| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 53.1 | Low | 79.3 | Confident | 227 Ų | 227 | 105.6 Ų | 105.6 | 100% | 1.118 | 57% | 0.565 | S | S | * | * | 0 | 22.8 | 0 | -69.7 | -165.3 | 139.8 | 0 | 0 | 113.8 | |||||
| 2 | T | 60.8 | Low | 80.6 | Confident | 106 Ų | 106 | 112.3 Ų | 112.3 | 65% | 0.65 | 58% | 0.576 | S | S | * | * | trans | -97.3 | -11.2 | -175 | 40.7 | 0 | 0 | 0 | 0 | 114.6 | S5 N6 | T2-S5 PolarHBondContact O-OG 3.45Å; T2-N6 PolarHBondContact O-N 2.77Å; T2-N6 PolarHBondContact O-ND2 3.42Å | ||
| 3 | S | 63.9 | Low | 81.8 | Confident | 89 Ų | 89 | 110.2 Ų | 110.2 | 62% | 0.622 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -71 | -39.9 | -179 | 44.4 | 0 | 0 | 0 | 0 | 112.8 | N6 L7 | S3-N6 PolarHBondContact O-N 2.68Å; S3-L7 PolarHBondContact O-N 2.99Å |
| 4 | N | 71 | Confident | 82.8 | Confident | 126 Ų | 126 | 107.6 Ų | 107.6 | 67% | 0.674 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -69.7 | -32.3 | 179.9 | -85.7 | -15.7 | 0 | 0 | 0 | 113.6 | S8 | N4-S8 PolarHBondContact O-N 3.24Å; N4-S8 VanDerWaalsContact O-N 3.15Å; N4-S8 PolarHBondContact O-OG 3.03Å |
| 5 | S | 76.8 | Confident | 83.8 | Confident | 55 Ų | 55 | 107.3 Ų | 107.3 | 39% | 0.385 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -72.6 | -35.9 | 177 | 51.4 | 0 | 0 | 0 | 0 | 112.4 | T2 S8 N9 | T2-S5 PolarHBondContact O-OG 3.45Å; S5-S8 PolarHBondContact O-OG 3.47Å; S5-N9 PolarHBondContact O-N 3.38Å; S5-N9 VanDerWaalsContact O-N 3.12Å; S5-N9 PolarHBondContact O-ND2 3.32Å |
| 6 | N | 86.8 | Confident | 84.6 | Confident | 95 Ų | 95 | 106.4 Ų | 106.4 | 51% | 0.508 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -67 | -40.3 | 174 | -76.4 | -58.3 | 0 | 0 | 0 | 111.7 | T2 S3 S8 N9 M10 | T2-N6 PolarHBondContact O-N 2.77Å; T2-N6 PolarHBondContact O-ND2 3.42Å; S3-N6 PolarHBondContact O-N 2.68Å; N6-S8 PolarHBondContact O-N 2.91Å; N6-N9 PolarHBondContact O-N 3.31Å; N6-M10 VanDerWaalsContact O-CG 3.3Å; N6-M10 WeakPolarHBondContact O-CG 3.28Å; N6-M10 PolarHBondContact O-N 3.47Å |
| 7 | L | 89.7 | Confident | 85.4 | Confident | 75 Ų | 75 | 105.2 Ų | 105.2 | 39% | 0.393 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -65 | -39 | 177.3 | -177 | 61 | 0 | 0 | 0 | 112.7 | S3 R11 | S3-L7 PolarHBondContact O-N 2.99Å; L7-R11 WeakPolarHBondContact O-CG 3.4Å; L7-R11 PolarHBondContact O-N 3.41Å; L7-R11 VanDerWaalsContact O-N 3.08Å |
| 8 | S | 89.8 | Confident | 86.1 | Confident | 45 Ų | 45 | 105.8 Ų | 105.8 | 32% | 0.315 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -68.3 | -38 | 175.9 | 60.4 | 0 | 0 | 0 | 0 | 112.4 | N4 S5 N6 R11 R12 | N4-S8 PolarHBondContact O-N 3.24Å; N4-S8 VanDerWaalsContact O-N 3.15Å; N4-S8 PolarHBondContact O-OG 3.03Å; S5-S8 PolarHBondContact O-OG 3.47Å; N6-S8 PolarHBondContact O-N 2.91Å; S8-R11 PolarHBondContact O-N 2.87Å; S8-R12 WeakPolarHBondContact O-CG 3.32Å; S8-R12 PolarHBondContact O-N 3.44Å; S8-R12 VanDerWaalsContact O-N 3.08Å |
| 9 | N | 92.6 | Very high | 86.6 | Confident | 80 Ų | 80 | 106 Ų | 106 | 43% | 0.428 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -63.4 | -44.1 | 174.2 | -69.6 | -18.2 | 0 | 0 | 0 | 111.9 | S5 N6 R11 R12 L13 | S5-N9 PolarHBondContact O-N 3.38Å; S5-N9 VanDerWaalsContact O-N 3.12Å; S5-N9 PolarHBondContact O-ND2 3.32Å; N6-N9 PolarHBondContact O-N 3.31Å; N9-R11 VanDerWaalsContact C-N 3.35Å; N9-R11 PolarHBondContact O-N 3.16Å; N9-R12 PolarHBondContact O-N 2.98Å; N9-L13 PolarHBondContact O-N 3.13Å |
| 10 | M | 92.6 | Very high | 87.1 | Confident | 108 Ų | 108 | 105.5 Ų | 105.5 | 53% | 0.532 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -63.1 | -39.9 | 177 | -70 | -63.7 | 98.1 | 0 | 0 | 112.3 | N6 L13 V14 | N6-M10 VanDerWaalsContact O-CG 3.3Å; N6-M10 WeakPolarHBondContact O-CG 3.28Å; N6-M10 PolarHBondContact O-N 3.47Å; M10-L13 HydrophobicContact CE-CD2 4.08Å; M10-L13 PolarHBondContact O-N 3.41Å; M10-V14 WeakPolarHBondContact O-CG2 3.49Å; M10-V14 PolarHBondContact O-N 2.99Å |
| 11 | R | 95 | Very high | 87.5 | Confident | 156 Ų | 156 | 103.9 Ų | 103.9 | 59% | 0.589 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -60.9 | -45.4 | 174 | -74.2 | 173.8 | 178.8 | 140.1 | -1.6 | 111.9 | L7 S8 N9 L13 V14 E15 | L7-R11 WeakPolarHBondContact O-CG 3.4Å; L7-R11 PolarHBondContact O-N 3.41Å; L7-R11 VanDerWaalsContact O-N 3.08Å; S8-R11 PolarHBondContact O-N 2.87Å; N9-R11 VanDerWaalsContact C-N 3.35Å; N9-R11 PolarHBondContact O-N 3.16Å; R11-L13 VanDerWaalsContact C-N 3.32Å; R11-L13 PolarHBondContact O-N 3.1Å; R11-V14 PolarHBondContact O-N 3.35Å; R11-E15 WeakPolarHBondContact O-CG 3.48Å; R11-E15 PolarHBondContact O-N 3.36Å |
| 12 | R | 95.1 | Very high | 89.6 | Confident | 185 Ų | 185 | 97.2 Ų | 97.2 | 70% | 0.698 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -60.3 | -42.4 | 176.1 | -72.1 | 176.6 | -180 | -176.6 | -0.6 | 112 | S8 N9 E15 Q16 | S8-R12 WeakPolarHBondContact O-CG 3.32Å; S8-R12 PolarHBondContact O-N 3.44Å; S8-R12 VanDerWaalsContact O-N 3.08Å; N9-R12 PolarHBondContact O-N 2.98Å; R12-E15 PolarHBondContact O-N 3Å; R12-Q16 PolarHBondContact O-N 3.45Å |
| 13 | L | 96.1 | Very high | 91.3 | Very high | 86 Ų | 86 | 96.4 Ų | 96.4 | 45% | 0.45 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -62.7 | -43.6 | 177.1 | -179.2 | 61.7 | 0 | 0 | 0 | 111.7 | N9 M10 R11 E15 Q16 L17 | N9-L13 PolarHBondContact O-N 3.13Å; M10-L13 HydrophobicContact CE-CD2 4.08Å; M10-L13 PolarHBondContact O-N 3.41Å; R11-L13 VanDerWaalsContact C-N 3.32Å; R11-L13 PolarHBondContact O-N 3.1Å; L13-E15 PolarHBondContact O-N 3.2Å; L13-Q16 WeakPolarHBondContact O-CB 3.23Å; L13-Q16 PolarHBondContact O-N 3.36Å; L13-L17 HydrophobicContact CD1-CD1 4.28Å; L13-L17 HydrophobicContact CD1-CG 4.25Å; L13-L17 HydrophobicContact CG-CD1 4.02Å; L13-L17 HydrophobicContact CG-CG 4.42Å; L13-L17 WeakPolarHBondContact O-CB 3.49Å; L13-L17 VanDerWaalsContact O-CG 3.28Å; L13-L17 WeakPolarHBondContact O-CG 3.38Å; L13-L17 PolarHBondContact O-N 3.12Å |
| 14 | V | 96.8 | Very high | 92.8 | Very high | 74 Ų | 74 | 101.2 Ų | 101.2 | 45% | 0.448 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -62.3 | -43.4 | 177 | 168.5 | 0 | 0 | 0 | 0 | 111.3 | M10 R11 Q16 L17 K18 | M10-V14 WeakPolarHBondContact O-CG2 3.49Å; M10-V14 PolarHBondContact O-N 2.99Å; R11-V14 PolarHBondContact O-N 3.35Å; V14-Q16 VanDerWaalsContact C-N 3.34Å; V14-Q16 PolarHBondContact O-N 3.36Å; V14-L17 PolarHBondContact O-N 3.5Å; V14-K18 HydrophobicContact CG1-CD 4.4Å; V14-K18 WeakPolarHBondContact O-CG 3.45Å; V14-K18 PolarHBondContact O-N 3.49Å |
| 15 | E | 96.8 | Very high | 94 | Very high | 102 Ų | 102 | 104.8 Ų | 104.8 | 48% | 0.477 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -62.8 | -41 | 175.9 | -66.5 | -51.2 | 138.6 | 0 | 0 | 111.9 | R11 R12 L13 K18 L19 | R11-E15 WeakPolarHBondContact O-CG 3.48Å; R11-E15 PolarHBondContact O-N 3.36Å; R12-E15 PolarHBondContact O-N 3Å; L13-E15 PolarHBondContact O-N 3.2Å; E15-K18 PolarHBondContact O-N 2.93Å; E15-K18 IonicContact OE1-NZ 2.77Å; E15-K18 PolarHBondContact OE1-NZ 2.9Å; E15-K18 IonicContact OE2-NZ 3.6Å; E15-L19 WeakPolarHBondContact O-CG 3.45Å; E15-L19 PolarHBondContact O-N 3.39Å |
| 16 | Q | 97.4 | Very high | 95 | Very high | 93 Ų | 93 | 106.9 Ų | 106.9 | 44% | 0.435 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -60.8 | -47.5 | 174.4 | -179.7 | 61.8 | 23 | 0 | 0 | 112 | R12 L13 V14 K18 L19 E20 | R12-Q16 PolarHBondContact O-N 3.45Å; L13-Q16 WeakPolarHBondContact O-CB 3.23Å; L13-Q16 PolarHBondContact O-N 3.36Å; V14-Q16 VanDerWaalsContact C-N 3.34Å; V14-Q16 PolarHBondContact O-N 3.36Å; Q16-K18 VanDerWaalsContact C-N 3.29Å; Q16-K18 PolarHBondContact O-N 3.13Å; Q16-L19 WeakPolarHBondContact O-CB 3.45Å; Q16-L19 PolarHBondContact O-N 2.94Å; Q16-L19 VanDerWaalsContact O-N 3.13Å; Q16-E20 WeakPolarHBondContact CG-OE1 3.4Å; Q16-E20 PolarHBondContact NE2-OE1 3.41Å; Q16-E20 PolarHBondContact O-N 3.41Å |
| 17 | L | 97.6 | Very high | 95.5 | Very high | 87 Ų | 87 | 109.9 Ų | 109.9 | 46% | 0.455 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -64.3 | -33.8 | -179.9 | -70.3 | 172 | 0 | 0 | 0 | 112.3 | L13 V14 E20 A21 | L13-L17 HydrophobicContact CD1-CD1 4.28Å; L13-L17 HydrophobicContact CD1-CG 4.25Å; L13-L17 HydrophobicContact CG-CD1 4.02Å; L13-L17 HydrophobicContact CG-CG 4.42Å; L13-L17 WeakPolarHBondContact O-CB 3.49Å; L13-L17 VanDerWaalsContact O-CG 3.28Å; L13-L17 WeakPolarHBondContact O-CG 3.38Å; L13-L17 PolarHBondContact O-N 3.12Å; V14-L17 PolarHBondContact O-N 3.5Å; L17-E20 PolarHBondContact O-N 2.89Å; L17-A21 VanDerWaalsContact O-CB 3.23Å; L17-A21 WeakPolarHBondContact O-CB 3.31Å; L17-A21 PolarHBondContact O-N 2.97Å |
| 18 | K | 97.4 | Very high | 95.9 | Very high | 115 Ų | 115 | 112.3 Ų | 112.3 | 50% | 0.5 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -62.3 | -43.3 | 172.9 | -74 | 171.2 | -176.7 | 171.2 | 0 | 111.5 | V14 E15 Q16 A21 S22 | V14-K18 HydrophobicContact CG1-CD 4.4Å; V14-K18 WeakPolarHBondContact O-CG 3.45Å; V14-K18 PolarHBondContact O-N 3.49Å; E15-K18 PolarHBondContact O-N 2.93Å; E15-K18 IonicContact OE1-NZ 2.77Å; E15-K18 PolarHBondContact OE1-NZ 2.9Å; E15-K18 IonicContact OE2-NZ 3.6Å; Q16-K18 VanDerWaalsContact C-N 3.29Å; Q16-K18 PolarHBondContact O-N 3.13Å; K18-A21 PolarHBondContact O-N 3.31Å; K18-S22 PolarHBondContact O-N 3.26Å; K18-S22 VanDerWaalsContact O-N 3.1Å; K18-S22 PolarHBondContact O-OG 2.96Å |
| 19 | L | 97.2 | Very high | 96.3 | Very high | 110 Ų | 110 | 114.3 Ų | 114.3 | 58% | 0.576 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -63.5 | -46.1 | 176.7 | -65.1 | 172.8 | 0 | 0 | 0 | 111 | E15 Q16 A21 S22 | E15-L19 WeakPolarHBondContact O-CG 3.45Å; E15-L19 PolarHBondContact O-N 3.39Å; Q16-L19 WeakPolarHBondContact O-CB 3.45Å; Q16-L19 PolarHBondContact O-N 2.94Å; Q16-L19 VanDerWaalsContact O-N 3.13Å; L19-A21 VanDerWaalsContact C-N 3.32Å; L19-A21 PolarHBondContact O-N 2.81Å; L19-S22 PolarHBondContact O-N 3.48Å; L19-S22 VanDerWaalsContact O-N 3.16Å; L19-S22 PolarHBondContact O-OG 3.28Å |
| 20 | E | 96 | Very high | 96.5 | Very high | 96 Ų | 96 | 114.9 Ų | 114.9 | 45% | 0.449 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -64.7 | -35.7 | 178 | -70.9 | 175.7 | -165 | 0 | 0 | 112.7 | Q16 L17 S22 V23 | Q16-E20 WeakPolarHBondContact CG-OE1 3.4Å; Q16-E20 PolarHBondContact NE2-OE1 3.41Å; Q16-E20 PolarHBondContact O-N 3.41Å; L17-E20 PolarHBondContact O-N 2.89Å; E20-S22 VanDerWaalsContact C-N 3.29Å; E20-S22 PolarHBondContact O-N 3.32Å; E20-V23 WeakPolarHBondContact O-CB 3.35Å; E20-V23 WeakPolarHBondContact O-CG2 3.49Å; E20-V23 PolarHBondContact O-N 2.98Å |
| 21 | A | 95.7 | Very high | 96.7 | Very high | 71 Ų | 71 | 111.2 Ų | 111.2 | 59% | 0.587 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -67.7 | -30.1 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | L17 K18 L19 V23 | L17-A21 VanDerWaalsContact O-CB 3.23Å; L17-A21 WeakPolarHBondContact O-CB 3.31Å; L17-A21 PolarHBondContact O-N 2.97Å; K18-A21 PolarHBondContact O-N 3.31Å; L19-A21 VanDerWaalsContact C-N 3.32Å; L19-A21 PolarHBondContact O-N 2.81Å; A21-V23 VanDerWaalsContact C-N 3.27Å; A21-V23 PolarHBondContact O-N 2.89Å |
| 22 | S | 96.2 | Very high | 96.9 | Very high | 87 Ų | 87 | 106.3 Ų | 106.3 | 61% | 0.608 | 55% | 0.551 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.2 | -3.3 | 176.3 | 65.5 | 0 | 0 | 0 | 0 | 114.9 | K18 L19 E20 E24 | K18-S22 PolarHBondContact O-N 3.26Å; K18-S22 VanDerWaalsContact O-N 3.1Å; K18-S22 PolarHBondContact O-OG 2.96Å; L19-S22 PolarHBondContact O-N 3.48Å; L19-S22 VanDerWaalsContact O-N 3.16Å; L19-S22 PolarHBondContact O-OG 3.28Å; E20-S22 VanDerWaalsContact C-N 3.29Å; E20-S22 PolarHBondContact O-N 3.32Å; S22-E24 PolarHBondContact O-N 3.3Å |
| 23 | V | 96.6 | Very high | 97 | Very high | 90 Ų | 90 | 99.9 Ų | 99.9 | 55% | 0.545 | 54% | 0.537 | S | S | . | . | S | Bend | trans | -69.8 | 121.5 | 177 | 179.1 | 0 | 0 | 0 | 0 | 110 | E20 A21 R25 | E20-V23 WeakPolarHBondContact O-CB 3.35Å; E20-V23 WeakPolarHBondContact O-CG2 3.49Å; E20-V23 PolarHBondContact O-N 2.98Å; A21-V23 VanDerWaalsContact C-N 3.27Å; A21-V23 PolarHBondContact O-N 2.89Å; V23-R25 PolarHBondContact O-N 2.96Å |
| 24 | E | 96.5 | Very high | 97 | Very high | 190 Ų | 190 | 100.4 Ų | 100.4 | 89% | 0.888 | 54% | 0.537 | S | S | * | . | P | Polyproline II helix | trans | -66.6 | 125.8 | 173.6 | -66.2 | -164.6 | 156.7 | 0 | 0 | 110.6 | S22 | S22-E24 PolarHBondContact O-N 3.3Š|
| 25 | R | 96.3 | Very high | 97.1 | Very high | 201 Ų | 201 | 102.4 Ų | 102.4 | 76% | 0.758 | 55% | 0.545 | S | S | * | . | P | Polyproline II helix | trans | -102.4 | 137.2 | 179 | -59.8 | -173.2 | -166.6 | 86 | 4.8 | 110.3 | V23 | V23-R25 PolarHBondContact O-N 2.96Š|
| 26 | I | 96.9 | Very high | 97 | Very high | 98 Ų | 98 | 103.8 Ų | 103.8 | 50% | 0.503 | 55% | 0.551 | S | S | . | * | P | Polyproline II helix | trans | -85.9 | 161.3 | 168.2 | 62.7 | 172.7 | 0 | 0 | 0 | 110.9 | A31 | I26-A31 HydrophobicContact CD1-CB 3.79Å; I26-A31 HydrophobicContact CG1-CB 4.27Å |
| 27 | K | 97.8 | Very high | 97 | Very high | 158 Ų | 158 | 104.8 Ų | 104.8 | 69% | 0.687 | 56% | 0.556 | S | S | * | * | P | Polyproline II helix | trans | -65.9 | 138.8 | 176 | -68.5 | -178.4 | -178.8 | 175.1 | 0 | 110.1 | S29 Q30 A31 | K27-S29 PolarHBondContact O-N 3.46Å; K27-Q30 HydrophobicContact CB-CB 4.29Å; K27-Q30 WeakPolarHBondContact O-CB 3.31Å; K27-Q30 PolarHBondContact O-N 3.41Å; K27-A31 PolarHBondContact O-N 2.96Å |
| 28 | V | 97.6 | Very high | 97 | Very high | 126 Ų | 126 | 107.7 Ų | 107.7 | 76% | 0.764 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -57.8 | -37.5 | 177 | 179.1 | 0 | 0 | 0 | 0 | 111.5 | Q30 A31 A32 | V28-Q30 VanDerWaalsContact C-N 3.31Å; V28-Q30 PolarHBondContact O-N 3.08Å; V28-A31 PolarHBondContact O-N 3.25Å; V28-A32 VanDerWaalsContact O-CB 3.31Å; V28-A32 WeakPolarHBondContact O-CB 3.28Å; V28-A32 PolarHBondContact O-N 3.08Å |
| 29 | S | 97.8 | Very high | 96.9 | Very high | 87 Ų | 87 | 106 Ų | 106 | 61% | 0.608 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -62.4 | -37.3 | 176 | 55 | 0 | 0 | 0 | 0 | 113 | K27 A33 | K27-S29 PolarHBondContact O-N 3.46Å; S29-A33 WeakPolarHBondContact O-CB 3.45Å; S29-A33 PolarHBondContact O-N 3.5Å; S29-A33 VanDerWaalsContact O-N 3.13Å |
| 30 | Q | 97.4 | Very high | 96.8 | Very high | 92 Ų | 92 | 106.7 Ų | 106.7 | 43% | 0.43 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -69.3 | -49.6 | 176.1 | 178 | -179.8 | -9.6 | 0 | 0 | 110.6 | K27 V28 A32 A33 E34 | K27-Q30 HydrophobicContact CB-CB 4.29Å; K27-Q30 WeakPolarHBondContact O-CB 3.31Å; K27-Q30 PolarHBondContact O-N 3.41Å; V28-Q30 VanDerWaalsContact C-N 3.31Å; V28-Q30 PolarHBondContact O-N 3.08Å; Q30-A32 VanDerWaalsContact C-N 3.27Å; Q30-A32 PolarHBondContact O-N 2.98Å; Q30-A33 PolarHBondContact O-N 3.15Å; Q30-A33 VanDerWaalsContact O-N 3.12Å; Q30-E34 VanDerWaalsContact CG-OE1 3.28Å; Q30-E34 WeakPolarHBondContact CG-OE1 3.3Å; Q30-E34 PolarHBondContact NE2-OE1 3.47Å; Q30-E34 WeakPolarHBondContact O-CG 3.49Å; Q30-E34 PolarHBondContact O-N 3.39Å |
| 31 | A | 97.6 | Very high | 96.7 | Very high | 31 Ų | 31 | 107.9 Ų | 107.9 | 26% | 0.256 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -57.1 | -42 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | I26 K27 V28 E34 L35 | I26-A31 HydrophobicContact CD1-CB 3.79Å; I26-A31 HydrophobicContact CG1-CB 4.27Å; K27-A31 PolarHBondContact O-N 2.96Å; V28-A31 PolarHBondContact O-N 3.25Å; A31-E34 PolarHBondContact O-N 3.05Å; A31-L35 WeakPolarHBondContact O-CB 3.47Å; A31-L35 VanDerWaalsContact O-CG 3.28Å; A31-L35 WeakPolarHBondContact O-CG 3.47Å; A31-L35 PolarHBondContact O-N 3.41Å |
| 32 | A | 97.8 | Very high | 96.5 | Very high | 54 Ų | 54 | 106.8 Ų | 106.8 | 45% | 0.446 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -64.4 | -40.2 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | V28 Q30 L35 Q36 | V28-A32 VanDerWaalsContact O-CB 3.31Å; V28-A32 WeakPolarHBondContact O-CB 3.28Å; V28-A32 PolarHBondContact O-N 3.08Å; Q30-A32 VanDerWaalsContact C-N 3.27Å; Q30-A32 PolarHBondContact O-N 2.98Å; A32-L35 PolarHBondContact O-N 3.36Å; A32-Q36 WeakPolarHBondContact O-CB 3.49Å; A32-Q36 PolarHBondContact O-N 3.12Å |
| 33 | A | 97.5 | Very high | 96.2 | Very high | 50 Ų | 50 | 103.9 Ų | 103.9 | 41% | 0.413 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -65.3 | -43.4 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | S29 Q30 Q36 Q37 | S29-A33 WeakPolarHBondContact O-CB 3.45Å; S29-A33 PolarHBondContact O-N 3.5Å; S29-A33 VanDerWaalsContact O-N 3.13Å; Q30-A33 PolarHBondContact O-N 3.15Å; Q30-A33 VanDerWaalsContact O-N 3.12Å; A33-Q36 PolarHBondContact O-N 3.2Å; A33-Q37 VanDerWaalsContact O-CB 3.31Å; A33-Q37 WeakPolarHBondContact O-CB 3.44Å; A33-Q37 PolarHBondContact O-N 3.48Å |
| 34 | E | 96.9 | Very high | 95.6 | Very high | 97 Ų | 97 | 102.6 Ų | 102.6 | 45% | 0.453 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -61.9 | -43.9 | 176.7 | -71 | 172.9 | -163.4 | 0 | 0 | 111.5 | Q30 A31 Q37 Y38 | Q30-E34 VanDerWaalsContact CG-OE1 3.28Å; Q30-E34 WeakPolarHBondContact CG-OE1 3.3Å; Q30-E34 PolarHBondContact NE2-OE1 3.47Å; Q30-E34 WeakPolarHBondContact O-CG 3.49Å; Q30-E34 PolarHBondContact O-N 3.39Å; A31-E34 PolarHBondContact O-N 3.05Å; E34-Q37 PolarHBondContact O-N 3.44Å; E34-Y38 WeakPolarHBondContact O-CB 3.28Å; E34-Y38 PolarHBondContact O-N 3.38Å |
| 35 | L | 97.6 | Very high | 95.1 | Very high | 116 Ų | 116 | 101.8 Ų | 101.8 | 61% | 0.607 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -62.4 | -45.7 | 174.9 | -72 | 173.3 | 0 | 0 | 0 | 112 | A31 A32 Q37 Y38 C39 | A31-L35 WeakPolarHBondContact O-CB 3.47Å; A31-L35 VanDerWaalsContact O-CG 3.28Å; A31-L35 WeakPolarHBondContact O-CG 3.47Å; A31-L35 PolarHBondContact O-N 3.41Å; A32-L35 PolarHBondContact O-N 3.36Å; L35-Q37 VanDerWaalsContact C-N 3.34Å; L35-Q37 PolarHBondContact O-N 2.94Å; L35-Y38 PolarHBondContact O-N 3.23Å; L35-C39 PolarHBondContact O-N 3.31Å; L35-C39 PolarHBondContact O-SG 3.48Å; L35-C39 VanDerWaalsContact O-SG 3.33Å |
| 36 | Q | 95.8 | Very high | 94.8 | Very high | 131 Ų | 131 | 95.7 Ų | 95.7 | 61% | 0.612 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -60.1 | -46.8 | 177.4 | -179.5 | -178.9 | 57.1 | 0 | 0 | 111 | A32 A33 Y38 C39 L40 | A32-Q36 WeakPolarHBondContact O-CB 3.49Å; A32-Q36 PolarHBondContact O-N 3.12Å; A33-Q36 PolarHBondContact O-N 3.2Å; Q36-Y38 VanDerWaalsContact C-N 3.32Å; Q36-Y38 PolarHBondContact O-N 2.98Å; Q36-C39 PolarHBondContact O-N 3.47Å; Q36-L40 HydrophobicContact CG-CD1 4.06Å; Q36-L40 HydrophobicContact CG-CG 4.45Å; Q36-L40 WeakPolarHBondContact O-CG 3.29Å; Q36-L40 PolarHBondContact O-N 2.83Å |
| 37 | Q | 97.3 | Very high | 94.2 | Very high | 113 Ų | 113 | 93.1 Ų | 93.1 | 53% | 0.528 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -60.8 | -42.3 | 178.9 | 177.6 | 174.8 | -4.7 | 0 | 0 | 111.3 | A33 E34 L35 L40 Q41 | A33-Q37 VanDerWaalsContact O-CB 3.31Å; A33-Q37 WeakPolarHBondContact O-CB 3.44Å; A33-Q37 PolarHBondContact O-N 3.48Å; E34-Q37 PolarHBondContact O-N 3.44Å; L35-Q37 VanDerWaalsContact C-N 3.34Å; L35-Q37 PolarHBondContact O-N 2.94Å; Q37-L40 PolarHBondContact O-N 3.15Å; Q37-Q41 VanDerWaalsContact NE2-NE2 3.17Å; Q37-Q41 VanDerWaalsContact O-CG 3.29Å; Q37-Q41 WeakPolarHBondContact O-CG 3.36Å; Q37-Q41 PolarHBondContact O-N 2.81Å |
| 38 | Y | 96.9 | Very high | 93.6 | Very high | 149 Ų | 149 | 93.4 Ų | 93.4 | 58% | 0.584 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -60.6 | -46.5 | 174.9 | 178.8 | -93.8 | 0 | 0 | 0 | 111.9 | E34 L35 Q36 L40 Q41 N42 | E34-Y38 WeakPolarHBondContact O-CB 3.28Å; E34-Y38 PolarHBondContact O-N 3.38Å; L35-Y38 PolarHBondContact O-N 3.23Å; Q36-Y38 VanDerWaalsContact C-N 3.32Å; Q36-Y38 PolarHBondContact O-N 2.98Å; Y38-L40 PolarHBondContact O-N 3.25Å; Y38-Q41 PolarHBondContact O-N 3.45Å; Y38-N42 WeakPolarHBondContact CD2-ND2 3.32Å; Y38-N42 VanDerWaalsContact CE2-ND2 3.32Å; Y38-N42 WeakPolarHBondContact CE2-ND2 3.47Å; Y38-N42 PolarHBondContact O-N 3.44Å; Y38-N42 VanDerWaalsContact O-N 3.15Å; Y38-N42 PolarHBondContact O-ND2 3.25Å |
| 39 | C | 96 | Very high | 93 | Very high | 79 Ų | 79 | 93.1 Ų | 93.1 | 53% | 0.534 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -61 | -45.2 | 177.9 | -69.6 | 0 | 0 | 0 | 0 | 111.6 | L35 Q36 Q41 N42 A43 | L35-C39 PolarHBondContact O-N 3.31Å; L35-C39 PolarHBondContact O-SG 3.48Å; L35-C39 VanDerWaalsContact O-SG 3.33Å; Q36-C39 PolarHBondContact O-N 3.47Å; C39-Q41 PolarHBondContact O-N 2.96Å; C39-N42 PolarHBondContact O-N 3.33Å; C39-A43 WeakPolarHBondContact O-CA 3.29Å; C39-A43 VanDerWaalsContact O-CB 3.29Å; C39-A43 WeakPolarHBondContact O-CB 3.46Å; C39-A43 PolarHBondContact O-N 3.26Å |
| 40 | L | 93.7 | Very high | 92.3 | Very high | 125 Ų | 125 | 93.6 Ų | 93.6 | 65% | 0.654 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -63.7 | -39.1 | 179.6 | -69.7 | 173.2 | 0 | 0 | 0 | 112.7 | Q36 Q37 Y38 N42 | Q36-L40 HydrophobicContact CG-CD1 4.06Å; Q36-L40 HydrophobicContact CG-CG 4.45Å; Q36-L40 WeakPolarHBondContact O-CG 3.29Å; Q36-L40 PolarHBondContact O-N 2.83Å; Q37-L40 PolarHBondContact O-N 3.15Å; Y38-L40 PolarHBondContact O-N 3.25Å; L40-N42 VanDerWaalsContact C-N 3.31Å; L40-N42 PolarHBondContact O-N 2.9Å |
| 41 | Q | 94.4 | Very high | 91.3 | Very high | 121 Ų | 121 | 91.1 Ų | 91.1 | 57% | 0.565 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -67.5 | -31.8 | 177.6 | -72.6 | 175.4 | 29.2 | 0 | 0 | 112.9 | Q37 Y38 C39 | Q37-Q41 VanDerWaalsContact NE2-NE2 3.17Å; Q37-Q41 VanDerWaalsContact O-CG 3.29Å; Q37-Q41 WeakPolarHBondContact O-CG 3.36Å; Q37-Q41 PolarHBondContact O-N 2.81Å; Y38-Q41 PolarHBondContact O-N 3.45Å; C39-Q41 PolarHBondContact O-N 2.96Å |
| 42 | N | 92.3 | Very high | 90.3 | Very high | 48 Ų | 48 | 92.7 Ų | 92.7 | 26% | 0.257 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -100.8 | -10.8 | -176 | -66.4 | -73.4 | 0 | 0 | 0 | 113.7 | Y38 C39 L40 G44 K45 D46 | Y38-N42 WeakPolarHBondContact CD2-ND2 3.32Å; Y38-N42 VanDerWaalsContact CE2-ND2 3.32Å; Y38-N42 WeakPolarHBondContact CE2-ND2 3.47Å; Y38-N42 PolarHBondContact O-N 3.44Å; Y38-N42 VanDerWaalsContact O-N 3.15Å; Y38-N42 PolarHBondContact O-ND2 3.25Å; C39-N42 PolarHBondContact O-N 3.33Å; L40-N42 VanDerWaalsContact C-N 3.31Å; L40-N42 PolarHBondContact O-N 2.9Å; N42-G44 PolarHBondContact O-N 3.04Å; N42-G44 VanDerWaalsContact O-N 3.17Å; N42-K45 PolarHBondContact O-N 3.17Å; N42-D46 PolarHBondContact O-N 2.79Å |
| 43 | A | 88.9 | Confident | 89 | Confident | 26 Ų | 26 | 94.4 Ų | 94.4 | 22% | 0.215 | 53% | 0.526 | C | S | . | . | G | 310 helix | trans | -50.8 | -42.2 | 179.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | C39 K45 D46 L49 V50 | C39-A43 WeakPolarHBondContact O-CA 3.29Å; C39-A43 VanDerWaalsContact O-CB 3.29Å; C39-A43 WeakPolarHBondContact O-CB 3.46Å; C39-A43 PolarHBondContact O-N 3.26Å; A43-K45 PolarHBondContact O-N 2.92Å; A43-D46 PolarHBondContact O-N 2.95Å; A43-L49 HydrophobicContact CB-CD2 3.63Å; A43-V50 VanDerWaalsContact O-CG2 3.29Å; A43-V50 WeakPolarHBondContact O-CG2 3.1Å |
| 44 | G | 85.3 | Confident | 87.4 | Confident | 63 Ų | 63 | 96.8 Ų | 96.8 | 65% | 0.649 | 54% | 0.535 | S | S | * | . | G | 310 helix | trans | -66.5 | -21 | 179.4 | 0 | 0 | 0 | 0 | 0 | 115 | N42 | N42-G44 PolarHBondContact O-N 3.04Å; N42-G44 VanDerWaalsContact O-N 3.17Å |
| 45 | K | 86.3 | Confident | 85.9 | Confident | 172 Ų | 172 | 96.2 Ų | 96.2 | 75% | 0.748 | 56% | 0.555 | S | S | * | * | G | 310 helix | trans | -95.7 | -12.2 | 179.5 | -60.8 | 175.2 | -174.2 | 167.5 | 0 | 112.2 | N42 A43 A47 | N42-K45 PolarHBondContact O-N 3.17Å; A43-K45 PolarHBondContact O-N 2.92Å; K45-A47 PolarHBondContact O-N 3.19Å |
| 46 | D | 88.8 | Confident | 84.6 | Confident | 74 Ų | 74 | 93.9 Ų | 93.9 | 40% | 0.396 | 55% | 0.549 | S | S | . | . | trans | -78.7 | 104 | 178.3 | -171.2 | -14.8 | 0 | 0 | 0 | 109.6 | N42 A43 L48 L49 V50 | N42-D46 PolarHBondContact O-N 2.79Å; A43-D46 PolarHBondContact O-N 2.95Å; D46-L48 PolarHBondContact O-N 3.24Å; D46-L48 WeakPolarHBondContact OD1-CB 3.29Å; D46-L48 PolarHBondContact OD1-N 3.21Å; D46-L49 HydrophobicContact CB-CB 3.91Å; D46-L49 PolarHBondContact O-N 3.27Å; D46-V50 PolarHBondContact O-N 2.9Å | ||
| 47 | A | 84 | Confident | 83.5 | Confident | 44 Ų | 44 | 90.4 Ų | 90.4 | 36% | 0.364 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -60 | -22.8 | 178.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | K45 G51 V52 | K45-A47 PolarHBondContact O-N 3.19Å; A47-G51 CarbonylContact O-C 3.3Å; A47-G51 VanDerWaalsContact O-C 3.3Å; A47-G51 WeakPolarHBondContact O-CA 3.33Å; A47-G51 PolarHBondContact O-N 3.47Å; A47-G51 VanDerWaalsContact O-N 3.08Å; A47-V52 HydrophobicContact CB-CG1 4.01Å; A47-V52 HydrophobicContact CB-CG2 4.24Å; A47-V52 PolarHBondContact O-N 3.08Å |
| 48 | L | 85.3 | Confident | 82.5 | Confident | 164 Ų | 164 | 90.4 Ų | 90.4 | 86% | 0.859 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -80.5 | -28.8 | 176.2 | -57.6 | -179.1 | 0 | 0 | 0 | 111.9 | D46 | D46-L48 PolarHBondContact O-N 3.24Å; D46-L48 WeakPolarHBondContact OD1-CB 3.29Å; D46-L48 PolarHBondContact OD1-N 3.21Å |
| 49 | L | 85.3 | Confident | 81.5 | Confident | 119 Ų | 119 | 92.1 Ų | 92.1 | 62% | 0.623 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -87.2 | -43.4 | -179.1 | -168.4 | 64.6 | 0 | 0 | 0 | 112.3 | A43 D46 | A43-L49 HydrophobicContact CB-CD2 3.63Å; D46-L49 HydrophobicContact CB-CB 3.91Å; D46-L49 PolarHBondContact O-N 3.27Å |
| 50 | V | 83.6 | Confident | 80.1 | Confident | 97 Ų | 97 | 94.1 Ų | 94.1 | 59% | 0.588 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -89 | -19.5 | -179.3 | -178.4 | 0 | 0 | 0 | 0 | 112.1 | A43 D46 | A43-V50 VanDerWaalsContact O-CG2 3.29Å; A43-V50 WeakPolarHBondContact O-CG2 3.1Å; D46-V50 PolarHBondContact O-N 2.9Å |
| 51 | G | 75.6 | Confident | 78.6 | Confident | 41 Ų | 41 | 96 Ų | 96 | 42% | 0.423 | 56% | 0.557 | S | S | . | * | trans | 81.2 | 146.3 | -168.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | A47 | A47-G51 CarbonylContact O-C 3.3Å; A47-G51 VanDerWaalsContact O-C 3.3Å; A47-G51 WeakPolarHBondContact O-CA 3.33Å; A47-G51 PolarHBondContact O-N 3.47Å; A47-G51 VanDerWaalsContact O-N 3.08Å | ||
| 52 | V | 77.7 | Confident | 77.1 | Confident | 63 Ų | 63 | 95.9 Ų | 95.9 | 38% | 0.382 | 57% | 0.566 | S | S | . | * | trans | -89.6 | 130.5 | 174.9 | -121.7 | 0 | 0 | 0 | 0 | 109.5 | A47 S56 N57 | A47-V52 HydrophobicContact CB-CG1 4.01Å; A47-V52 HydrophobicContact CB-CG2 4.24Å; A47-V52 PolarHBondContact O-N 3.08Å; V52-S56 WeakPolarHBondContact CG1-OG 3.44Å; V52-N57 HydrophobicContact CB-CB 4.25Å; V52-N57 HydrophobicContact CG2-CB 4.24Å | ||
| 53 | P | 69.8 | Low | 75.2 | Confident | 91 Ų | 91 | 104 Ų | 104 | 59% | 0.591 | 59% | 0.593 | S | S | * | * | trans | -51.4 | 145.2 | 169.7 | -25.1 | 31.6 | 0 | 0 | 0 | 111.5 | G55 S56 | P53-G55 PolarHBondContact O-N 3.31Å; P53-S56 WeakPolarHBondContact CD-OG 3.42Å; P53-S56 PolarHBondContact O-N 2.87Å; P53-S56 PolarHBondContact O-OG 2.97Å | ||
| 54 | T | 64.5 | Low | 73.6 | Confident | 100 Ų | 100 | 107.9 Ų | 107.9 | 61% | 0.613 | 62% | 0.619 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -57.5 | -18.7 | -168.8 | -37.5 | 0 | 0 | 0 | 0 | 114.6 | R60 | T54-R60 VanDerWaalsContact CG2-CZ 3.48Å; T54-R60 WeakPolarHBondContact O-CD 3.26Å |
| 55 | G | 64.2 | Low | 71.6 | Confident | 84 Ų | 84 | 108.4 Ų | 108.4 | 87% | 0.866 | 61% | 0.612 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -102.3 | -6 | 178.7 | 0 | 0 | 0 | 0 | 0 | 116.3 | P53 | P53-G55 PolarHBondContact O-N 3.31Š|
| 56 | S | 69.8 | Low | 69.8 | Low | 68 Ų | 68 | 104.4 Ų | 104.4 | 48% | 0.476 | 61% | 0.611 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -110.5 | 1.3 | -177.1 | 71 | 0 | 0 | 0 | 0 | 114 | V52 P53 P58 | V52-S56 WeakPolarHBondContact CG1-OG 3.44Å; P53-S56 WeakPolarHBondContact CD-OG 3.42Å; P53-S56 PolarHBondContact O-N 2.87Å; P53-S56 PolarHBondContact O-OG 2.97Å; S56-P58 VanDerWaalsContact O-CD 3.26Å; S56-P58 WeakPolarHBondContact O-CD 3.43Å |
| 57 | N | 74.1 | Confident | 68 | Low | 57 Ų | 57 | 106 Ų | 106 | 31% | 0.305 | 62% | 0.623 | S | S | . | * | trans | -80.9 | 111.5 | 175.8 | -179.9 | 0.9 | 0 | 0 | 0 | 110.3 | V52 F59 R60 | V52-N57 HydrophobicContact CB-CB 4.25Å; V52-N57 HydrophobicContact CG2-CB 4.24Å; N57-F59 PolarHBondContact O-N 2.99Å; N57-F59 PolarHBondContact OD1-N 3.26Å; N57-R60 HydrophobicContact CB-CB 4.14Å; N57-R60 WeakPolarHBondContact O-CB 3.46Å; N57-R60 PolarHBondContact O-N 3.19Å | ||
| 58 | P | 75.8 | Confident | 66 | Low | 113 Ų | 113 | 109.8 Ų | 109.8 | 73% | 0.734 | 63% | 0.631 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.3 | -16.4 | -178.1 | 29.2 | -35.4 | 0 | 0 | 0 | 113.9 | S56 | S56-P58 VanDerWaalsContact O-CD 3.26Å; S56-P58 WeakPolarHBondContact O-CD 3.43Å |
| 59 | F | 75.8 | Confident | 64.1 | Low | 185 Ų | 185 | 106.3 Ų | 106.3 | 81% | 0.811 | 62% | 0.621 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.8 | -2.3 | 177.4 | -59.9 | -75.4 | 0 | 0 | 0 | 113.2 | N57 E61 | N57-F59 PolarHBondContact O-N 2.99Å; N57-F59 PolarHBondContact OD1-N 3.26Å; F59-E61 PolarHBondContact O-N 3.45Å |
| 60 | R | 66.3 | Low | 62.3 | Low | 122 Ų | 122 | 107.6 Ų | 107.6 | 46% | 0.46 | 63% | 0.627 | S | S | . | * | S | Bend | trans | -80.4 | 121.5 | 177.1 | -156.5 | 176.2 | -163 | -102.4 | 1.4 | 108.2 | T54 N57 | T54-R60 VanDerWaalsContact CG2-CZ 3.48Å; T54-R60 WeakPolarHBondContact O-CD 3.26Å; N57-R60 HydrophobicContact CB-CB 4.14Å; N57-R60 WeakPolarHBondContact O-CB 3.46Å; N57-R60 PolarHBondContact O-N 3.19Å |
| 61 | E | 63.1 | Low | 60.4 | Low | 165 Ų | 165 | 107 Ų | 107 | 77% | 0.771 | 63% | 0.627 | S | S | * | * | P | Polyproline II helix | trans | -48.8 | 130.6 | 171.2 | -75.5 | 159.3 | 168.3 | 0 | 0 | 108.9 | F59 R63 | F59-E61 PolarHBondContact O-N 3.45Å; E61-R63 PolarHBondContact O-N 3Å |
| 62 | P | 62.2 | Low | 58.8 | Low | 117 Ų | 117 | 108 Ų | 108 | 76% | 0.76 | 63% | 0.626 | S | S | * | * | P | Polyproline II helix | trans | -52.8 | 121.9 | 170.1 | -9.5 | 18.3 | 0 | 0 | 0 | 105.2 | S64 | P62-S64 VanDerWaalsContact C-N 3.3Å; P62-S64 PolarHBondContact O-N 3.47Å |
| 63 | R | 53.9 | Low | 57.5 | Low | 219 Ų | 219 | 112 Ų | 112 | 83% | 0.826 | 65% | 0.646 | S | S | * | * | trans | -48.5 | 104.5 | 179.6 | -78.7 | -119.8 | -81.5 | 177.9 | -5.2 | 106.7 | E61 C65 | E61-R63 PolarHBondContact O-N 3Å; R63-C65 PolarHBondContact O-N 2.79Å | ||
| 64 | S | 53.8 | Low | 56.7 | Low | 108 Ų | 108 | 110.7 Ų | 110.7 | 76% | 0.755 | 64% | 0.642 | S | S | * | * | S | Bend | trans | -65.5 | 95.9 | 178.8 | 41.8 | 0 | 0 | 0 | 0 | 105 | P62 | P62-S64 VanDerWaalsContact C-N 3.3Å; P62-S64 PolarHBondContact O-N 3.47Å |
| 65 | C | 43.9 | Very low | 56 | Low | 73 Ų | 73 | 114.6 Ų | 114.6 | 49% | 0.493 | 65% | 0.654 | S | S | . | * | trans | 166 | 81.4 | 145.3 | -88.2 | 0 | 0 | 0 | 0 | 111.1 | R63 V67 F68 | R63-C65 PolarHBondContact O-N 2.79Å; C65-V67 PolarHBondContact O-N 2.68Å; C65-F68 HydrophobicContact CB-CB 3.46Å; C65-F68 VanDerWaalsContact CB-CB 3.46Å | ||
| 66 | A | 49.1 | Very low | 55.3 | Low | 88 Ų | 88 | 115.2 Ų | 115.2 | 73% | 0.727 | 65% | 0.645 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.6 | -15.2 | 144.4 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||
| 67 | V | 50.6 | Low | 54.2 | Low | 108 Ų | 108 | 119.1 Ų | 119.1 | 66% | 0.655 | 65% | 0.654 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.1 | -29.3 | -177.6 | -172.4 | 0 | 0 | 0 | 0 | 113.1 | C65 L70 C71 | C65-V67 PolarHBondContact O-N 2.68Å; V67-L70 PolarHBondContact O-N 3.28Å; V67-C71 PolarHBondContact O-N 3.44Å |
| 68 | F | 42.6 | Very low | 53.1 | Low | 123 Ų | 123 | 125.1 Ų | 125.1 | 54% | 0.539 | 68% | 0.677 | S | S | . | * | H | α-helix | trans | -75.3 | -25.1 | 178.8 | -158.4 | -97.1 | 0 | 0 | 0 | 113.1 | C65 L70 C72 | C65-F68 HydrophobicContact CB-CB 3.46Å; C65-F68 VanDerWaalsContact CB-CB 3.46Å; F68-L70 VanDerWaalsContact C-N 3.26Å; F68-L70 PolarHBondContact O-N 2.97Å; F68-C72 HydrophobicContact CD1-CB 3.92Å; F68-C72 HydrophobicContact CE1-CB 3.76Å; F68-C72 VanDerWaalsContact CE1-SG 3.58Å; F68-C72 HydrophobicContact CZ-CB 4.31Å; F68-C72 WeakPolarHBondContact O-CB 3.06Å; F68-C72 PolarHBondContact O-N 3.24Å |
| 69 | S | 44.1 | Very low | 52.1 | Low | 91 Ų | 91 | 126 Ų | 126 | 64% | 0.636 | 67% | 0.674 | S | S | * | * | H | α-helix | trans | -71 | -23.3 | 171.8 | -167.8 | 0 | 0 | 0 | 0 | 112.8 | ||
| 70 | L | 49 | Very low | 50.8 | Low | 146 Ų | 146 | 124.7 Ų | 124.7 | 76% | 0.764 | 67% | 0.672 | S | S | * | * | H | α-helix | trans | -91.2 | -32.7 | 176.6 | -76.7 | 162.1 | 0 | 0 | 0 | 112.2 | V67 F68 | V67-L70 PolarHBondContact O-N 3.28Å; F68-L70 VanDerWaalsContact C-N 3.26Å; F68-L70 PolarHBondContact O-N 2.97Å |
| 71 | C | 43.6 | Very low | 49.9 | Very low | 86 Ų | 86 | 124.3 Ų | 124.3 | 58% | 0.581 | 68% | 0.676 | S | S | * | * | H | α-helix | trans | -83.5 | -23.7 | 177.2 | -132.4 | 0 | 0 | 0 | 0 | 113.4 | V67 N73 A74 | V67-C71 PolarHBondContact O-N 3.44Å; C71-N73 PolarHBondContact O-N 3.34Å; C71-A74 PolarHBondContact O-N 2.95Å |
| 72 | C | 41.3 | Very low | 49.1 | Very low | 60 Ų | 60 | 122.4 Ų | 122.4 | 41% | 0.405 | 67% | 0.671 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -82.4 | 3.3 | 178.4 | -147.8 | 0 | 0 | 0 | 0 | 113.9 | F68 | F68-C72 HydrophobicContact CD1-CB 3.92Å; F68-C72 HydrophobicContact CE1-CB 3.76Å; F68-C72 VanDerWaalsContact CE1-SG 3.58Å; F68-C72 HydrophobicContact CZ-CB 4.31Å; F68-C72 WeakPolarHBondContact O-CB 3.06Å; F68-C72 PolarHBondContact O-N 3.24Å |
| 73 | N | 50.4 | Low | 48.4 | Very low | 148 Ų | 148 | 124.2 Ų | 124.2 | 79% | 0.791 | 67% | 0.669 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.4 | -1.1 | 164.9 | -103.1 | -47.1 | 0 | 0 | 0 | 113.5 | C71 | C71-N73 PolarHBondContact O-N 3.34Š|
| 74 | A | 53.5 | Low | 47.9 | Very low | 63 Ų | 63 | 119.2 Ų | 119.2 | 52% | 0.521 | 67% | 0.666 | S | S | . | * | S | Bend | trans | -136.2 | 103.6 | 174 | 0 | 0 | 0 | 0 | 0 | 111.6 | C71 | C71-A74 PolarHBondContact O-N 2.95Š|
| 75 | Q | 49.1 | Very low | 47.4 | Very low | 182 Ų | 182 | 121.9 Ų | 121.9 | 85% | 0.85 | 66% | 0.664 | S | S | * | * | S | Bend | trans | 86.8 | -8.5 | 146.4 | -131.7 | 68 | 16.5 | 0 | 0 | 123.6 | ||
| 76 | S | 49.9 | Very low | 47.7 | Very low | 98 Ų | 98 | 122.9 Ų | 122.9 | 69% | 0.685 | 67% | 0.672 | S | S | * | * | trans | -109.7 | 1.8 | -170.6 | -119.4 | 0 | 0 | 0 | 0 | 119.2 | K78 | S76-K78 PolarHBondContact O-N 3.49Š| ||
| 77 | F | 45.4 | Very low | 47.6 | Very low | 150 Ų | 150 | 121.5 Ų | 121.5 | 66% | 0.658 | 67% | 0.667 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.1 | -7.8 | -179.2 | -128.8 | -93.4 | 0 | 0 | 0 | 115.2 | ||
| 78 | K | 52.9 | Low | 47.1 | Very low | 182 Ų | 182 | 122.8 Ų | 122.8 | 79% | 0.791 | 68% | 0.675 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.9 | -13 | -179.5 | -95.9 | 168.2 | 178.7 | 169.4 | 0 | 114.8 | S76 | S76-K78 PolarHBondContact O-N 3.49Š|
| 79 | I | 54.3 | Low | 47.1 | Very low | 131 Ų | 131 | 125.1 Ų | 125.1 | 67% | 0.672 | 69% | 0.687 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.2 | -28.2 | -175.4 | -64.8 | 175.8 | 0 | 0 | 0 | 112.5 | ||
| 80 | M | 47.2 | Very low | 47.2 | Very low | 158 Ų | 158 | 126.9 Ų | 126.9 | 78% | 0.778 | 69% | 0.694 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.9 | -8.6 | -179.4 | -89.5 | -76.5 | -78.8 | 0 | 0 | 115.5 | ||
| 81 | Q | 48.7 | Very low | 46.8 | Very low | 115 Ų | 115 | 125.6 Ų | 125.6 | 54% | 0.537 | 70% | 0.698 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -89.4 | -24.5 | 173.3 | -87 | -120.9 | 22.2 | 0 | 0 | 113.5 | ||
| 82 | N | 46.6 | Very low | 46.5 | Very low | 125 Ų | 125 | 131.1 Ų | 131.1 | 67% | 0.668 | 74% | 0.737 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.8 | -17.9 | -178.4 | -81.9 | -21.1 | 0 | 0 | 0 | 113.9 | ||
| 83 | H | 45.9 | Very low | 46.8 | Very low | 155 Ų | 155 | 134.7 Ų | 134.7 | 72% | 0.718 | 75% | 0.754 | S | S | * | * | S | Bend | trans | -89.3 | -11.4 | 179.6 | -133.1 | -71.5 | 0 | 0 | 0 | 114.2 | ||
| 84 | C | 43.5 | Very low | 46.6 | Very low | 113 Ų | 113 | 134 Ų | 134 | 76% | 0.764 | 75% | 0.752 | S | S | * | * | S | Bend | trans | -97 | -10.1 | 179.3 | -157.2 | 0 | 0 | 0 | 0 | 113.1 | ||
| 85 | K | 44.7 | Very low | 46.2 | Very low | 165 Ų | 165 | 137.9 Ų | 137.9 | 72% | 0.717 | 77% | 0.765 | S | S | * | * | S | Bend | trans | -96.6 | -12.2 | 175.9 | -76 | -173.4 | 178.3 | -178.3 | 0 | 114.9 | ||
| 86 | S | 49.6 | Very low | 46.1 | Very low | 94 Ų | 94 | 135.4 Ų | 135.4 | 66% | 0.657 | 76% | 0.76 | S | S | * | * | S | Bend | trans | -96.8 | 8.6 | -178.2 | 50.5 | 0 | 0 | 0 | 0 | 114.5 | ||
| 87 | G | 46.2 | Very low | 45.8 | Very low | 59 Ų | 59 | 137.7 Ų | 137.7 | 61% | 0.608 | 77% | 0.765 | S | S | * | * | trans | -108.2 | 0.8 | -172.6 | 0 | 0 | 0 | 0 | 0 | 117.1 | Q89 | G87-Q89 PolarHBondContact O-N 3.48Š| ||
| 88 | T | 41.6 | Very low | 45.8 | Very low | 135 Ų | 135 | 136.9 Ų | 136.9 | 83% | 0.828 | 77% | 0.772 | S | S | * | * | S | Bend | trans | -94.4 | 97.6 | 169.7 | 30.6 | 0 | 0 | 0 | 0 | 109.2 | ||
| 89 | Q | 42.5 | Very low | 45.3 | Very low | 172 Ų | 172 | 133.6 Ų | 133.6 | 80% | 0.804 | 77% | 0.77 | S | S | * | * | trans | -58.2 | 145.2 | -177.2 | -69.7 | 177.9 | 5.1 | 0 | 0 | 113.3 | G87 | G87-Q89 PolarHBondContact O-N 3.48Š| ||
| 90 | T | 44.5 | Very low | 44.7 | Very low | 127 Ų | 127 | 133.8 Ų | 133.8 | 78% | 0.779 | 78% | 0.778 | S | S | * | * | trans | -7.5 | 120.4 | 133.8 | 51.6 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 91 | S | 42.5 | Very low | 44.4 | Very low | 120 Ų | 120 | 131.8 Ų | 131.8 | 84% | 0.839 | 78% | 0.778 | S | S | * | * | trans | -150.3 | 88.1 | 151.7 | -90.2 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 92 | S | 37.1 | Very low | 44.1 | Very low | 202 Ų | 202 | 133.4 Ų | 133.4 | 100% | 1.413 | 80% | 0.8 | S | S | * | * | trans | -175.3 | 0 | 136.6 | -73.6 | 0 | 0 | 0 | 0 | 108.5 |
Retrieved 92 of 92 residues in 113.9 ms
(Link to these results)