 Ų | 130.9 | 55% | 0.548 | 62% | 0.617 | S | S | . | * | H | α-helix | trans | -68.6 | -43.3 | 176.6 | -158.9 | 177.2 | 172 | -175.3 | 0 | 111.5 | W95 I96 K102 L103 | W95-K99 HydrophobicContact CE3-CD 4.35Å; W95-K99 HydrophobicContact CZ3-CD 3.93Å; W95-K99 VanDerWaalsContact O-CB 3.29Å; W95-K99 WeakPolarHBondContact O-CB 3.41Å; W95-K99 PolarHBondContact O-N 3.24Å; I96-K99 PolarHBondContact O-N 3.19Å; K99-K102 PolarHBondContact O-N 3.29Å; K99-L103 PolarHBondContact O-N 3.08Å |
| 100 | M | 80.1 | Confident | 66.2 | Low | 115 Ų | 115 | 131.1 Ų | 131.1 | 57% | 0.567 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -63 | -42.2 | 173.5 | -67.3 | -63 | -106.4 | 0 | 0 | 111.9 | I96 K102 L103 I104 | I96-M100 VanDerWaalsContact O-CG 3.28Å; I96-M100 WeakPolarHBondContact O-CG 3.48Å; I96-M100 PolarHBondContact O-N 3.03Å; M100-K102 VanDerWaalsContact C-N 3.3Å; M100-K102 PolarHBondContact O-N 3.23Å; M100-L103 PolarHBondContact O-N 3.17Å; M100-I104 WeakPolarHBondContact O-CD1 3.29Å; M100-I104 VanDerWaalsContact O-CG1 3.28Å; M100-I104 WeakPolarHBondContact O-CG1 3.47Å; M100-I104 PolarHBondContact O-N 2.96Å |
| 101 | R | 76.5 | Confident | 65.9 | Low | 152 Ų | 152 | 129 Ų | 129 | 57% | 0.574 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -62.1 | -36.9 | 174.5 | -172.7 | -176.9 | -67.6 | -171.3 | -2.3 | 111.8 | T97 L98 K105 | T97-R101 VanDerWaalsContact O-CB 3.26Å; T97-R101 WeakPolarHBondContact O-CB 3.49Å; T97-R101 PolarHBondContact O-N 3.26Å; L98-R101 PolarHBondContact O-N 3.05Å; R101-K105 WeakPolarHBondContact O-CB 3.4Å; R101-K105 PolarHBondContact O-N 3.47Å |
| 102 | K | 76.4 | Confident | 65.6 | Low | 167 Ų | 167 | 124.5 Ų | 124.5 | 73% | 0.726 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -67.8 | -39.9 | 176.6 | -166.8 | 168.6 | -178.7 | 174.4 | 0 | 112.1 | L98 K99 M100 S106 | L98-K102 WeakPolarHBondContact O-CB 3.33Å; L98-K102 PolarHBondContact O-N 3.03Å; K99-K102 PolarHBondContact O-N 3.29Å; M100-K102 VanDerWaalsContact C-N 3.3Å; M100-K102 PolarHBondContact O-N 3.23Å; K102-S106 PolarHBondContact O-N 3.49Å; K102-S106 PolarHBondContact O-OG 3.42Å |
| 103 | L | 72.3 | Confident | 65 | Low | 104 Ų | 104 | 121.9 Ų | 121.9 | 55% | 0.545 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -67.9 | -35 | 174.9 | -91.2 | 139.2 | 0 | 0 | 0 | 113.6 | K99 M100 S106 K107 | K99-L103 PolarHBondContact O-N 3.08Å; M100-L103 PolarHBondContact O-N 3.17Å; L103-S106 PolarHBondContact O-OG 3.39Å; L103-S106 VanDerWaalsContact O-OG 3.08Å; L103-K107 PolarHBondContact O-N 3.13Å |
| 104 | I | 70.3 | Confident | 64.4 | Low | 120 Ų | 120 | 129.9 Ų | 129.9 | 62% | 0.615 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -77.3 | -34.7 | 177.6 | -63.1 | 163.5 | 0 | 0 | 0 | 110.8 | M100 K107 K108 | M100-I104 WeakPolarHBondContact O-CD1 3.29Å; M100-I104 VanDerWaalsContact O-CG1 3.28Å; M100-I104 WeakPolarHBondContact O-CG1 3.47Å; M100-I104 PolarHBondContact O-N 2.96Å; I104-K107 PolarHBondContact O-N 3.36Å; I104-K108 PolarHBondContact O-N 3.23Å; I104-K108 VanDerWaalsContact O-N 3.1Å |
| 105 | K | 63.9 | Low | 63.2 | Low | 130 Ų | 130 | 132.2 Ų | 132.2 | 57% | 0.565 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -69.4 | -41.4 | 175.1 | -108.3 | 157.6 | 166.6 | 177.8 | 0 | 112.7 | R101 K107 K108 D109 | R101-K105 WeakPolarHBondContact O-CB 3.4Å; R101-K105 PolarHBondContact O-N 3.47Å; K105-K107 PolarHBondContact O-N 2.99Å; K105-K108 WeakPolarHBondContact O-CA 3.42Å; K105-K108 PolarHBondContact O-N 2.82Å; K105-D109 PolarHBondContact O-N 3.07Å |
| 106 | S | 58.3 | Low | 61.4 | Low | 71 Ų | 71 | 133.2 Ų | 133.2 | 50% | 0.497 | 62% | 0.621 | S | S | . | * | H | α-helix | trans | -62.9 | -28.1 | 174.9 | 63.1 | 0 | 0 | 0 | 0 | 113.2 | K102 L103 | K102-S106 PolarHBondContact O-N 3.49Å; K102-S106 PolarHBondContact O-OG 3.42Å; L103-S106 PolarHBondContact O-OG 3.39Å; L103-S106 VanDerWaalsContact O-OG 3.08Å |
| 107 | K | 55.3 | Low | 59.4 | Low | 164 Ų | 164 | 133.8 Ų | 133.8 | 71% | 0.713 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -77.6 | -23.6 | 169.2 | -91.5 | -164.5 | 173.7 | -173.8 | 0 | 114.2 | L103 I104 K105 | L103-K107 PolarHBondContact O-N 3.13Å; I104-K107 PolarHBondContact O-N 3.36Å; K105-K107 PolarHBondContact O-N 2.99Å |
| 108 | K | 57.6 | Low | 57.5 | Low | 122 Ų | 122 | 138.3 Ų | 138.3 | 53% | 0.53 | 65% | 0.653 | S | S | . | * | H | α-helix | trans | -81.2 | -28.2 | 178.4 | -170.5 | 164.8 | -179.5 | 173 | 0 | 112.4 | I104 K105 R112 | I104-K108 PolarHBondContact O-N 3.23Å; I104-K108 VanDerWaalsContact O-N 3.1Å; K105-K108 WeakPolarHBondContact O-CA 3.42Å; K105-K108 PolarHBondContact O-N 2.82Å; K108-R112 PolarHBondContact O-N 3.34Å |
| 109 | D | 51.2 | Low | 55.4 | Low | 103 Ų | 103 | 138.9 Ų | 138.9 | 55% | 0.551 | 66% | 0.662 | S | S | * | * | H | α-helix | trans | -76.2 | -36.3 | 175.7 | -61.5 | -35.7 | 0 | 0 | 0 | 111.4 | K105 N111 R112 E113 | K105-D109 PolarHBondContact O-N 3.07Å; D109-N111 PolarHBondContact O-N 2.85Å; D109-R112 PolarHBondContact O-N 3.46Å; D109-E113 PolarHBondContact O-N 2.92Å |
| 110 | I | 54.3 | Low | 53.4 | Low | 124 Ų | 124 | 140.6 Ų | 140.6 | 64% | 0.636 | 68% | 0.676 | S | S | * | * | H | α-helix | trans | -66.1 | -21.4 | 175.7 | -135.3 | 79.7 | 0 | 0 | 0 | 113.8 | ||
| 111 | N | 49.2 | Very low | 51.1 | Low | 133 Ų | 133 | 141.4 Ų | 141.4 | 71% | 0.711 | 69% | 0.688 | S | S | * | * | H | α-helix | trans | -96.6 | -20.6 | 179.6 | -162.8 | -90 | 0 | 0 | 0 | 112.8 | D109 | D109-N111 PolarHBondContact O-N 2.85Å |
| 112 | R | 51.1 | Low | 49.5 | Very low | 155 Ų | 155 | 140 Ų | 140 | 59% | 0.585 | 70% | 0.699 | S | S | * | * | H | α-helix | trans | -79.1 | -28 | 174.6 | -168.7 | 83.6 | 75.5 | -158.1 | 7.7 | 112.2 | K108 D109 R114 Q115 | K108-R112 PolarHBondContact O-N 3.34Å; D109-R112 PolarHBondContact O-N 3.46Å; R112-R114 VanDerWaalsContact C-N 3.28Å; R112-R114 PolarHBondContact O-N 3.38Å; R112-Q115 PolarHBondContact O-N 2.68Å |
| 113 | E | 44.2 | Very low | 47.3 | Very low | 150 Ų | 150 | 138.7 Ų | 138.7 | 70% | 0.701 | 71% | 0.705 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.3 | -17.6 | -172.4 | -152.7 | 172.7 | -162.1 | 0 | 0 | 114.1 | D109 Q115 | D109-E113 PolarHBondContact O-N 2.92Å; E113-Q115 VanDerWaalsContact C-N 3.28Å; E113-Q115 PolarHBondContact O-N 2.81Å |
| 114 | R | 44.3 | Very low | 45.3 | Very low | 224 Ų | 224 | 144.1 Ų | 144.1 | 85% | 0.845 | 72% | 0.718 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.3 | -5.4 | 173.2 | -76.3 | -173 | 66.5 | 154.7 | -0.5 | 114.8 | R112 | R112-R114 VanDerWaalsContact C-N 3.28Å; R112-R114 PolarHBondContact O-N 3.38Å |
| 115 | Q | 44.2 | Very low | 43.5 | Very low | 156 Ų | 156 | 143 Ų | 143 | 73% | 0.729 | 72% | 0.72 | S | S | * | * | S | Bend | trans | -140.3 | 69.2 | -177.9 | -69 | -74.7 | -40.4 | 0 | 0 | 109.3 | R112 E113 | R112-Q115 PolarHBondContact O-N 2.68Å; E113-Q115 VanDerWaalsContact C-N 3.28Å; E113-Q115 PolarHBondContact O-N 2.81Å |
| 116 | K | 39.2 | Very low | 41.8 | Very low | 199 Ų | 199 | 143.4 Ų | 143.4 | 87% | 0.865 | 73% | 0.729 | S | S | * | * | trans | 158.1 | 69.7 | 155 | -83.5 | 152.4 | -170.4 | -167.7 | 0 | 110.1 | ||||
| 117 | S | 32.6 | Very low | 40.6 | Very low | 101 Ų | 101 | 145.5 Ų | 145.5 | 71% | 0.706 | 74% | 0.744 | S | S | * | * | trans | -106.1 | 97.1 | 162.1 | 53.7 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 118 | L | 34.7 | Very low | 39.3 | Very low | 168 Ų | 168 | 142.6 Ų | 142.6 | 88% | 0.88 | 74% | 0.744 | S | S | * | * | trans | -166.3 | 125.7 | 156 | -105.3 | 141 | 0 | 0 | 0 | 110.2 | ||||
| 119 | T | 30.8 | Very low | 38 | Very low | 132 Ų | 132 | 146 Ų | 146 | 81% | 0.81 | 76% | 0.762 | S | S | * | * | trans | 101.6 | 95 | 164 | -29.4 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 120 | L | 35.4 | Very low | 37.1 | Very low | 163 Ų | 163 | 144.8 Ų | 144.8 | 85% | 0.853 | 77% | 0.773 | S | S | * | * | trans | -79.2 | 143.4 | 159.7 | -64.1 | 166.6 | 0 | 0 | 0 | 109.9 | ||||
| 121 | T | 31.1 | Very low | 35.8 | Very low | 131 Ų | 131 | 148.7 Ų | 148.7 | 80% | 0.804 | 79% | 0.786 | S | S | * | * | trans | -161 | 125.2 | 140.5 | 25.9 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 122 | P | 43.6 | Very low | 35.6 | Very low | 124 Ų | 124 | 149.1 Ų | 149.1 | 81% | 0.805 | 79% | 0.788 | S | S | * | * | trans | -100.2 | 130.2 | 169.7 | 32.8 | -23 | 0 | 0 | 0 | 110.7 | ||||
| 123 | T | 29.8 | Very low | 34.7 | Very low | 139 Ų | 139 | 149.5 Ų | 149.5 | 85% | 0.853 | 80% | 0.796 | S | S | * | * | trans | -133 | 131.2 | 168.7 | -41.9 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 124 | R | 29.7 | Very low | 34.4 | Very low | 218 Ų | 218 | 149 Ų | 149 | 82% | 0.823 | 80% | 0.797 | S | S | * | * | trans | -64.7 | 165.3 | 179.3 | -75.2 | 170.4 | 69.2 | 175.4 | 2.9 | 114.3 | ||||
| 125 | S | 33.3 | Very low | 34.5 | Very low | 95 Ų | 95 | 143.8 Ų | 143.8 | 66% | 0.664 | 79% | 0.793 | S | S | * | * | trans | 120.9 | 109.3 | 140.6 | -72.2 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 126 | D | 29.2 | Very low | 34 | Very low | 139 Ų | 139 | 143.6 Ų | 143.6 | 74% | 0.743 | 79% | 0.791 | S | S | * | * | 99.9 | 113.4 | 70.4 | -78.7 | -39.7 | 0 | 0 | 0 | 109.3 | |||||
| 127 | S | 31.4 | Very low | 33.9 | Very low | 116 Ų | 116 | 140.9 Ų | 140.9 | 81% | 0.811 | 78% | 0.782 | S | S | * | * | trans | -179.8 | 128.4 | 139.4 | -168 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 128 | S | 28.9 | Very low | 33.6 | Very low | 102 Ų | 102 | 141.5 Ų | 141.5 | 71% | 0.713 | 78% | 0.777 | S | S | * | * | trans | 66.9 | 95.2 | 157.8 | 74.8 | 0 | 0 | 0 | 0 | 121.6 | ||||
| 129 | E | 30.6 | Very low | 33.6 | Very low | 194 Ų | 194 | 138 Ų | 138 | 91% | 0.907 | 77% | 0.767 | S | S | * | * | 27.9 | 122 | 124.8 | -57 | -173.4 | 161 | 0 | 0 | 118.1 | |||||
| 130 | G | 31.2 | Very low | 33.9 | Very low | 77 Ų | 77 | 140.3 Ų | 140.3 | 79% | 0.794 | 77% | 0.768 | S | S | * | * | 88.8 | 121.5 | 69.9 | 0 | 0 | 0 | 0 | 0 | 108 | |||||
| 131 | F | 27.4 | Very low | 33.5 | Very low | 207 Ų | 207 | 138.9 Ų | 138.9 | 91% | 0.908 | 76% | 0.762 | S | S | * | * | cis | -172.6 | 137.8 | 46.3 | -179.4 | -107.3 | 0 | 0 | 0 | 107.9 | ||||
| 132 | L | 44.7 | Very low | 33.4 | Very low | 142 Ų | 142 | 137.3 Ų | 137.3 | 74% | 0.743 | 76% | 0.756 | S | S | * | * | trans | -69.4 | 157.6 | 171.3 | -68.1 | 161.9 | 0 | 0 | 0 | 110.1 | ||||
| 133 | Q | 31.7 | Very low | 33.2 | Very low | 162 Ų | 162 | 136.8 Ų | 136.8 | 76% | 0.757 | 76% | 0.755 | S | S | * | * | 158.3 | 118.7 | 114.6 | -163.1 | 59.4 | 38.9 | 0 | 0 | 112.1 | |||||
| 134 | L | 39.1 | Very low | 33.5 | Very low | 139 Ų | 139 | 135.1 Ų | 135.1 | 73% | 0.728 | 75% | 0.749 | S | S | * | * | trans | -79.3 | 152 | 159 | -140.1 | 86 | 0 | 0 | 0 | 109.4 | ||||
| 135 | P | 45.2 | Very low | 33.7 | Very low | 116 Ų | 116 | 131 Ų | 131 | 75% | 0.753 | 75% | 0.748 | S | S | * | * | -144.1 | 138.6 | 107.3 | 32.7 | -15.5 | 0 | 0 | 0 | 112 | |||||
| 136 | H | 34.9 | Very low | 33.8 | Very low | 151 Ų | 151 | 129.8 Ų | 129.8 | 70% | 0.699 | 75% | 0.75 | S | S | * | * | 68.3 | 132.4 | 74.8 | -150.5 | 55 | 0 | 0 | 0 | 116.3 | |||||
| 137 | Q | 35.7 | Very low | 34.1 | Very low | 143 Ų | 143 | 128.4 Ų | 128.4 | 67% | 0.668 | 75% | 0.752 | S | S | * | * | trans | 80.6 | 140.6 | 167.3 | -56.8 | -142.3 | 123.4 | 0 | 0 | 117.2 | ||||
| 138 | D | 26.6 | Very low | 34.3 | Very low | 114 Ų | 114 | 130.3 Ų | 130.3 | 61% | 0.61 | 75% | 0.753 | S | S | * | * | cis | -172.7 | 151.3 | 0.1 | -110.2 | -19.4 | 0 | 0 | 0 | 110.1 | ||||
| 139 | S | 34.6 | Very low | 34.6 | Very low | 94 Ų | 94 | 131 Ų | 131 | 66% | 0.657 | 76% | 0.758 | S | S | * | * | trans | 62.1 | 141.4 | 132.8 | 83.3 | 0 | 0 | 0 | 0 | 125.1 | ||||
| 140 | Q | 36.9 | Very low | 35.1 | Very low | 180 Ų | 180 | 128.8 Ų | 128.8 | 84% | 0.841 | 75% | 0.751 | S | S | * | * | trans | 77.7 | 149.9 | 147.5 | -54.2 | -143.7 | -44 | 0 | 0 | 118.7 | ||||
| 141 | D | 26.9 | Very low | 35.4 | Very low | 134 Ų | 134 | 133 Ų | 133 | 72% | 0.717 | 75% | 0.75 | S | S | * | * | cis | -176.7 | 163.7 | -24.7 | -169.7 | 3.9 | 0 | 0 | 0 | 103.8 | ||||
| 142 | S | 30.8 | Very low | 35.7 | Very low | 97 Ų | 97 | 130.9 Ų | 130.9 | 68% | 0.678 | 75% | 0.748 | S | S | * | * | trans | 79.8 | 118.5 | 155 | -65.4 | 0 | 0 | 0 | 0 | 121.7 | ||||
| 143 | S | 38.1 | Very low | 35.2 | Very low | 114 Ų | 114 | 127.7 Ų | 127.7 | 80% | 0.797 | 75% | 0.75 | S | S | * | * | trans | -42.5 | 155.6 | 153 | 54.1 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 144 | S | 36.5 | Very low | 35.2 | Very low | 103 Ų | 103 | 129.1 Ų | 129.1 | 72% | 0.72 | 76% | 0.757 | S | S | * | * | trans | -170.9 | 127.5 | 134 | -152.8 | 0 | 0 | 0 | 0 | 114 | ||||
| 145 | V | 33.4 | Very low | 35 | Very low | 132 Ų | 132 | 129.4 Ų | 129.4 | 80% | 0.8 | 76% | 0.764 | S | S | * | * | trans | 43.7 | 128.2 | 145.1 | -54.9 | 0 | 0 | 0 | 0 | 121.8 | ||||
| 146 | G | 35.1 | Very low | 34.4 | Very low | 69 Ų | 69 | 132.3 Ų | 132.3 | 71% | 0.711 | 77% | 0.773 | S | S | * | * | trans | -72.1 | 159.1 | 166.2 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 147 | S | 35.7 | Very low | 34.3 | Very low | 111 Ų | 111 | 128.2 Ų | 128.2 | 78% | 0.776 | 77% | 0.772 | S | S | * | * | trans | -155.2 | 118.4 | 152.7 | -73.9 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 148 | N | 37.3 | Very low | 34.2 | Very low | 156 Ų | 156 | 128.5 Ų | 128.5 | 83% | 0.834 | 78% | 0.783 | S | S | * | * | trans | -34.8 | 131.5 | 147.4 | 45.6 | -31.1 | 0 | 0 | 0 | 114.3 | ||||
| 149 | S | 33.5 | Very low | 34.7 | Very low | 117 Ų | 117 | 133.2 Ų | 133.2 | 82% | 0.818 | 80% | 0.798 | S | S | * | * | trans | -144.3 | 118.4 | 153.4 | -163.5 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 150 | L | 41.6 | Very low | 35 | Very low | 147 Ų | 147 | 138.8 Ų | 138.8 | 77% | 0.77 | 81% | 0.811 | S | S | * | * | trans | -61.8 | 155.7 | 156.1 | -162.9 | 85.5 | 0 | 0 | 0 | 108.3 | ||||
| 151 | E | 38.4 | Very low | 34.8 | Very low | 165 Ų | 165 | 135.8 Ų | 135.8 | 77% | 0.771 | 81% | 0.81 | S | S | * | * | trans | 156.2 | 144.2 | 141.1 | -78.4 | -56 | 132.3 | 0 | 0 | 111.3 | ||||
| 152 | D | 33.5 | Very low | 35.2 | Very low | 162 Ų | 162 | 133.9 Ų | 133.9 | 87% | 0.866 | 81% | 0.807 | S | S | * | * | trans | -64.6 | 165.9 | -173.6 | -101.4 | -41.8 | 0 | 0 | 0 | 116.5 | ||||
| 153 | G | 33.1 | Very low | 35.5 | Very low | 76 Ų | 76 | 137.8 Ų | 137.8 | 78% | 0.784 | 82% | 0.816 | S | S | * | * | trans | 122.8 | 122.9 | 141.7 | 0 | 0 | 0 | 0 | 0 | 118.5 | ||||
| 154 | Q | 33.1 | Very low | 36 | Very low | 191 Ų | 191 | 139.5 Ų | 139.5 | 89% | 0.893 | 82% | 0.822 | S | S | * | * | trans | -55.6 | 150.5 | -177.6 | -66.9 | 152.9 | 19.5 | 0 | 0 | 116.8 | ||||
| 155 | T | 34.3 | Very low | 36.5 | Very low | 145 Ų | 145 | 138.9 Ų | 138.9 | 89% | 0.89 | 82% | 0.823 | S | S | * | * | -170 | 153.4 | 123.7 | 42.2 | 0 | 0 | 0 | 0 | 112.2 | |||||
| 156 | L | 32.8 | Very low | 37.2 | Very low | 178 Ų | 178 | 140.3 Ų | 140.3 | 93% | 0.932 | 83% | 0.825 | S | S | * | * | trans | -61.9 | 148.9 | -166.6 | -84.5 | 79.2 | 0 | 0 | 0 | 117 | ||||
| 157 | G | 32.5 | Very low | 37.6 | Very low | 65 Ų | 65 | 145.1 Ų | 145.1 | 67% | 0.67 | 83% | 0.826 | S | S | * | * | 111.7 | 96.1 | 124.5 | 0 | 0 | 0 | 0 | 0 | 118.1 | |||||
| 158 | T | 34.5 | Very low | 38.1 | Very low | 148 Ų | 148 | 151.9 Ų | 151.9 | 91% | 0.908 | 84% | 0.835 | S | S | * | * | 162.9 | 130 | 118.8 | 41.3 | 0 | 0 | 0 | 0 | 110.2 | |||||
| 159 | K | 35.9 | Very low | 38.3 | Very low | 213 Ų | 213 | 151 Ų | 151 | 93% | 0.926 | 83% | 0.83 | S | S | * | * | trans | -81.3 | 123.7 | -175.4 | -64 | 179.9 | 176.4 | -179.8 | 0 | 110.4 | ||||
| 160 | K | 41 | Very low | 38.9 | Very low | 212 Ų | 212 | 150.1 Ų | 150.1 | 92% | 0.922 | 82% | 0.821 | S | S | * | * | trans | -133.3 | 115.7 | 148.5 | -77.3 | -174.9 | 161.7 | -170.3 | 0 | 108.1 | ||||
| 161 | S | 33.4 | Very low | 38.9 | Very low | 117 Ų | 117 | 153 Ų | 153 | 82% | 0.818 | 83% | 0.828 | S | S | * | * | trans | -86.7 | 152.9 | -173.9 | -173.4 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 162 | S | 35.8 | Very low | 39.3 | Very low | 94 Ų | 94 | 151.4 Ų | 151.4 | 66% | 0.657 | 82% | 0.824 | S | S | * | * | trans | 86.5 | 81.9 | 141 | -178.1 | 0 | 0 | 0 | 0 | 119 | ||||
| 163 | M | 35.1 | Very low | 40.2 | Very low | 178 Ų | 178 | 154.7 Ų | 154.7 | 88% | 0.877 | 82% | 0.824 | S | S | * | * | 169.7 | 61.2 | 117 | -94.3 | -168.7 | -69.7 | 0 | 0 | 111.4 | |||||
| 164 | V | 49.8 | Very low | 40.5 | Very low | 150 Ų | 150 | 158 Ų | 158 | 91% | 0.909 | 82% | 0.823 | S | S | * | * | trans | -139.1 | 75.1 | 166.9 | -177.2 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 165 | A | 47.6 | Very low | 41.6 | Very low | 91 Ų | 91 | 156.9 Ų | 156.9 | 75% | 0.752 | 81% | 0.811 | S | S | * | * | trans | -167.6 | 56.1 | 166.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 166 | L | 47.9 | Very low | 42.3 | Very low | 161 Ų | 161 | 153.6 Ų | 153.6 | 84% | 0.843 | 79% | 0.793 | S | S | * | * | S | Bend | trans | -127.3 | 94.3 | 154.3 | -74.6 | 178.7 | 0 | 0 | 0 | 109.2 | ||
| 167 | K | 43.2 | Very low | 43.5 | Very low | 170 Ų | 170 | 152.7 Ų | 152.7 | 74% | 0.739 | 78% | 0.781 | S | S | * | * | trans | 54.6 | 94.2 | 139.5 | -65.8 | 176.1 | 173.5 | 178.7 | 0 | 115.9 | L169 | K167-L169 VanDerWaalsContact C-N 3.27Å; K167-L169 PolarHBondContact O-N 3.38Å | ||
| 168 | R | 44.7 | Very low | 44.6 | Very low | 254 Ų | 254 | 155 Ų | 155 | 96% | 0.958 | 78% | 0.778 | S | S | * | * | trans | -50.5 | 100.2 | 135.3 | -100.9 | -179.5 | 175.4 | 145.8 | -1.7 | 107.4 | ||||
| 169 | L | 42.5 | Very low | 45.8 | Very low | 137 Ų | 137 | 154.8 Ų | 154.8 | 72% | 0.717 | 76% | 0.764 | S | S | * | * | trans | -77.3 | 127.2 | 159.6 | -71.1 | 168.3 | 0 | 0 | 0 | 106.6 | K167 F171 | K167-L169 VanDerWaalsContact C-N 3.27Å; K167-L169 PolarHBondContact O-N 3.38Å; L169-F171 PolarHBondContact O-N 2.99Å | ||
| 170 | P | 47.2 | Very low | 47.3 | Very low | 99 Ų | 99 | 147.1 Ų | 147.1 | 64% | 0.643 | 73% | 0.734 | S | S | * | * | trans | -62.5 | 124.3 | 157.7 | 27.8 | -28.1 | 0 | 0 | 0 | 105.8 | L172 | P170-L172 HydrophobicContact CB-CD1 4.48Å; P170-L172 HydrophobicContact CG-CD1 4.04Å; P170-L172 PolarHBondContact O-N 2.85Å | ||
| 171 | F | 39.9 | Very low | 48.5 | Very low | 207 Ų | 207 | 143.2 Ų | 143.2 | 91% | 0.908 | 72% | 0.716 | S | S | * | * | trans | -57.2 | 91.9 | 165.5 | -101.5 | -95.7 | 0 | 0 | 0 | 107.5 | L169 R173 | L169-F171 PolarHBondContact O-N 2.99Å; F171-R173 PolarHBondContact O-N 2.97Å | ||
| 172 | L | 46.9 | Very low | 50.1 | Low | 131 Ų | 131 | 144.1 Ų | 144.1 | 69% | 0.686 | 71% | 0.71 | S | S | * | * | trans | -66.9 | 90 | 159.4 | -96.8 | 82.4 | 0 | 0 | 0 | 105.7 | P170 N174 | P170-L172 HydrophobicContact CB-CD1 4.48Å; P170-L172 HydrophobicContact CG-CD1 4.04Å; P170-L172 PolarHBondContact O-N 2.85Å; L172-N174 VanDerWaalsContact C-N 3.25Å; L172-N174 PolarHBondContact O-N 3.32Å | ||
| 173 | R | 52.9 | Low | 51.7 | Low | 232 Ų | 232 | 146 Ų | 146 | 88% | 0.875 | 71% | 0.706 | S | S | * | * | trans | -58.7 | 101.5 | 155.3 | -175.8 | 168.6 | 170.2 | 170.4 | -3.5 | 105.2 | F171 R175 | F171-R173 PolarHBondContact O-N 2.97Å; R173-R175 PolarHBondContact O-N 3.27Å | ||
| 174 | N | 39.4 | Very low | 53.2 | Low | 144 Ų | 144 | 139.3 Ų | 139.3 | 77% | 0.77 | 68% | 0.679 | S | S | * | * | trans | -58.5 | 86.2 | 173.9 | -74.3 | -59.4 | 0 | 0 | 0 | 108.5 | L172 P176 | L172-N174 VanDerWaalsContact C-N 3.25Å; L172-N174 PolarHBondContact O-N 3.32Å; N174-P176 WeakPolarHBondContact O-CD 3.46Å | ||
| 175 | R | 56.4 | Low | 53.7 | Low | 169 Ų | 169 | 136.2 Ų | 136.2 | 64% | 0.638 | 66% | 0.663 | S | S | * | * | trans | -73.3 | 117.9 | 162 | -168.5 | 168.7 | 174.3 | 171.6 | -4.9 | 104.7 | R173 K177 D180 | R173-R175 PolarHBondContact O-N 3.27Å; R175-K177 PolarHBondContact O-N 3.07Å; R175-D180 VanDerWaalsContact CD-OD2 3.29Å; R175-D180 WeakPolarHBondContact CD-OD2 3.18Å; R175-D180 IonicContact CZ-OD1 2.81Å; R175-D180 IonicContact CZ-OD2 3.38Å; R175-D180 VanDerWaalsContact CZ-OD2 3.24Å; R175-D180 IonicContact NE-OD1 3.54Å; R175-D180 PolarHBondContact NE-OD1 3.29Å; R175-D180 IonicContact NE-OD2 3.47Å; R175-D180 PolarHBondContact NE-OD2 2.9Å; R175-D180 IonicContact NH2-OD1 3.38Å; R175-D180 PolarHBondContact NH2-OD1 2.89Å; R175-D180 IonicContact NH2-OD2 2.68Å; R175-D180 PolarHBondContact NH2-OD2 2.62Å | ||
| 176 | P | 49.1 | Very low | 54.5 | Low | 76 Ų | 76 | 140.5 Ų | 140.5 | 49% | 0.494 | 66% | 0.661 | S | S | . | * | trans | -60.9 | 106 | 179 | 22.3 | -30.2 | 0 | 0 | 0 | 107.4 | N174 D178 K179 | N174-P176 WeakPolarHBondContact O-CD 3.46Å; P176-D178 PolarHBondContact O-N 2.77Å; P176-K179 HydrophobicContact CG-CB 4.49Å; P176-K179 HydrophobicContact CG-CG 4.47Å; P176-K179 PolarHBondContact O-N 3.37Å | ||
| 177 | K | 58 | Low | 55.5 | Low | 159 Ų | 159 | 143.8 Ų | 143.8 | 69% | 0.691 | 66% | 0.662 | S | S | * | * | H | α-helix | trans | -59.4 | -17.7 | -175.1 | -67.7 | -146.8 | 176.7 | -172.7 | 0 | 112 | R175 K181 | R175-K177 PolarHBondContact O-N 3.07Å; K177-K181 WeakPolarHBondContact O-CB 3.3Å; K177-K181 WeakPolarHBondContact O-CD 3.27Å; K177-K181 WeakPolarHBondContact O-CG 3.32Å; K177-K181 PolarHBondContact O-N 2.71Å; K177-K181 VanDerWaalsContact O-N 3.08Å |
| 178 | D | 54.5 | Low | 56.6 | Low | 113 Ų | 113 | 145 Ų | 145 | 60% | 0.604 | 66% | 0.662 | S | S | * | * | H | α-helix | trans | -73.6 | -31.7 | 178.6 | -56.2 | -33.3 | 0 | 0 | 0 | 112.7 | P176 D180 K181 M182 | P176-D178 PolarHBondContact O-N 2.77Å; D178-D180 VanDerWaalsContact C-N 3.34Å; D178-D180 PolarHBondContact O-N 3.26Å; D178-K181 PolarHBondContact O-N 2.79Å; D178-K181 IonicContact OD1-NZ 3.93Å; D178-M182 WeakPolarHBondContact O-CB 3.34Å; D178-M182 PolarHBondContact O-N 3.31Å |
| 179 | K | 61.5 | Low | 57.8 | Low | 144 Ų | 144 | 136.1 Ų | 136.1 | 63% | 0.626 | 64% | 0.639 | S | S | * | * | H | α-helix | trans | -66 | -37.3 | 174.3 | -89.4 | -162.4 | 172.6 | -175.5 | 0 | 112.3 | P176 K183 | P176-K179 HydrophobicContact CG-CB 4.49Å; P176-K179 HydrophobicContact CG-CG 4.47Å; P176-K179 PolarHBondContact O-N 3.37Å; K179-K183 WeakPolarHBondContact O-CB 3.35Å; K179-K183 WeakPolarHBondContact O-CD 3.24Å; K179-K183 WeakPolarHBondContact O-CG 3.07Å; K179-K183 PolarHBondContact O-N 2.94Å |
| 180 | D | 67 | Low | 59.2 | Low | 52 Ų | 52 | 135.6 Ų | 135.6 | 28% | 0.278 | 64% | 0.635 | S | S | . | * | H | α-helix | trans | -80.2 | -33.3 | 179.9 | -67.6 | -34.8 | 0 | 0 | 0 | 111.9 | R175 D178 A184 | R175-D180 VanDerWaalsContact CD-OD2 3.29Å; R175-D180 WeakPolarHBondContact CD-OD2 3.18Å; R175-D180 IonicContact CZ-OD1 2.81Å; R175-D180 IonicContact CZ-OD2 3.38Å; R175-D180 VanDerWaalsContact CZ-OD2 3.24Å; R175-D180 IonicContact NE-OD1 3.54Å; R175-D180 PolarHBondContact NE-OD1 3.29Å; R175-D180 IonicContact NE-OD2 3.47Å; R175-D180 PolarHBondContact NE-OD2 2.9Å; R175-D180 IonicContact NH2-OD1 3.38Å; R175-D180 PolarHBondContact NH2-OD1 2.89Å; R175-D180 IonicContact NH2-OD2 2.68Å; R175-D180 PolarHBondContact NH2-OD2 2.62Å; D178-D180 VanDerWaalsContact C-N 3.34Å; D178-D180 PolarHBondContact O-N 3.26Å; D180-A184 WeakPolarHBondContact O-CB 3.44Å; D180-A184 PolarHBondContact O-N 2.76Å |
| 181 | K | 65.8 | Low | 60.8 | Low | 129 Ų | 129 | 133.6 Ų | 133.6 | 56% | 0.561 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -64.4 | -44.6 | 173.6 | -72.7 | 168.6 | -173.4 | 175.7 | 0 | 112.1 | K177 D178 A184 C185 | K177-K181 WeakPolarHBondContact O-CB 3.3Å; K177-K181 WeakPolarHBondContact O-CD 3.27Å; K177-K181 WeakPolarHBondContact O-CG 3.32Å; K177-K181 PolarHBondContact O-N 2.71Å; K177-K181 VanDerWaalsContact O-N 3.08Å; D178-K181 PolarHBondContact O-N 2.79Å; D178-K181 IonicContact OD1-NZ 3.93Å; K181-A184 PolarHBondContact O-N 3.15Å; K181-C185 WeakPolarHBondContact O-CB 3.37Å; K181-C185 PolarHBondContact O-N 2.79Å |
| 182 | M | 65.9 | Low | 62.2 | Low | 137 Ų | 137 | 127.8 Ų | 127.8 | 68% | 0.675 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -66 | -41.1 | 178.3 | -168.3 | 174.3 | -173.9 | 0 | 0 | 111.6 | D178 C185 Y186 | D178-M182 WeakPolarHBondContact O-CB 3.34Å; D178-M182 PolarHBondContact O-N 3.31Å; M182-C185 PolarHBondContact O-N 3.29Å; M182-Y186 WeakPolarHBondContact O-CB 3.49Å; M182-Y186 PolarHBondContact O-N 3.17Å |
| 183 | K | 70.6 | Confident | 63.6 | Low | 132 Ų | 132 | 126.9 Ų | 126.9 | 57% | 0.574 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -66.2 | -35.9 | 173.7 | -72.6 | 176.1 | -179.6 | -168.9 | 0 | 112.9 | K179 R187 | K179-K183 WeakPolarHBondContact O-CB 3.35Å; K179-K183 WeakPolarHBondContact O-CD 3.24Å; K179-K183 WeakPolarHBondContact O-CG 3.07Å; K179-K183 PolarHBondContact O-N 2.94Å; K183-R187 WeakPolarHBondContact O-CB 3.46Å; K183-R187 PolarHBondContact O-N 2.82Å |
| 184 | A | 65.3 | Low | 65.1 | Low | 38 Ų | 38 | 119.2 Ų | 119.2 | 31% | 0.314 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -72.8 | -34 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | D180 K181 R188 | D180-A184 WeakPolarHBondContact O-CB 3.44Å; D180-A184 PolarHBondContact O-N 2.76Å; K181-A184 PolarHBondContact O-N 3.15Å; A184-R188 WeakPolarHBondContact O-CB 3.39Å; A184-R188 PolarHBondContact O-N 3.34Å |
| 185 | C | 61.3 | Low | 67 | Low | 86 Ų | 86 | 116.5 Ų | 116.5 | 58% | 0.581 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -65.2 | -46.5 | 171.9 | -171.8 | 0 | 0 | 0 | 0 | 110.4 | K181 M182 R187 R188 S189 | K181-C185 WeakPolarHBondContact O-CB 3.37Å; K181-C185 PolarHBondContact O-N 2.79Å; M182-C185 PolarHBondContact O-N 3.29Å; C185-R187 PolarHBondContact O-N 3.38Å; C185-R188 CarbonylContact O-C 3.55Å; C185-R188 PolarHBondContact O-N 2.9Å; C185-R188 VanDerWaalsContact O-N 3.16Å; C185-S189 WeakPolarHBondContact O-CB 3.17Å; C185-S189 PolarHBondContact O-N 2.87Å; C185-S189 PolarHBondContact O-OG 3.44Å |
| 186 | Y | 65.2 | Low | 68.1 | Low | 181 Ų | 181 | 112 Ų | 112 | 71% | 0.71 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -65.5 | -35.5 | 175.8 | -171.7 | -98.7 | 0 | 0 | 0 | 113.6 | M182 R188 S189 | M182-Y186 WeakPolarHBondContact O-CB 3.49Å; M182-Y186 PolarHBondContact O-N 3.17Å; Y186-R188 VanDerWaalsContact C-N 3.32Å; Y186-S189 WeakPolarHBondContact CA-OG 2.81Å; Y186-S189 PolarHBondContact O-OG 2.72Å |
| 187 | R | 68.8 | Low | 69.3 | Low | 230 Ų | 230 | 114.2 Ų | 114.2 | 87% | 0.868 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -72.6 | -21.5 | 173.3 | -93.3 | -154.9 | -175.1 | -83.2 | 3.9 | 114 | K183 C185 | K183-R187 WeakPolarHBondContact O-CB 3.46Å; K183-R187 PolarHBondContact O-N 2.82Å; C185-R187 PolarHBondContact O-N 3.38Å |
| 188 | R | 65.4 | Low | 70.1 | Confident | 194 Ų | 194 | 109.4 Ų | 109.4 | 73% | 0.732 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -102.6 | -13.2 | -177.6 | -161.7 | -176.8 | -70 | 113.1 | -6 | 112.5 | A184 C185 Y186 M190 | A184-R188 WeakPolarHBondContact O-CB 3.39Å; A184-R188 PolarHBondContact O-N 3.34Å; C185-R188 CarbonylContact O-C 3.55Å; C185-R188 PolarHBondContact O-N 2.9Å; C185-R188 VanDerWaalsContact O-N 3.16Å; Y186-R188 VanDerWaalsContact C-N 3.32Å; R188-M190 PolarHBondContact O-N 3.22Å |
| 189 | S | 69.2 | Low | 70.7 | Confident | 69 Ų | 69 | 110 Ų | 110 | 48% | 0.483 | 54% | 0.539 | S | S | . | . | S | Bend | trans | -71.6 | 124.2 | 172.3 | 49.9 | 0 | 0 | 0 | 0 | 109.9 | C185 Y186 | C185-S189 WeakPolarHBondContact O-CB 3.17Å; C185-S189 PolarHBondContact O-N 2.87Å; C185-S189 PolarHBondContact O-OG 3.44Å; Y186-S189 WeakPolarHBondContact CA-OG 2.81Å; Y186-S189 PolarHBondContact O-OG 2.72Å |
| 190 | M | 71.8 | Confident | 71.3 | Confident | 126 Ų | 126 | 108.7 Ų | 108.7 | 62% | 0.621 | 54% | 0.543 | S | S | * | . | P | Polyproline II helix | trans | -63.3 | 142.2 | 170.1 | -63.5 | -158.5 | 87.7 | 0 | 0 | 109.8 | R188 D194 | R188-M190 PolarHBondContact O-N 3.22Å; M190-D194 HydrophobicContact CB-CB 4.16Å; M190-D194 HydrophobicContact CE-CB 3.73Å |
| 191 | S | 80.9 | Confident | 71.5 | Confident | 57 Ų | 57 | 113.9 Ų | 113.9 | 40% | 0.399 | 57% | 0.57 | S | S | . | * | P | Polyproline II helix | trans | -63.3 | 150.6 | 170.9 | 175.6 | 0 | 0 | 0 | 0 | 109.6 | N193 D194 L195 | S191-N193 PolarHBondContact O-N 3.4Å; S191-N193 PolarHBondContact OG-N 3.1Å; S191-D194 WeakPolarHBondContact CB-OD2 3.26Å; S191-D194 PolarHBondContact N-OD2 2.82Å; S191-D194 VanDerWaalsContact N-OD2 3.15Å; S191-D194 CarbonylContact O-C 3.58Å; S191-D194 WeakPolarHBondContact O-CA 3.28Å; S191-D194 WeakPolarHBondContact O-CB 3.29Å; S191-D194 PolarHBondContact O-N 3.32Å; S191-L195 PolarHBondContact O-N 2.83Å |
| 192 | M | 70.4 | Confident | 71.4 | Confident | 84 Ų | 84 | 111.1 Ų | 111.1 | 41% | 0.414 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -54.9 | -36.4 | 173.8 | 179.4 | 144 | -76.6 | 0 | 0 | 111.7 | M46 D194 L195 V196 | M46-M192 HydrophobicContact CE-CE 3.4Å; M46-M192 HydrophobicContact CE-SD 3.88Å; M46-M192 HydrophobicContact CG-CE 3.7Å; M46-M192 HydrophobicContact CG-SD 4.08Å; M46-M192 HydrophobicContact SD-CE 3.5Å; M46-M192 VanDerWaalsContact SD-CE 3.5Å; M46-M192 HydrophobicContact SD-SD 4.44Å; M192-D194 VanDerWaalsContact C-N 3.33Å; M192-D194 PolarHBondContact O-N 2.86Å; M192-L195 PolarHBondContact O-N 3.21Å; M192-V196 VanDerWaalsContact O-CG2 3.32Å; M192-V196 WeakPolarHBondContact O-CG2 3.21Å; M192-V196 PolarHBondContact O-N 2.92Å |
| 193 | N | 76.3 | Confident | 70.8 | Confident | 113 Ų | 113 | 107.2 Ų | 107.2 | 60% | 0.604 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -65.2 | -36.5 | 173.4 | -68.9 | -49 | 0 | 0 | 0 | 112 | S191 Q197 | S191-N193 PolarHBondContact O-N 3.4Å; S191-N193 PolarHBondContact OG-N 3.1Å; N193-Q197 VanDerWaalsContact O-CB 3.26Å; N193-Q197 WeakPolarHBondContact O-CB 3.37Å; N193-Q197 WeakPolarHBondContact O-CG 3.45Å; N193-Q197 PolarHBondContact O-N 3.08Å; N193-Q197 PolarHBondContact O-NE2 2.87Å |
| 194 | D | 83.8 | Confident | 70.2 | Confident | 70 Ų | 70 | 104 Ų | 104 | 37% | 0.374 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -70.5 | -33.8 | 176.1 | -57.5 | -25.6 | 0 | 0 | 0 | 111.5 | M190 S191 M192 S198 | M190-D194 HydrophobicContact CB-CB 4.16Å; M190-D194 HydrophobicContact CE-CB 3.73Å; S191-D194 WeakPolarHBondContact CB-OD2 3.26Å; S191-D194 PolarHBondContact N-OD2 2.82Å; S191-D194 VanDerWaalsContact N-OD2 3.15Å; S191-D194 CarbonylContact O-C 3.58Å; S191-D194 WeakPolarHBondContact O-CA 3.28Å; S191-D194 WeakPolarHBondContact O-CB 3.29Å; S191-D194 PolarHBondContact O-N 3.32Å; M192-D194 VanDerWaalsContact C-N 3.33Å; M192-D194 PolarHBondContact O-N 2.86Å; D194-S198 WeakPolarHBondContact O-CB 3.5Å; D194-S198 PolarHBondContact O-N 3.45Å |
| 195 | L | 80.1 | Confident | 69.7 | Low | 88 Ų | 88 | 110.4 Ų | 110.4 | 46% | 0.461 | 59% | 0.593 | S | S | . | * | H | α-helix | trans | -69.5 | -45.8 | 175.9 | -178.1 | 64.9 | 0 | 0 | 0 | 111.5 | S191 M192 S198 M199 | S191-L195 PolarHBondContact O-N 2.83Å; M192-L195 PolarHBondContact O-N 3.21Å; L195-S198 WeakPolarHBondContact O-CB 3.44Å; L195-S198 PolarHBondContact O-N 2.9Å; L195-M199 WeakPolarHBondContact O-CG 3.28Å; L195-M199 PolarHBondContact O-N 3.23Å |
| 196 | V | 78.6 | Confident | 69.1 | Low | 75 Ų | 75 | 118.6 Ų | 118.6 | 46% | 0.455 | 61% | 0.612 | S | S | . | * | H | α-helix | trans | -63.6 | -44 | 176.2 | 172.9 | 0 | 0 | 0 | 0 | 110.2 | M192 S198 M199 V200 | M192-V196 VanDerWaalsContact O-CG2 3.32Å; M192-V196 WeakPolarHBondContact O-CG2 3.21Å; M192-V196 PolarHBondContact O-N 2.92Å; V196-S198 VanDerWaalsContact C-N 3.33Å; V196-S198 PolarHBondContact O-N 2.7Å; V196-M199 PolarHBondContact O-N 2.74Å; V196-V200 VanDerWaalsContact O-CG2 3.27Å; V196-V200 WeakPolarHBondContact O-CG2 3.4Å; V196-V200 PolarHBondContact O-N 2.81Å |
| 197 | Q | 75.4 | Confident | 68.1 | Low | 122 Ų | 122 | 116.3 Ų | 116.3 | 57% | 0.57 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -61.9 | -39.8 | 173.6 | -75.7 | 171.5 | 98.1 | 0 | 0 | 112 | N193 V200 L201 | N193-Q197 VanDerWaalsContact O-CB 3.26Å; N193-Q197 WeakPolarHBondContact O-CB 3.37Å; N193-Q197 WeakPolarHBondContact O-CG 3.45Å; N193-Q197 PolarHBondContact O-N 3.08Å; N193-Q197 PolarHBondContact O-NE2 2.87Å; Q197-V200 PolarHBondContact O-N 3.08Å; Q197-L201 VanDerWaalsContact O-CB 3.28Å; Q197-L201 WeakPolarHBondContact O-CB 3.48Å; Q197-L201 PolarHBondContact O-N 3.44Å |
| 198 | S | 73.9 | Confident | 66.7 | Low | 57 Ų | 57 | 109 Ų | 109 | 40% | 0.399 | 61% | 0.613 | S | S | . | * | H | α-helix | trans | -62.4 | -42.3 | 175.3 | 179.9 | 0 | 0 | 0 | 0 | 112.1 | D194 L195 V196 L201 A202 | D194-S198 WeakPolarHBondContact O-CB 3.5Å; D194-S198 PolarHBondContact O-N 3.45Å; L195-S198 WeakPolarHBondContact O-CB 3.44Å; L195-S198 PolarHBondContact O-N 2.9Å; V196-S198 VanDerWaalsContact C-N 3.33Å; V196-S198 PolarHBondContact O-N 2.7Å; S198-L201 PolarHBondContact O-N 3.29Å; S198-A202 WeakPolarHBondContact O-CB 3.45Å; S198-A202 PolarHBondContact O-N 2.7Å |
| 199 | M | 67.8 | Low | 65.2 | Low | 126 Ų | 126 | 105.5 Ų | 105.5 | 62% | 0.621 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -67.3 | -35.5 | 175.4 | -68.4 | -155 | -55.7 | 0 | 0 | 113 | L195 V196 | L195-M199 WeakPolarHBondContact O-CG 3.28Å; L195-M199 PolarHBondContact O-N 3.23Å; V196-M199 PolarHBondContact O-N 2.74Å |
| 200 | V | 73.1 | Confident | 63.9 | Low | 116 Ų | 116 | 108.4 Ų | 108.4 | 70% | 0.703 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -68.5 | -40.9 | 174.6 | 171.9 | 0 | 0 | 0 | 0 | 110.8 | V196 Q197 G203 | V196-V200 VanDerWaalsContact O-CG2 3.27Å; V196-V200 WeakPolarHBondContact O-CG2 3.4Å; V196-V200 PolarHBondContact O-N 2.81Å; Q197-V200 PolarHBondContact O-N 3.08Å; V200-G203 PolarHBondContact O-N 3.2Å |
| 201 | L | 72.8 | Confident | 62.2 | Low | 162 Ų | 162 | 110.5 Ų | 110.5 | 85% | 0.848 | 64% | 0.641 | S | S | * | * | H | α-helix | trans | -75.2 | -28.1 | 179.3 | -150.9 | 76.9 | 0 | 0 | 0 | 112.8 | Q197 S198 G203 | Q197-L201 VanDerWaalsContact O-CB 3.28Å; Q197-L201 WeakPolarHBondContact O-CB 3.48Å; Q197-L201 PolarHBondContact O-N 3.44Å; S198-L201 PolarHBondContact O-N 3.29Å; L201-G203 PolarHBondContact O-N 3.03Å |
| 202 | A | 61.9 | Low | 59.9 | Low | 70 Ų | 70 | 115.4 Ų | 115.4 | 58% | 0.579 | 66% | 0.663 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.4 | 4.9 | 176.3 | 0 | 0 | 0 | 0 | 0 | 113.8 | S198 G204 | S198-A202 WeakPolarHBondContact O-CB 3.45Å; S198-A202 PolarHBondContact O-N 2.7Å; A202-G204 PolarHBondContact O-N 2.98Å |
| 203 | G | 54.4 | Low | 58.6 | Low | 56 Ų | 56 | 120.1 Ų | 120.1 | 58% | 0.577 | 69% | 0.689 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 49.6 | 62.5 | 163.6 | 0 | 0 | 0 | 0 | 0 | 114.5 | V200 L201 Q205 | V200-G203 PolarHBondContact O-N 3.2Å; L201-G203 PolarHBondContact O-N 3.03Å; G203-Q205 VanDerWaalsContact C-N 3.28Å; G203-Q205 PolarHBondContact O-N 2.98Å |
| 204 | G | 57.9 | Low | 56.7 | Low | 63 Ų | 63 | 123.7 Ų | 123.7 | 65% | 0.649 | 70% | 0.702 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 53.2 | 27.9 | 151.6 | 0 | 0 | 0 | 0 | 0 | 118.6 | A202 W206 | A202-G204 PolarHBondContact O-N 2.98Å; G204-W206 PolarHBondContact O-N 3.4Å |
| 205 | Q | 53.7 | Low | 54.5 | Low | 174 Ų | 174 | 126.8 Ų | 126.8 | 81% | 0.813 | 72% | 0.724 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.4 | 60.8 | -178.9 | -158.1 | 173.6 | 10.9 | 0 | 0 | 112.3 | G203 | G203-Q205 VanDerWaalsContact C-N 3.28Å; G203-Q205 PolarHBondContact O-N 2.98Å |
| 206 | W | 49 | Very low | 53.2 | Low | 258 Ų | 258 | 127.2 Ų | 127.2 | 98% | 0.977 | 73% | 0.732 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -138.1 | 11.9 | 165.1 | -75.3 | 101.2 | 0 | 0 | 0 | 113.5 | G204 | G204-W206 PolarHBondContact O-N 3.4Š|
| 207 | T | 45.3 | Very low | 51.1 | Low | 133 Ų | 133 | 130.5 Ų | 130.5 | 82% | 0.816 | 75% | 0.747 | S | S | * | * | S | Bend | trans | -118.9 | 114.3 | 172 | 79.4 | 0 | 0 | 0 | 0 | 109.3 | ||
| 208 | G | 39.6 | Very low | 49.3 | Very low | 75 Ų | 75 | 131.6 Ų | 131.6 | 77% | 0.773 | 76% | 0.756 | S | S | * | * | trans | 111 | 91.7 | 169.1 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 209 | S | 33.4 | Very low | 47.6 | Very low | 121 Ų | 121 | 136.8 Ų | 136.8 | 85% | 0.846 | 78% | 0.778 | S | S | * | * | trans | -145.4 | 69.6 | 149 | -143.3 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 210 | T | 40.8 | Very low | 46.3 | Very low | 130 Ų | 130 | 135.8 Ų | 135.8 | 80% | 0.798 | 78% | 0.783 | S | S | * | * | trans | -122 | 72.4 | 164.9 | 52.2 | 0 | 0 | 0 | 0 | 107.1 | ||||
| 211 | E | 36.2 | Very low | 44.6 | Very low | 170 Ų | 170 | 136.6 Ų | 136.6 | 79% | 0.794 | 79% | 0.789 | S | S | * | * | trans | 169.9 | 141.1 | 152.1 | 54.9 | -163.2 | 177.6 | 0 | 0 | 108.9 | ||||
| 212 | N | 32.5 | Very low | 43.4 | Very low | 161 Ų | 161 | 132.7 Ų | 132.7 | 86% | 0.861 | 79% | 0.788 | S | S | * | * | trans | 131.5 | 65.3 | 169.2 | -70.6 | -60 | 0 | 0 | 0 | 110.7 | ||||
| 213 | L | 44.5 | Very low | 42.5 | Very low | 182 Ų | 182 | 138.8 Ų | 138.8 | 95% | 0.953 | 80% | 0.801 | S | S | * | * | trans | -94.3 | 90.4 | 154.5 | -102.3 | 162.8 | 0 | 0 | 0 | 106.7 | ||||
| 214 | E | 36.8 | Very low | 41.9 | Very low | 189 Ų | 189 | 147.9 Ų | 147.9 | 88% | 0.883 | 82% | 0.818 | S | S | * | * | trans | -152.2 | 118.6 | 156.3 | -140.2 | 168 | -177.3 | 0 | 0 | 109.4 | ||||
| 215 | V | 36 | Very low | 41.1 | Very low | 135 Ų | 135 | 155.3 Ų | 155.3 | 82% | 0.818 | 83% | 0.826 | S | S | * | * | trans | -138.1 | 145.5 | 173.8 | 165.3 | 0 | 0 | 0 | 0 | 102.9 | ||||
| 216 | P | 53 | Low | 40.8 | Very low | 97 Ų | 97 | 156.4 Ų | 156.4 | 63% | 0.63 | 83% | 0.828 | S | S | * | * | cis | -139.4 | 168.3 | 18.2 | 26.5 | -1.8 | 0 | 0 | 0 | 116.1 | ||||
| 217 | D | 34.5 | Very low | 40.2 | Very low | 144 Ų | 144 | 152.3 Ų | 152.3 | 77% | 0.77 | 82% | 0.82 | S | S | * | * | 171.2 | 139.5 | 107.9 | -89 | -29 | 0 | 0 | 0 | 113.1 | |||||
| 218 | D | 39.1 | Very low | 40.1 | Very low | 145 Ų | 145 | 154 Ų | 154 | 78% | 0.775 | 82% | 0.824 | S | S | * | * | trans | 24 | 125.6 | 163.3 | -73.6 | -30.3 | 0 | 0 | 0 | 121.7 | ||||
| 219 | I | 36.6 | Very low | 40 | Very low | 166 Ų | 166 | 153.6 Ų | 153.6 | 85% | 0.851 | 82% | 0.819 | S | S | * | * | -171.7 | 131.1 | 118.5 | -83.4 | 142.5 | 0 | 0 | 0 | 109.7 | |||||
| 220 | S | 41.9 | Very low | 40.4 | Very low | 105 Ų | 105 | 152.8 Ų | 152.8 | 73% | 0.734 | 82% | 0.82 | S | S | * | * | trans | -52 | 133.8 | 168.9 | 178.2 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 221 | T | 37.8 | Very low | 40.6 | Very low | 133 Ų | 133 | 155.1 Ų | 155.1 | 82% | 0.816 | 82% | 0.824 | S | S | * | * | trans | -173.6 | 123.1 | 133.8 | 22.1 | 0 | 0 | 0 | 0 | 111 | K223 | T221-K223 PolarHBondContact O-N 3Š| ||
| 222 | G | 46 | Very low | 41.1 | Very low | 80 Ų | 80 | 151.8 Ų | 151.8 | 83% | 0.825 | 83% | 0.825 | S | S | * | * | trans | -62.6 | 130.7 | -179.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 223 | K | 43.9 | Very low | 41.3 | Very low | 198 Ų | 198 | 153.4 Ų | 153.4 | 86% | 0.861 | 83% | 0.825 | S | S | * | * | trans | -132.3 | 122.6 | 153 | -78.1 | -171.9 | 177.6 | 175 | 0 | 109.3 | T221 R225 | T221-K223 PolarHBondContact O-N 3Å; K223-R225 PolarHBondContact O-N 2.93Å; K223-R225 VanDerWaalsContact O-N 3.14Å | ||
| 224 | R | 40.4 | Very low | 41 | Very low | 246 Ų | 246 | 150 Ų | 150 | 93% | 0.928 | 82% | 0.816 | S | S | * | * | trans | -44.6 | 114.5 | 178.2 | -64.9 | -177.5 | -66.2 | 166.8 | -1.6 | 110.5 | K226 | R224-K226 PolarHBondContact O-N 3.48Š| ||
| 225 | R | 42 | Very low | 41.7 | Very low | 219 Ų | 219 | 147.3 Ų | 147.3 | 83% | 0.826 | 81% | 0.813 | S | S | * | * | trans | -61.3 | 114.7 | 165.7 | -63.2 | -176.9 | 75.8 | -122.7 | 4.5 | 107.1 | K223 E227 | K223-R225 PolarHBondContact O-N 2.93Å; K223-R225 VanDerWaalsContact O-N 3.14Å; R225-E227 PolarHBondContact O-N 3.03Å | ||
| 226 | K | 47 | Very low | 42.2 | Very low | 198 Ų | 198 | 146.7 Ų | 146.7 | 86% | 0.861 | 81% | 0.809 | S | S | * | * | trans | -81.1 | 101.6 | 166.5 | -163.7 | 169.6 | -176.7 | 177.9 | 0 | 105.3 | R224 L228 | R224-K226 PolarHBondContact O-N 3.48Å; K226-L228 PolarHBondContact O-N 3.32Å | ||
| 227 | E | 36.6 | Very low | 41.7 | Very low | 171 Ų | 171 | 146.4 Ų | 146.4 | 80% | 0.799 | 82% | 0.815 | S | S | * | * | trans | -54.5 | 111.4 | 173 | -69.6 | -177.5 | 156.9 | 0 | 0 | 108.5 | R225 G229 | R225-E227 PolarHBondContact O-N 3.03Å; E227-G229 PolarHBondContact O-N 2.9Å | ||
| 228 | L | 43.3 | Very low | 42.2 | Very low | 170 Ų | 170 | 146 Ų | 146 | 89% | 0.89 | 81% | 0.812 | S | S | * | * | trans | -70.4 | 110.2 | 163.3 | -70.5 | 170.5 | 0 | 0 | 0 | 105.6 | K226 | K226-L228 PolarHBondContact O-N 3.32Š| ||
| 229 | G | 38.2 | Very low | 42.1 | Very low | 65 Ų | 65 | 146 Ų | 146 | 67% | 0.67 | 81% | 0.811 | S | S | * | * | trans | -51.6 | 141.2 | 176.7 | 0 | 0 | 0 | 0 | 0 | 111 | E227 M231 | E227-G229 PolarHBondContact O-N 2.9Å; G229-M231 PolarHBondContact O-N 3.25Å; G229-M231 VanDerWaalsContact O-N 3.12Å | ||
| 230 | A | 42.2 | Very low | 42.2 | Very low | 105 Ų | 105 | 146.9 Ų | 146.9 | 87% | 0.868 | 81% | 0.809 | S | S | * | * | trans | -44.2 | 116.3 | 179.7 | 0 | 0 | 0 | 0 | 0 | 111.5 | A232 | A230-A232 PolarHBondContact O-N 3.1Š| ||
| 231 | M | 44.4 | Very low | 42.1 | Very low | 179 Ų | 179 | 146.6 Ų | 146.6 | 88% | 0.882 | 81% | 0.808 | S | S | * | * | trans | -66.4 | 112.4 | 164.8 | -78.1 | -169.6 | 174.3 | 0 | 0 | 107.4 | G229 F233 | G229-M231 PolarHBondContact O-N 3.25Å; G229-M231 VanDerWaalsContact O-N 3.12Å; M231-F233 PolarHBondContact O-N 3.44Å | ||
| 232 | A | 45.9 | Very low | 42.3 | Very low | 99 Ų | 99 | 146.9 Ų | 146.9 | 82% | 0.818 | 81% | 0.81 | S | S | * | * | trans | -65.2 | 119.2 | 170.5 | 0 | 0 | 0 | 0 | 0 | 108.6 | A230 S234 | A230-A232 PolarHBondContact O-N 3.1Å; A232-S234 PolarHBondContact O-N 3.02Å | ||
| 233 | F | 37.9 | Very low | 42 | Very low | 196 Ų | 196 | 150 Ų | 150 | 86% | 0.86 | 81% | 0.812 | S | S | * | * | trans | -60.6 | 119.8 | 171.3 | -64.7 | -83.1 | 0 | 0 | 0 | 109.2 | M231 T235 | M231-F233 PolarHBondContact O-N 3.44Å; F233-T235 PolarHBondContact O-N 3.21Å; F233-T235 VanDerWaalsContact O-N 3.12Å | ||
| 234 | S | 37.5 | Very low | 41.6 | Very low | 109 Ų | 109 | 147.3 Ų | 147.3 | 76% | 0.762 | 81% | 0.807 | S | S | * | * | trans | -69 | 103.8 | 171.5 | -173.5 | 0 | 0 | 0 | 0 | 108.9 | A232 T236 | A232-S234 PolarHBondContact O-N 3.02Å; S234-T236 PolarHBondContact O-N 3.29Å | ||
| 235 | T | 51.9 | Low | 41.2 | Very low | 134 Ų | 134 | 141.7 Ų | 141.7 | 82% | 0.822 | 81% | 0.805 | S | S | * | * | trans | -84.9 | 86.6 | 173.5 | 42.1 | 0 | 0 | 0 | 0 | 110.5 | F233 | F233-T235 PolarHBondContact O-N 3.21Å; F233-T235 VanDerWaalsContact O-N 3.12Å | ||
| 236 | T | 45.7 | Very low | 41 | Very low | 121 Ų | 121 | 135.9 Ų | 135.9 | 74% | 0.742 | 80% | 0.799 | S | S | * | * | trans | -123 | 79.8 | 158.5 | 35 | 0 | 0 | 0 | 0 | 108.3 | S234 | S234-T236 PolarHBondContact O-N 3.29Š| ||
| 237 | A | 42.5 | Very low | 40.4 | Very low | 92 Ų | 92 | 131.1 Ų | 131.1 | 76% | 0.76 | 80% | 0.796 | S | S | * | * | trans | -84.1 | 118.9 | 166.5 | 0 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 238 | I | 45.8 | Very low | 40.2 | Very low | 135 Ų | 135 | 127.7 Ų | 127.7 | 69% | 0.692 | 80% | 0.797 | S | S | * | * | trans | -89.3 | 112.7 | 170 | -56.9 | 175.2 | 0 | 0 | 0 | 106.4 | F240 | I238-F240 HydrophobicContact CB-CD2 4.35Å; I238-F240 HydrophobicContact CB-CE2 4.06Å; I238-F240 HydrophobicContact CG2-CD2 3.72Å; I238-F240 HydrophobicContact CG2-CE2 3.29Å; I238-F240 HydrophobicContact CG2-CZ 3.84Å | ||
| 239 | N | 37 | Very low | 39.7 | Very low | 144 Ų | 144 | 128.7 Ų | 128.7 | 77% | 0.77 | 80% | 0.795 | S | S | * | * | trans | -74.8 | 119.4 | 174.5 | -80.4 | -48.7 | 0 | 0 | 0 | 109.8 | ||||
| 240 | F | 38.3 | Very low | 39.4 | Very low | 185 Ų | 185 | 136.6 Ų | 136.6 | 81% | 0.811 | 80% | 0.804 | S | S | * | * | trans | -113.3 | 25.1 | 174.2 | -83 | -75 | 0 | 0 | 0 | 113.3 | I238 | I238-F240 HydrophobicContact CB-CD2 4.35Å; I238-F240 HydrophobicContact CB-CE2 4.06Å; I238-F240 HydrophobicContact CG2-CD2 3.72Å; I238-F240 HydrophobicContact CG2-CE2 3.29Å; I238-F240 HydrophobicContact CG2-CZ 3.84Å | ||
| 241 | S | 39.6 | Very low | 38.9 | Very low | 100 Ų | 100 | 136.6 Ų | 136.6 | 70% | 0.699 | 80% | 0.798 | S | S | * | * | trans | -109.4 | 57.5 | -176.8 | 41.3 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 242 | T | 42.5 | Very low | 38.3 | Very low | 139 Ų | 139 | 137.1 Ų | 137.1 | 85% | 0.853 | 80% | 0.795 | S | S | * | * | trans | -143.1 | 56.1 | 159.5 | 58.6 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 243 | V | 40.3 | Very low | 37.5 | Very low | 144 Ų | 144 | 140.7 Ų | 140.7 | 87% | 0.873 | 80% | 0.795 | S | S | * | * | S | Bend | trans | -148.1 | 128.9 | 155 | -131 | 0 | 0 | 0 | 0 | 108.5 | ||
| 244 | N | 35.3 | Very low | 37.3 | Very low | 142 Ų | 142 | 139.2 Ų | 139.2 | 76% | 0.759 | 80% | 0.795 | S | S | * | * | trans | 90.7 | 64.7 | 174.6 | -141.8 | 55.9 | 0 | 0 | 0 | 118 | ||||
| 245 | S | 31.9 | Very low | 37 | Very low | 128 Ų | 128 | 140.3 Ų | 140.3 | 90% | 0.895 | 80% | 0.797 | S | S | * | * | trans | -92.2 | 91.9 | 153.3 | -69.8 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 246 | S | 36.8 | Very low | 36 | Very low | 98 Ų | 98 | 141 Ų | 141 | 69% | 0.685 | 80% | 0.796 | S | S | * | * | trans | -175.9 | 77 | 155.5 | 49.6 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 247 | A | 33.9 | Very low | 35.2 | Very low | 97 Ų | 97 | 143.7 Ų | 143.7 | 80% | 0.802 | 81% | 0.805 | S | S | * | * | trans | -168.6 | 134.9 | 151.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 248 | A | 33.2 | Very low | 35 | Very low | 99 Ų | 99 | 148 Ų | 148 | 82% | 0.818 | 81% | 0.807 | S | S | * | * | trans | 75.2 | 98.9 | 149.5 | 0 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 249 | F | 32.6 | Very low | 34.4 | Very low | 192 Ų | 192 | 147.5 Ų | 147.5 | 84% | 0.842 | 81% | 0.806 | S | S | * | * | trans | -12.4 | 145.8 | 142.7 | -78 | -81.3 | 0 | 0 | 0 | 121.2 | ||||
| 250 | R | 33 | Very low | 34.2 | Very low | 230 Ų | 230 | 146.3 Ų | 146.3 | 87% | 0.868 | 80% | 0.804 | S | S | * | * | trans | 81.5 | 113.5 | 150.1 | -70.5 | 173.1 | -167 | -91.5 | 2.1 | 118.5 | ||||
| 251 | S | 30.2 | Very low | 34 | Very low | 106 Ų | 106 | 143.5 Ų | 143.5 | 74% | 0.741 | 80% | 0.802 | S | S | * | * | 151.5 | 122.2 | 94.1 | -169.4 | 0 | 0 | 0 | 0 | 110.6 | |||||
| 252 | K | 33 | Very low | 33.4 | Very low | 189 Ų | 189 | 144.4 Ų | 144.4 | 82% | 0.822 | 81% | 0.808 | S | S | * | * | 166.3 | 151.3 | 121.3 | -88 | 170.3 | -172.7 | -176 | 0 | 110.7 | |||||
| 253 | Q | 28.5 | Very low | 32.9 | Very low | 174 Ų | 174 | 146.7 Ų | 146.7 | 81% | 0.813 | 81% | 0.807 | S | S | * | * | trans | 92.9 | 104.1 | 146.7 | -154 | 168.4 | -2.2 | 0 | 0 | 116.8 | ||||
| 254 | L | 32.9 | Very low | 32.7 | Very low | 166 Ų | 166 | 147.4 Ų | 147.4 | 87% | 0.869 | 80% | 0.801 | S | S | * | * | -167.9 | 114.6 | 110.9 | -96.8 | 155.7 | 0 | 0 | 0 | 109.7 | |||||
| 255 | V | 32 | Very low | 32.6 | Very low | 131 Ų | 131 | 147.5 Ų | 147.5 | 79% | 0.794 | 80% | 0.801 | S | S | * | * | trans | -90.4 | 117 | 165.2 | -78.7 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 256 | N | 31.4 | Very low | 32.6 | Very low | 150 Ų | 150 | 148.5 Ų | 148.5 | 80% | 0.802 | 80% | 0.795 | S | S | * | * | trans | 176.2 | 119.9 | 144 | -105.1 | 2.8 | 0 | 0 | 0 | 107.3 | ||||
| 257 | N | 29.4 | Very low | 32.5 | Very low | 176 Ų | 176 | 148.8 Ų | 148.8 | 94% | 0.941 | 80% | 0.797 | S | S | * | * | trans | -166.8 | 143.3 | 132.2 | -87.2 | -33.5 | 0 | 0 | 0 | 109.2 | ||||
| 258 | K | 37 | Very low | 33.7 | Very low | 182 Ų | 182 | 149.2 Ų | 149.2 | 79% | 0.791 | 79% | 0.791 | S | S | * | * | trans | -103.2 | 148.5 | -170.9 | 166.8 | 149.9 | 176.8 | 165.4 | 0 | 108.8 | ||||
| 259 | D | 32.8 | Very low | 33.6 | Very low | 126 Ų | 126 | 152.9 Ų | 152.9 | 67% | 0.674 | 79% | 0.792 | S | S | * | * | trans | 106.6 | 121.9 | 160.3 | -61 | -32.2 | 0 | 0 | 0 | 119.8 | ||||
| 260 | T | 33.4 | Very low | 33.5 | Very low | 118 Ų | 118 | 146.7 Ų | 146.7 | 72% | 0.724 | 78% | 0.782 | S | S | * | * | trans | 86 | 108.1 | 138 | 56.6 | 0 | 0 | 0 | 0 | 122.8 | ||||
| 261 | T | 33.4 | Very low | 33.6 | Very low | 127 Ų | 127 | 143.1 Ų | 143.1 | 78% | 0.779 | 78% | 0.778 | S | S | * | * | 79.1 | 140.5 | 127.9 | 60.5 | 0 | 0 | 0 | 0 | 123.9 | |||||
| 262 | S | 28.7 | Very low | 33.9 | Very low | 119 Ų | 119 | 142.3 Ų | 142.3 | 83% | 0.832 | 77% | 0.773 | S | S | * | * | trans | 79.8 | 122.3 | 165.4 | 71.5 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 263 | F | 30.8 | Very low | 34.1 | Very low | 187 Ų | 187 | 140.7 Ų | 140.7 | 82% | 0.82 | 77% | 0.773 | S | S | * | * | cis | 103.9 | 139 | 35.3 | -160.3 | -103.6 | 0 | 0 | 0 | 112.8 | ||||
| 264 | E | 35.9 | Very low | 34.4 | Very low | 158 Ų | 158 | 139.8 Ų | 139.8 | 74% | 0.738 | 77% | 0.774 | S | S | * | * | trans | 77.7 | 122.6 | -176.5 | -53.8 | -159.5 | 161.1 | 0 | 0 | 117 | ||||
| 265 | D | 33 | Very low | 34.8 | Very low | 144 Ų | 144 | 136.8 Ų | 136.8 | 77% | 0.77 | 77% | 0.767 | S | S | * | * | cis | 108.3 | 149.1 | 38.2 | -169.2 | 32.3 | 0 | 0 | 0 | 110.4 | ||||
| 266 | I | 33 | Very low | 35 | Very low | 150 Ų | 150 | 135.4 Ų | 135.4 | 77% | 0.769 | 76% | 0.763 | S | S | * | * | trans | 104.8 | 91.7 | 169.7 | -51.4 | 157.7 | 0 | 0 | 0 | 115.4 | ||||
| 267 | S | 34.6 | Very low | 35.2 | Very low | 104 Ų | 104 | 135 Ų | 135 | 73% | 0.727 | 77% | 0.766 | S | S | * | * | trans | -79.5 | -171.4 | 141.8 | -79.4 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 268 | P | 59.6 | Low | 35.4 | Very low | 105 Ų | 105 | 130.4 Ų | 130.4 | 68% | 0.682 | 76% | 0.761 | S | S | * | * | -128.2 | 171.3 | -52.8 | 34.3 | -18.6 | 0 | 0 | 0 | 110.1 | |||||
| 269 | Q | 31 | Very low | 35.2 | Very low | 176 Ų | 176 | 127.5 Ų | 127.5 | 82% | 0.822 | 76% | 0.763 | S | S | * | * | trans | -178 | 121.7 | 144.1 | -144.5 | 60.4 | 0.4 | 0 | 0 | 109.8 | ||||
| 270 | G | 30.8 | Very low | 35.3 | Very low | 62 Ų | 62 | 131.8 Ų | 131.8 | 64% | 0.639 | 77% | 0.77 | S | S | * | * | 110.6 | 144.8 | 98.7 | 0 | 0 | 0 | 0 | 0 | 108.1 | |||||
| 271 | I | 34.3 | Very low | 35.5 | Very low | 155 Ų | 155 | 131.5 Ų | 131.5 | 80% | 0.795 | 77% | 0.768 | S | S | * | * | cis | -173 | 146 | 17.8 | 38.5 | 169.7 | 0 | 0 | 0 | 106.2 | ||||
| 272 | S | 35.6 | Very low | 35.5 | Very low | 90 Ų | 90 | 134 Ų | 134 | 63% | 0.629 | 77% | 0.77 | S | S | * | * | trans | 15.9 | 154.9 | 141.9 | 45.8 | 0 | 0 | 0 | 0 | 120.7 | ||||
| 273 | D | 37.5 | Very low | 35.6 | Very low | 155 Ų | 155 | 132.4 Ų | 132.4 | 83% | 0.829 | 76% | 0.764 | S | S | * | * | cis | -170.2 | 158.4 | 2.5 | -89 | -28.1 | 0 | 0 | 0 | 102.7 | ||||
| 274 | D | 35.1 | Very low | 35.9 | Very low | 155 Ų | 155 | 128.9 Ų | 128.9 | 83% | 0.829 | 76% | 0.763 | S | S | * | * | 178.3 | 149.2 | 76.3 | -174.8 | 18.9 | 0 | 0 | 0 | 109 | |||||
| 275 | S | 40.9 | Very low | 36.3 | Very low | 102 Ų | 102 | 132.9 Ų | 132.9 | 71% | 0.713 | 77% | 0.771 | S | S | * | * | trans | -83.1 | 160.8 | -179.8 | -63.8 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 276 | S | 37.3 | Very low | 36.7 | Very low | 103 Ų | 103 | 132 Ų | 132 | 72% | 0.72 | 77% | 0.773 | S | S | * | * | 168.3 | 132.4 | 101.3 | 95.7 | 0 | 0 | 0 | 0 | 113.3 | |||||
| 277 | T | 35.7 | Very low | 36.8 | Very low | 141 Ų | 141 | 129.8 Ų | 129.8 | 87% | 0.865 | 78% | 0.778 | S | S | * | * | trans | 58.3 | 118 | 136.7 | -4.9 | 0 | 0 | 0 | 0 | 121.9 | ||||
| 278 | G | 32.3 | Very low | 36.7 | Very low | 80 Ų | 80 | 130.3 Ų | 130.3 | 83% | 0.825 | 78% | 0.781 | S | S | * | * | trans | 178.5 | 95.1 | 157.6 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 279 | S | 34.8 | Very low | 36.2 | Very low | 121 Ų | 121 | 133.6 Ų | 133.6 | 85% | 0.846 | 79% | 0.792 | S | S | * | * | trans | -73.6 | 156.7 | -172.6 | -168.4 | 0 | 0 | 0 | 0 | 115 | ||||
| 280 | R | 34.2 | Very low | 36.3 | Very low | 215 Ų | 215 | 132.4 Ų | 132.4 | 81% | 0.811 | 79% | 0.792 | S | S | * | * | trans | 106.4 | 100 | 140 | -149.6 | 175.3 | -159 | -150.3 | 3 | 119.5 | ||||
| 281 | V | 37.3 | Very low | 36.6 | Very low | 113 Ų | 113 | 135 Ų | 135 | 69% | 0.685 | 80% | 0.8 | S | S | * | * | 21.9 | 123.2 | 128.8 | -168.8 | 0 | 0 | 0 | 0 | 118 | |||||
| 282 | H | 33.6 | Very low | 36.6 | Very low | 179 Ų | 179 | 130.8 Ų | 130.8 | 83% | 0.829 | 80% | 0.795 | S | S | * | * | 173.4 | 162.8 | 121.7 | -91.3 | -69.3 | 0 | 0 | 0 | 111.9 | |||||
| 283 | A | 31.3 | Very low | 36.9 | Very low | 85 Ų | 85 | 137.7 Ų | 137.7 | 70% | 0.702 | 81% | 0.807 | S | S | * | * | trans | -91.9 | 162 | -151.5 | 0 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 284 | S | 36.3 | Very low | 36.7 | Very low | 113 Ų | 113 | 137 Ų | 137 | 79% | 0.79 | 81% | 0.808 | S | S | * | * | trans | 42 | 115.5 | 137.5 | -51.7 | 0 | 0 | 0 | 0 | 122 | ||||
| 285 | R | 44.1 | Very low | 36.8 | Very low | 242 Ų | 242 | 135.4 Ų | 135.4 | 91% | 0.913 | 81% | 0.809 | S | S | * | * | 135.9 | 141.4 | 119.1 | -90.6 | -178.3 | 165.4 | -137.5 | -2.6 | 115.2 | |||||
| 286 | P | 41.8 | Very low | 36.4 | Very low | 125 Ų | 125 | 137.6 Ų | 137.6 | 81% | 0.812 | 82% | 0.819 | S | S | * | * | trans | -90.4 | 162 | 169.4 | 36.4 | -31.6 | 0 | 0 | 0 | 113 | ||||
| 287 | A | 35.4 | Very low | 36.2 | Very low | 105 Ų | 105 | 138 Ų | 138 | 87% | 0.868 | 82% | 0.822 | S | S | * | * | trans | -61.6 | 138.4 | -170.6 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 288 | S | 33 | Very low | 36.1 | Very low | 115 Ų | 115 | 138.6 Ų | 138.6 | 80% | 0.804 | 82% | 0.819 | S | S | * | * | trans | -109 | 121 | 163.1 | 54.9 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 289 | L | 47.7 | Very low | 36.3 | Very low | 173 Ų | 173 | 138.6 Ų | 138.6 | 91% | 0.906 | 81% | 0.807 | S | S | * | * | trans | -92.3 | 119.9 | 163.6 | -77.6 | 167.7 | 0 | 0 | 0 | 108.7 | ||||
| 290 | D | 33.9 | Very low | 36.5 | Very low | 152 Ų | 152 | 140.1 Ų | 140.1 | 81% | 0.813 | 81% | 0.806 | S | S | * | * | trans | -73.8 | 132.5 | 169.2 | 176.9 | 16.4 | 0 | 0 | 0 | 109.8 | ||||
| 291 | S | 36.3 | Very low | 37 | Very low | 117 Ų | 117 | 136.8 Ų | 136.8 | 82% | 0.818 | 80% | 0.804 | S | S | * | * | trans | -108.1 | 103.7 | 170.4 | -76.3 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 292 | G | 34.3 | Very low | 37.3 | Very low | 66 Ų | 66 | 139.8 Ų | 139.8 | 68% | 0.68 | 82% | 0.816 | S | S | * | * | trans | -81.2 | 117.4 | 172.5 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 293 | R | 42.1 | Very low | 37.5 | Very low | 235 Ų | 235 | 135.4 Ų | 135.4 | 89% | 0.887 | 81% | 0.811 | S | S | * | * | trans | 34.9 | 125.8 | 139.2 | -60.8 | 171.1 | 73.5 | -148 | 4 | 118.9 | ||||
| 294 | T | 33.8 | Very low | 37.9 | Very low | 139 Ų | 139 | 136.7 Ų | 136.7 | 85% | 0.853 | 82% | 0.815 | S | S | * | * | -167.6 | 142.1 | 97.8 | 42 | 0 | 0 | 0 | 0 | 110.9 | |||||
| 295 | S | 36.6 | Very low | 37.6 | Very low | 122 Ų | 122 | 139.3 Ų | 139.3 | 85% | 0.853 | 82% | 0.819 | S | S | * | * | trans | -94.2 | 134.9 | 179.3 | -52.8 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 296 | T | 32.8 | Very low | 37.3 | Very low | 148 Ų | 148 | 135.2 Ų | 135.2 | 91% | 0.908 | 81% | 0.81 | S | S | * | * | trans | -131.6 | 102.3 | 157.4 | 22 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 297 | S | 33.1 | Very low | 36.7 | Very low | 113 Ų | 113 | 137.4 Ų | 137.4 | 79% | 0.79 | 81% | 0.809 | S | S | * | * | trans | -84.9 | 129.1 | 167.5 | 179.6 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 298 | N | 32.8 | Very low | 36.8 | Very low | 152 Ų | 152 | 137.9 Ų | 137.9 | 81% | 0.813 | 80% | 0.801 | S | S | * | * | trans | -113.9 | 100.5 | 164.7 | -169.6 | 18.9 | 0 | 0 | 0 | 107.8 | ||||
| 299 | S | 36.3 | Very low | 36.8 | Very low | 80 Ų | 80 | 141.8 Ų | 141.8 | 56% | 0.559 | 80% | 0.804 | S | S | * | * | trans | -119 | 114.2 | 173.2 | -179.3 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 300 | N | 39.8 | Very low | 36.1 | Very low | 154 Ų | 154 | 138 Ų | 138 | 82% | 0.824 | 80% | 0.798 | S | S | * | * | trans | -109.6 | 98.6 | 165.9 | -90.9 | -9.4 | 0 | 0 | 0 | 108.4 | ||||
| 301 | N | 44.3 | Very low | 35.9 | Very low | 144 Ų | 144 | 134.2 Ų | 134.2 | 77% | 0.77 | 79% | 0.794 | S | S | * | * | trans | -78.4 | 140.4 | 154.4 | -72.4 | -44.4 | 0 | 0 | 0 | 108 | ||||
| 302 | N | 43.3 | Very low | 35.8 | Very low | 176 Ų | 176 | 133 Ų | 133 | 94% | 0.941 | 79% | 0.791 | S | S | * | * | trans | -125.2 | 119.5 | 158.2 | -136.9 | 5.1 | 0 | 0 | 0 | 108.4 | ||||
| 303 | A | 38.4 | Very low | 35.9 | Very low | 88 Ų | 88 | 136.2 Ų | 136.2 | 73% | 0.727 | 80% | 0.797 | S | S | * | * | trans | -121.9 | 133.6 | 175.7 | 0 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 304 | S | 39 | Very low | 35.4 | Very low | 112 Ų | 112 | 132 Ų | 132 | 78% | 0.783 | 79% | 0.793 | S | S | * | * | trans | 54.9 | 120.7 | 148.3 | -168.8 | 0 | 0 | 0 | 0 | 120.7 | ||||
| 305 | L | 30.6 | Very low | 35.5 | Very low | 168 Ų | 168 | 131.2 Ų | 131.2 | 88% | 0.88 | 78% | 0.782 | S | S | * | * | -172.1 | 150.4 | 109 | -123.1 | 140.9 | 0 | 0 | 0 | 112.8 | |||||
| 306 | H | 37 | Very low | 35.6 | Very low | 156 Ų | 156 | 133.7 Ų | 133.7 | 72% | 0.722 | 78% | 0.78 | S | S | * | * | trans | -99.9 | 128.4 | 178.7 | 171.1 | -79 | 0 | 0 | 0 | 110.2 | ||||
| 307 | E | 31.2 | Very low | 35.7 | Very low | 170 Ų | 170 | 132.7 Ų | 132.7 | 79% | 0.794 | 78% | 0.779 | S | S | * | * | trans | -171 | 148 | 134.2 | -112.8 | -169.3 | 138.8 | 0 | 0 | 114.4 | ||||
| 308 | V | 36.3 | Very low | 35.9 | Very low | 115 Ų | 115 | 135.8 Ų | 135.8 | 70% | 0.697 | 77% | 0.773 | S | S | * | * | trans | -36.1 | 141 | 175 | -93.3 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 309 | K | 32.8 | Very low | 36.3 | Very low | 198 Ų | 198 | 134.7 Ų | 134.7 | 86% | 0.861 | 78% | 0.775 | S | S | * | * | 166.5 | 131.4 | 101.8 | -167.7 | 135.3 | -178.3 | 173 | 0 | 113.7 | |||||
| 310 | A | 32.7 | Very low | 36.1 | Very low | 94 Ų | 94 | 136.2 Ų | 136.2 | 78% | 0.777 | 77% | 0.773 | S | S | * | * | trans | 57.7 | 129.4 | 148.3 | 0 | 0 | 0 | 0 | 0 | 122.4 | ||||
| 311 | G | 31.1 | Very low | 35.7 | Very low | 72 Ų | 72 | 134.5 Ų | 134.5 | 74% | 0.742 | 77% | 0.773 | S | S | * | * | 107.9 | 100.9 | 125.8 | 0 | 0 | 0 | 0 | 0 | 118.8 | |||||
| 312 | A | 33.4 | Very low | 35.2 | Very low | 91 Ų | 91 | 135.8 Ų | 135.8 | 75% | 0.752 | 77% | 0.774 | S | S | * | * | trans | 72.2 | 129.5 | 132.7 | 0 | 0 | 0 | 0 | 0 | 122 | ||||
| 313 | V | 35.8 | Very low | 34.8 | Very low | 134 Ų | 134 | 133 Ų | 133 | 81% | 0.812 | 77% | 0.768 | S | S | * | * | trans | 60.3 | 107.8 | 143.6 | -65.2 | 0 | 0 | 0 | 0 | 122.5 | ||||
| 314 | N | 32.9 | Very low | 35 | Very low | 147 Ų | 147 | 134.5 Ų | 134.5 | 79% | 0.786 | 77% | 0.774 | S | S | * | * | 52.9 | 139.1 | 112.4 | -150.8 | 16.9 | 0 | 0 | 0 | 122.2 | |||||
| 315 | I | 36.2 | Very low | 34.8 | Very low | 122 Ų | 122 | 132.1 Ų | 132.1 | 63% | 0.626 | 77% | 0.766 | S | S | * | * | trans | 93.7 | 119.9 | 150.8 | -24.6 | 178 | 0 | 0 | 0 | 121.1 | ||||
| 316 | Q | 37.5 | Very low | 34.9 | Very low | 173 Ų | 173 | 131.8 Ų | 131.8 | 81% | 0.808 | 77% | 0.766 | S | S | * | * | trans | 66.1 | 113.9 | 144.2 | -104.5 | 142.5 | -10.6 | 0 | 0 | 121.3 | ||||
| 317 | S | 34.4 | Very low | 34.8 | Very low | 127 Ų | 127 | 134.6 Ų | 134.6 | 89% | 0.888 | 78% | 0.776 | S | S | * | * | -160.4 | 121.3 | 121.5 | -76.6 | 0 | 0 | 0 | 0 | 110.8 | |||||
| 318 | R | 38.9 | Very low | 34.9 | Very low | 178 Ų | 178 | 132.3 Ų | 132.3 | 67% | 0.672 | 78% | 0.779 | S | S | * | * | trans | -91.4 | 152 | 174.2 | -177.5 | -179.3 | -170.7 | -144.4 | 4.4 | 108.2 | Q320 | R318-Q320 VanDerWaalsContact NH1-CD 3.27Š| ||
| 319 | P | 40.7 | Very low | 34.9 | Very low | 130 Ų | 130 | 134.5 Ų | 134.5 | 84% | 0.844 | 79% | 0.786 | S | S | * | * | -127.5 | 137.9 | 127.3 | 25.2 | -10.2 | 0 | 0 | 0 | 111.9 | |||||
| 320 | Q | 32.4 | Very low | 34.9 | Very low | 111 Ų | 111 | 132.5 Ų | 132.5 | 52% | 0.519 | 78% | 0.784 | S | S | . | * | P | Polyproline II helix | trans | -89.4 | 119.7 | -179.7 | -169.1 | 176.8 | 1.2 | 0 | 0 | 107.1 | R318 | R318-Q320 VanDerWaalsContact NH1-CD 3.27Š|
| 321 | S | 31.3 | Very low | 35.2 | Very low | 119 Ų | 119 | 135.2 Ų | 135.2 | 83% | 0.832 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -69.9 | 127.6 | 172.3 | 29 | 0 | 0 | 0 | 0 | 110.1 | ||
| 322 | H | 33.8 | Very low | 35.2 | Very low | 170 Ų | 170 | 139.3 Ų | 139.3 | 79% | 0.787 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -98.3 | 136.2 | 166.1 | -80.6 | -93.4 | 0 | 0 | 0 | 109.9 | ||
| 323 | S | 34.6 | Very low | 35.3 | Very low | 118 Ų | 118 | 141.6 Ų | 141.6 | 83% | 0.825 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -99.5 | 140.1 | -179.8 | 166.3 | 0 | 0 | 0 | 0 | 110 | ||
| 324 | S | 43.1 | Very low | 35.2 | Very low | 120 Ų | 120 | 144.2 Ų | 144.2 | 84% | 0.839 | 78% | 0.783 | S | S | * | * | trans | -174.8 | 118.7 | 153.1 | 45 | 0 | 0 | 0 | 0 | 105.9 | ||||
| 325 | G | 34.8 | Very low | 35.5 | Very low | 61 Ų | 61 | 141.9 Ų | 141.9 | 63% | 0.629 | 77% | 0.774 | S | S | * | * | cis | 100.2 | 100.3 | 37 | 0 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 326 | D | 32.5 | Very low | 35.7 | Very low | 162 Ų | 162 | 148.5 Ų | 148.5 | 87% | 0.866 | 79% | 0.791 | S | S | * | * | trans | 155.5 | 103.4 | 144.8 | -73.3 | -17.7 | 0 | 0 | 0 | 111.5 | ||||
| 327 | F | 33.4 | Very low | 35.6 | Very low | 215 Ų | 215 | 145.4 Ų | 145.4 | 94% | 0.943 | 79% | 0.789 | S | S | * | * | trans | -133.3 | 119.3 | 152.3 | -104.8 | -84 | 0 | 0 | 0 | 107.3 | ||||
| 328 | S | 35 | Very low | 35.7 | Very low | 121 Ų | 121 | 145 Ų | 145 | 85% | 0.846 | 79% | 0.787 | S | S | * | * | trans | -57.2 | 134.4 | -175.3 | -59.3 | 0 | 0 | 0 | 0 | 112.9 | L330 | S328-L330 PolarHBondContact O-N 3.32Š| ||
| 329 | L | 35.4 | Very low | 35.5 | Very low | 161 Ų | 161 | 142.8 Ų | 142.8 | 84% | 0.843 | 80% | 0.798 | S | S | * | * | trans | -60.9 | 119.5 | 163.9 | -83.2 | 139.4 | 0 | 0 | 0 | 110.2 | ||||
| 330 | L | 33.2 | Very low | 35.1 | Very low | 157 Ų | 157 | 140.4 Ų | 140.4 | 82% | 0.822 | 80% | 0.797 | S | S | * | * | trans | -105.1 | 115.4 | 151.6 | -137.4 | 167.7 | 0 | 0 | 0 | 107 | S328 | S328-L330 PolarHBondContact O-N 3.32Š| ||
| 331 | H | 39.6 | Very low | 35.2 | Very low | 150 Ų | 150 | 140.9 Ų | 140.9 | 69% | 0.694 | 81% | 0.813 | S | S | * | * | trans | -87.2 | 109.3 | -176.2 | -147.1 | 85.9 | 0 | 0 | 0 | 107 | ||||
| 332 | D | 30.3 | Very low | 35.5 | Very low | 158 Ų | 158 | 140 Ų | 140 | 85% | 0.845 | 81% | 0.807 | S | S | * | * | trans | -119.4 | 116.6 | 159.4 | -88.1 | -33.1 | 0 | 0 | 0 | 109 | ||||
| 333 | H | 35.8 | Very low | 35.9 | Very low | 139 Ų | 139 | 138 Ų | 138 | 64% | 0.644 | 81% | 0.809 | S | S | * | * | trans | -99.6 | 104.2 | -176.6 | 168.2 | -85.6 | 0 | 0 | 0 | 107.4 | T335 | H333-T335 WeakPolarHBondContact CE1-CG2 3.47Š| ||
| 334 | E | 32.8 | Very low | 36.1 | Very low | 190 Ų | 190 | 138.8 Ų | 138.8 | 89% | 0.888 | 80% | 0.802 | S | S | * | * | trans | -117.1 | 106 | 162.3 | -76.6 | -163.2 | 145.6 | 0 | 0 | 110.5 | ||||
| 335 | T | 40.5 | Very low | 35.9 | Very low | 98 Ų | 98 | 142.2 Ų | 142.2 | 60% | 0.601 | 81% | 0.805 | S | S | * | * | trans | -49.3 | 125.5 | 169 | 41 | 0 | 0 | 0 | 0 | 112 | H333 S337 | H333-T335 WeakPolarHBondContact CE1-CG2 3.47Å; T335-S337 PolarHBondContact O-N 3.33Å | ||
| 336 | W | 40.5 | Very low | 35.9 | Very low | 260 Ų | 260 | 149.4 Ų | 149.4 | 99% | 0.985 | 81% | 0.814 | S | S | * | * | trans | -56.9 | 122.1 | 156.8 | -68.4 | -33.8 | 0 | 0 | 0 | 109.7 | ||||
| 337 | S | 34.2 | Very low | 36 | Very low | 109 Ų | 109 | 149.3 Ų | 149.3 | 76% | 0.762 | 81% | 0.813 | S | S | * | * | trans | -138.2 | 110.1 | 161.9 | -79.7 | 0 | 0 | 0 | 0 | 109.9 | T335 | T335-S337 PolarHBondContact O-N 3.33Š| ||
| 338 | S | 36.1 | Very low | 36.1 | Very low | 119 Ų | 119 | 148 Ų | 148 | 83% | 0.832 | 81% | 0.807 | S | S | * | * | trans | -54.9 | 127.5 | 159.6 | -59.7 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 339 | S | 35.8 | Very low | 36.2 | Very low | 131 Ų | 131 | 152.7 Ų | 152.7 | 92% | 0.916 | 81% | 0.806 | S | S | * | * | trans | 169.9 | 128.4 | 137.6 | -80.3 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 340 | G | 31.8 | Very low | 36.2 | Very low | 79 Ų | 79 | 153.3 Ų | 153.3 | 81% | 0.814 | 81% | 0.805 | S | S | * | * | trans | -180 | 63.1 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 341 | S | 35.4 | Very low | 36.5 | Very low | 122 Ų | 122 | 152.1 Ų | 152.1 | 85% | 0.853 | 80% | 0.804 | S | S | * | * | trans | -51.4 | 139.6 | 177.9 | -175.3 | 0 | 0 | 0 | 0 | 114 | ||||
| 342 | S | 37.1 | Very low | 36.5 | Very low | 101 Ų | 101 | 156.9 Ų | 156.9 | 71% | 0.706 | 82% | 0.816 | S | S | * | * | trans | -66.6 | 147.2 | 164.8 | -50.1 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 343 | P | 41 | Very low | 37.2 | Very low | 127 Ų | 127 | 154.8 Ų | 154.8 | 83% | 0.825 | 81% | 0.814 | S | S | * | * | trans | -86.8 | 115.5 | 175.5 | 31 | -29.7 | 0 | 0 | 0 | 111.6 | ||||
| 344 | I | 39 | Very low | 37.4 | Very low | 135 Ų | 135 | 157.6 Ų | 157.6 | 69% | 0.692 | 85% | 0.849 | S | S | * | * | trans | -82.2 | 119.4 | 166.1 | -68.6 | 178.1 | 0 | 0 | 0 | 108.3 | Y346 | I344-Y346 HydrophobicContact CG2-CD2 3.97Å; I344-Y346 HydrophobicContact CG2-CE2 3.81Å; I344-Y346 PolarHBondContact O-N 3.4Å | ||
| 345 | Q | 38.8 | Very low | 37.7 | Very low | 192 Ų | 192 | 156 Ų | 156 | 90% | 0.897 | 85% | 0.847 | S | S | * | * | trans | -76.2 | 112.6 | 171.2 | -67.6 | -131.4 | -6 | 0 | 0 | 110.4 | ||||
| 346 | Y | 35.4 | Very low | 37.5 | Very low | 211 Ų | 211 | 159.1 Ų | 159.1 | 83% | 0.827 | 86% | 0.86 | S | S | * | * | trans | -86.1 | 115.2 | 169.4 | -87 | -91.1 | 0 | 0 | 0 | 110.5 | I344 K348 | I344-Y346 HydrophobicContact CG2-CD2 3.97Å; I344-Y346 HydrophobicContact CG2-CE2 3.81Å; I344-Y346 PolarHBondContact O-N 3.4Å; Y346-K348 PolarHBondContact O-N 3.21Å | ||
| 347 | L | 33.9 | Very low | 37.4 | Very low | 161 Ų | 161 | 153.4 Ų | 153.4 | 84% | 0.843 | 85% | 0.853 | S | S | * | * | trans | -73.2 | 107.9 | 171.2 | -171.8 | 70.7 | 0 | 0 | 0 | 109.8 | R349 | L347-R349 PolarHBondContact O-N 3.29Š| ||
| 348 | K | 36.2 | Very low | 37.5 | Very low | 186 Ų | 186 | 156.1 Ų | 156.1 | 81% | 0.809 | 86% | 0.859 | S | S | * | * | trans | -74.6 | 100.3 | 175.3 | -172.7 | 178.7 | -178.1 | 178.4 | 0 | 110.1 | Y346 | Y346-K348 PolarHBondContact O-N 3.21Š| ||
| 349 | R | 36.5 | Very low | 37.6 | Very low | 221 Ų | 221 | 158.4 Ų | 158.4 | 83% | 0.834 | 86% | 0.861 | S | S | * | * | trans | -85 | 111.2 | 167.4 | -169.4 | 179.5 | -86.1 | -105.2 | 3.9 | 108.4 | L347 | L347-R349 PolarHBondContact O-N 3.29Š| ||
| 350 | Q | 37.2 | Very low | 37.8 | Very low | 174 Ų | 174 | 160.2 Ų | 160.2 | 81% | 0.813 | 86% | 0.857 | S | S | * | * | trans | -70.3 | 122.5 | 169.7 | -82.9 | 165.5 | -28.5 | 0 | 0 | 109.7 | ||||
| 351 | T | 38.3 | Very low | 38.2 | Very low | 132 Ų | 132 | 166 Ų | 166 | 81% | 0.81 | 86% | 0.86 | S | S | * | * | trans | -94.6 | 114.9 | 164.7 | 46.6 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 352 | R | 40.9 | Very low | 38.4 | Very low | 249 Ų | 249 | 169.4 Ų | 169.4 | 94% | 0.94 | 86% | 0.86 | S | S | * | * | trans | -73.9 | 128.2 | 161.1 | -95.8 | 165.4 | 80 | 174.6 | 3.9 | 108 | ||||
| 353 | S | 44.2 | Very low | 38.5 | Very low | 115 Ų | 115 | 175.1 Ų | 175.1 | 80% | 0.804 | 87% | 0.873 | S | S | * | * | trans | -74.6 | 137.3 | 162.6 | 47.6 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 354 | S | 40.5 | Very low | 38.3 | Very low | 198 Ų | 198 | 179.5 Ų | 179.5 | 100% | 1.385 | 88% | 0.878 | S | S | * | * | trans | -111.9 | 0 | 145.7 | -76.1 | 0 | 0 | 0 | 0 | 107.7 |
Retrieved 354 of 354 residues in 160.2 ms
(Link to these results)