| 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 | 61.2 | Low | 89.4 | Confident | 208 Ų | 208 | 127.5 Ų | 127.5 | 100% | 1.025 | 63% | 0.627 | S | S | * | * | 0 | 3.3 | 0 | -122.9 | -179.2 | -132.5 | 0 | 0 | 113.2 | V3 N4 | M1-V3 PolarHBondContact O-N 3.15Å; M1-N4 PolarHBondContact O-N 3.12Å | |||
| 2 | E | 73.1 | Confident | 90 | Very high | 162 Ų | 162 | 121.3 Ų | 121.3 | 76% | 0.757 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -65.9 | -31.7 | -176.9 | -84.8 | 158.2 | 141.2 | 0 | 0 | 115.1 | N4 I5 E6 | E2-N4 PolarHBondContact O-N 3.32Å; E2-I5 PolarHBondContact O-N 3.47Å; E2-E6 PolarHBondContact O-N 3.21Å |
| 3 | V | 83.5 | Confident | 90.6 | Very high | 128 Ų | 128 | 117.8 Ų | 117.8 | 78% | 0.776 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -59.9 | -32.4 | 179 | -169.3 | 0 | 0 | 0 | 0 | 111.6 | M1 A7 | M1-V3 PolarHBondContact O-N 3.15Å; V3-A7 VanDerWaalsContact O-CB 3.25Å; V3-A7 WeakPolarHBondContact O-CB 3.31Å; V3-A7 PolarHBondContact O-N 2.96Å |
| 4 | N | 91.1 | Very high | 91 | Very high | 105 Ų | 105 | 113.7 Ų | 113.7 | 56% | 0.561 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -70.5 | -33.5 | 175.7 | -106.8 | -49.2 | 0 | 0 | 0 | 112.8 | M1 E2 R8 | M1-N4 PolarHBondContact O-N 3.12Å; E2-N4 PolarHBondContact O-N 3.32Å; N4-R8 VanDerWaalsContact O-CG 3.3Å; N4-R8 WeakPolarHBondContact O-CG 3Å; N4-R8 PolarHBondContact O-N 3.1Å |
| 5 | I | 94.8 | Very high | 91.3 | Very high | 117 Ų | 117 | 111.5 Ų | 111.5 | 60% | 0.6 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -74.3 | -44 | 178.3 | -61.3 | 171.6 | 0 | 0 | 0 | 109.5 | E2 R8 R9 | E2-I5 PolarHBondContact O-N 3.47Å; I5-R8 PolarHBondContact O-N 3.18Å; I5-R9 PolarHBondContact O-N 3.37Å |
| 6 | E | 95.4 | Very high | 91.5 | Very high | 83 Ų | 83 | 109.3 Ų | 109.3 | 39% | 0.388 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -66.6 | -38.8 | 178.1 | -167.9 | 58.8 | -153.3 | 0 | 0 | 111.5 | E2 R8 R9 I10 | E2-E6 PolarHBondContact O-N 3.21Å; E6-R8 PolarHBondContact O-N 2.83Å; E6-R9 WeakPolarHBondContact O-CB 3.41Å; E6-R9 PolarHBondContact O-N 2.95Å; E6-R9 IonicContact OE1-NH1 3.29Å; E6-R9 PolarHBondContact OE1-NH1 3.31Å; E6-R9 IonicContact OE2-NH1 3.37Å; E6-R9 PolarHBondContact OE2-NH1 3.28Å; E6-I10 HydrophobicContact CG-CD1 4.13Å; E6-I10 VanDerWaalsContact O-CG1 3.31Å; E6-I10 WeakPolarHBondContact O-CG1 3.31Å; E6-I10 PolarHBondContact O-N 3.48Å |
| 7 | A | 96.7 | Very high | 91.5 | Very high | 52 Ų | 52 | 111.5 Ų | 111.5 | 43% | 0.43 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -59.7 | -43.4 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | V3 R9 I10 L11 | V3-A7 VanDerWaalsContact O-CB 3.25Å; V3-A7 WeakPolarHBondContact O-CB 3.31Å; V3-A7 PolarHBondContact O-N 2.96Å; A7-R9 VanDerWaalsContact C-N 3.33Å; A7-R9 PolarHBondContact O-N 3.29Å; A7-I10 PolarHBondContact O-N 2.9Å; A7-L11 WeakPolarHBondContact O-CB 3.43Å; A7-L11 PolarHBondContact O-N 3.15Å |
| 8 | R | 95.8 | Very high | 91.2 | Very high | 186 Ų | 186 | 110.9 Ų | 110.9 | 70% | 0.702 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -64.3 | -37.9 | 175.5 | -72.4 | 174.7 | -173.1 | -158.7 | 1.7 | 112 | N4 I5 E6 L11 A12 | N4-R8 VanDerWaalsContact O-CG 3.3Å; N4-R8 WeakPolarHBondContact O-CG 3Å; N4-R8 PolarHBondContact O-N 3.1Å; I5-R8 PolarHBondContact O-N 3.18Å; E6-R8 PolarHBondContact O-N 2.83Å; R8-L11 PolarHBondContact O-N 3.36Å; R8-A12 WeakPolarHBondContact O-CB 3.26Å; R8-A12 PolarHBondContact O-N 2.97Å |
| 9 | R | 97.1 | Very high | 91 | Very high | 157 Ų | 157 | 113.2 Ų | 113.2 | 59% | 0.592 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -65.1 | -47.6 | 176 | -175.4 | -173.1 | 177.8 | -155.4 | 2.4 | 111.7 | I5 E6 A7 L11 A12 V13 | I5-R9 PolarHBondContact O-N 3.37Å; E6-R9 WeakPolarHBondContact O-CB 3.41Å; E6-R9 PolarHBondContact O-N 2.95Å; E6-R9 IonicContact OE1-NH1 3.29Å; E6-R9 PolarHBondContact OE1-NH1 3.31Å; E6-R9 IonicContact OE2-NH1 3.37Å; E6-R9 PolarHBondContact OE2-NH1 3.28Å; A7-R9 VanDerWaalsContact C-N 3.33Å; A7-R9 PolarHBondContact O-N 3.29Å; R9-L11 VanDerWaalsContact C-N 3.29Å; R9-L11 PolarHBondContact O-N 3.5Å; R9-A12 PolarHBondContact O-N 3.08Å; R9-V13 WeakPolarHBondContact O-CG2 3.37Å; R9-V13 PolarHBondContact O-N 3.34Å |
| 10 | I | 97.1 | Very high | 90.5 | Very high | 103 Ų | 103 | 111 Ų | 111 | 53% | 0.528 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -59.1 | -43.4 | 176.6 | -68.1 | 167.8 | 0 | 0 | 0 | 110.2 | E6 A7 V13 S14 | E6-I10 HydrophobicContact CG-CD1 4.13Å; E6-I10 VanDerWaalsContact O-CG1 3.31Å; E6-I10 WeakPolarHBondContact O-CG1 3.31Å; E6-I10 PolarHBondContact O-N 3.48Å; A7-I10 PolarHBondContact O-N 2.9Å; I10-V13 PolarHBondContact O-N 3.36Å; I10-S14 WeakPolarHBondContact O-CB 3.39Å; I10-S14 PolarHBondContact O-N 3.15Å; I10-S14 PolarHBondContact O-OG 3.47Å |
| 11 | L | 97.6 | Very high | 90.1 | Very high | 102 Ų | 102 | 108.3 Ų | 108.3 | 53% | 0.534 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -61.8 | -45.3 | 176.4 | -175.5 | 152.9 | 0 | 0 | 0 | 112.2 | A7 R8 R9 V13 S14 I15 | A7-L11 WeakPolarHBondContact O-CB 3.43Å; A7-L11 PolarHBondContact O-N 3.15Å; R8-L11 PolarHBondContact O-N 3.36Å; R9-L11 VanDerWaalsContact C-N 3.29Å; R9-L11 PolarHBondContact O-N 3.5Å; L11-V13 VanDerWaalsContact C-N 3.33Å; L11-V13 PolarHBondContact O-N 3.43Å; L11-S14 WeakPolarHBondContact CA-OG 3.48Å; L11-S14 PolarHBondContact O-N 2.88Å; L11-S14 PolarHBondContact O-OG 3.13Å; L11-I15 HydrophobicContact CD2-CD1 3.48Å; L11-I15 VanDerWaalsContact CD2-CD1 3.48Å; L11-I15 HydrophobicContact CD2-CG1 4.36Å; L11-I15 HydrophobicContact CG-CD1 4.28Å; L11-I15 VanDerWaalsContact O-CG1 3.32Å; L11-I15 WeakPolarHBondContact O-CG1 3.36Å; L11-I15 PolarHBondContact O-N 3.41Å |
| 12 | A | 97.2 | Very high | 90.9 | Very high | 52 Ų | 52 | 107.4 Ų | 107.4 | 43% | 0.43 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -62.8 | -41 | 178 | 0 | 0 | 0 | 0 | 0 | 112.1 | R8 R9 S16 | R8-A12 WeakPolarHBondContact O-CB 3.26Å; R8-A12 PolarHBondContact O-N 2.97Å; R9-A12 PolarHBondContact O-N 3.08Å; A12-S16 WeakPolarHBondContact O-CB 3.37Å; A12-S16 PolarHBondContact O-N 2.91Å; A12-S16 VanDerWaalsContact O-N 3.12Å; A12-S16 PolarHBondContact O-OG 3.3Å |
| 13 | V | 97 | Very high | 90.7 | Very high | 77 Ų | 77 | 103.9 Ų | 103.9 | 47% | 0.467 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -67.9 | -42.5 | 177.5 | 173 | 0 | 0 | 0 | 0 | 111.1 | R9 I10 L11 S16 K17 | R9-V13 WeakPolarHBondContact O-CG2 3.37Å; R9-V13 PolarHBondContact O-N 3.34Å; I10-V13 PolarHBondContact O-N 3.36Å; L11-V13 VanDerWaalsContact C-N 3.33Å; L11-V13 PolarHBondContact O-N 3.43Å; V13-S16 PolarHBondContact O-N 3.11Å; V13-K17 HydrophobicContact CG1-CD 4.04Å; V13-K17 HydrophobicContact CG1-CG 4.39Å; V13-K17 WeakPolarHBondContact O-CG 3.23Å; V13-K17 PolarHBondContact O-N 3Å |
| 14 | S | 96.6 | Very high | 90.1 | Very high | 60 Ų | 60 | 105.5 Ų | 105.5 | 42% | 0.42 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -65.7 | -41.8 | -179.3 | 65.6 | 0 | 0 | 0 | 0 | 112 | I10 L11 S16 K17 L18 | I10-S14 WeakPolarHBondContact O-CB 3.39Å; I10-S14 PolarHBondContact O-N 3.15Å; I10-S14 PolarHBondContact O-OG 3.47Å; L11-S14 WeakPolarHBondContact CA-OG 3.48Å; L11-S14 PolarHBondContact O-N 2.88Å; L11-S14 PolarHBondContact O-OG 3.13Å; S14-S16 PolarHBondContact O-N 3.5Å; S14-K17 PolarHBondContact O-N 3.33Å; S14-L18 WeakPolarHBondContact O-CB 3.36Å; S14-L18 PolarHBondContact O-N 3.39Å |
| 15 | I | 95.7 | Very high | 89 | Confident | 80 Ų | 80 | 111.7 Ų | 111.7 | 41% | 0.41 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -58.9 | -48.8 | 172.7 | -69.2 | 176 | 0 | 0 | 0 | 110.2 | L11 K17 L18 Y19 | L11-I15 HydrophobicContact CD2-CD1 3.48Å; L11-I15 VanDerWaalsContact CD2-CD1 3.48Å; L11-I15 HydrophobicContact CD2-CG1 4.36Å; L11-I15 HydrophobicContact CG-CD1 4.28Å; L11-I15 VanDerWaalsContact O-CG1 3.32Å; L11-I15 WeakPolarHBondContact O-CG1 3.36Å; L11-I15 PolarHBondContact O-N 3.41Å; I15-K17 VanDerWaalsContact C-N 3.32Å; I15-K17 PolarHBondContact O-N 2.89Å; I15-L18 WeakPolarHBondContact O-CB 3.38Å; I15-L18 PolarHBondContact O-N 2.9Å; I15-L18 VanDerWaalsContact O-N 3.12Å; I15-Y19 HydrophobicContact CG2-CD2 3.67Å; I15-Y19 HydrophobicContact CG2-CE2 3.66Å; I15-Y19 VanDerWaalsContact O-CD2 3.32Å; I15-Y19 WeakPolarHBondContact O-CD2 3.25Å; I15-Y19 PolarHBondContact O-N 2.92Å |
| 16 | S | 93.8 | Very high | 88.2 | Confident | 77 Ų | 77 | 108.4 Ų | 108.4 | 54% | 0.538 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -59.5 | -42.4 | 179.6 | -58.7 | 0 | 0 | 0 | 0 | 112.1 | A12 V13 S14 L18 Y19 A20 | A12-S16 WeakPolarHBondContact O-CB 3.37Å; A12-S16 PolarHBondContact O-N 2.91Å; A12-S16 VanDerWaalsContact O-N 3.12Å; A12-S16 PolarHBondContact O-OG 3.3Å; V13-S16 PolarHBondContact O-N 3.11Å; S14-S16 PolarHBondContact O-N 3.5Å; S16-L18 VanDerWaalsContact C-N 3.34Å; S16-L18 PolarHBondContact O-N 3.11Å; S16-Y19 PolarHBondContact O-N 2.98Å; S16-A20 WeakPolarHBondContact O-CB 2.88Å; S16-A20 PolarHBondContact O-N 3.37Å |
| 17 | K | 92.6 | Very high | 87.7 | Confident | 146 Ų | 146 | 105.1 Ų | 105.1 | 64% | 0.635 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -65.2 | -36.6 | 176.1 | -72.3 | -179.5 | 72.9 | 173.1 | 0 | 112.3 | V13 S14 I15 A20 S21 | V13-K17 HydrophobicContact CG1-CD 4.04Å; V13-K17 HydrophobicContact CG1-CG 4.39Å; V13-K17 WeakPolarHBondContact O-CG 3.23Å; V13-K17 PolarHBondContact O-N 3Å; S14-K17 PolarHBondContact O-N 3.33Å; I15-K17 VanDerWaalsContact C-N 3.32Å; I15-K17 PolarHBondContact O-N 2.89Å; K17-A20 PolarHBondContact O-N 3.09Å; K17-S21 VanDerWaalsContact O-CB 3.3Å; K17-S21 WeakPolarHBondContact O-CB 3.19Å; K17-S21 PolarHBondContact O-N 2.96Å; K17-S21 PolarHBondContact O-OG 3.19Å; K17-S21 VanDerWaalsContact O-OG 3.08Å |
| 18 | L | 86.1 | Confident | 87 | Confident | 102 Ų | 102 | 108.8 Ų | 108.8 | 53% | 0.534 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -66 | -44.4 | 176.1 | -176.7 | 148.3 | 0 | 0 | 0 | 111.5 | S14 I15 S16 S21 R22 | S14-L18 WeakPolarHBondContact O-CB 3.36Å; S14-L18 PolarHBondContact O-N 3.39Å; I15-L18 WeakPolarHBondContact O-CB 3.38Å; I15-L18 PolarHBondContact O-N 2.9Å; I15-L18 VanDerWaalsContact O-N 3.12Å; S16-L18 VanDerWaalsContact C-N 3.34Å; S16-L18 PolarHBondContact O-N 3.11Å; L18-S21 PolarHBondContact O-N 2.92Å; L18-S21 PolarHBondContact O-OG 3.18Å; L18-R22 WeakPolarHBondContact O-CB 3.36Å; L18-R22 PolarHBondContact O-N 3.13Å; L18-R22 VanDerWaalsContact O-N 3.11Å |
| 19 | Y | 86.9 | Confident | 86.4 | Confident | 154 Ų | 154 | 110.6 Ų | 110.6 | 60% | 0.604 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -66.3 | -38.3 | 176.2 | -84 | -80.4 | 0 | 0 | 0 | 112.4 | I15 S16 | I15-Y19 HydrophobicContact CG2-CD2 3.67Å; I15-Y19 HydrophobicContact CG2-CE2 3.66Å; I15-Y19 VanDerWaalsContact O-CD2 3.32Å; I15-Y19 WeakPolarHBondContact O-CD2 3.25Å; I15-Y19 PolarHBondContact O-N 2.92Å; S16-Y19 PolarHBondContact O-N 2.98Å |
| 20 | A | 81.4 | Confident | 86 | Confident | 68 Ų | 68 | 106.9 Ų | 106.9 | 56% | 0.562 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -69.9 | -35.1 | 177.5 | 0 | 0 | 0 | 0 | 0 | 113.2 | S16 K17 T23 | S16-A20 WeakPolarHBondContact O-CB 2.88Å; S16-A20 PolarHBondContact O-N 3.37Å; K17-A20 PolarHBondContact O-N 3.09Å; A20-T23 PolarHBondContact O-OG1 3.1Å |
| 21 | S | 81 | Confident | 85.6 | Confident | 56 Ų | 56 | 107.1 Ų | 107.1 | 39% | 0.392 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -83.7 | -18.6 | -178.5 | 69.8 | 0 | 0 | 0 | 0 | 113.6 | K17 L18 T23 Q24 | K17-S21 VanDerWaalsContact O-CB 3.3Å; K17-S21 WeakPolarHBondContact O-CB 3.19Å; K17-S21 PolarHBondContact O-N 2.96Å; K17-S21 PolarHBondContact O-OG 3.19Å; K17-S21 VanDerWaalsContact O-OG 3.08Å; L18-S21 PolarHBondContact O-N 2.92Å; L18-S21 PolarHBondContact O-OG 3.18Å; S21-T23 PolarHBondContact O-N 3.05Å; S21-Q24 WeakPolarHBondContact O-CB 3.33Å; S21-Q24 PolarHBondContact O-N 3.49Å |
| 22 | R | 77.6 | Confident | 85.3 | Confident | 189 Ų | 189 | 111.6 Ų | 111.6 | 71% | 0.713 | 56% | 0.557 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -55.9 | -24.1 | 177 | -166 | 172.9 | -173.9 | 164.7 | 1.9 | 112.7 | L18 | L18-R22 WeakPolarHBondContact O-CB 3.36Å; L18-R22 PolarHBondContact O-N 3.13Å; L18-R22 VanDerWaalsContact O-N 3.11Å |
| 23 | T | 69.4 | Low | 85.1 | Confident | 87 Ų | 87 | 111.7 Ų | 111.7 | 53% | 0.534 | 56% | 0.555 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -101.6 | 8.6 | 176.5 | 53.2 | 0 | 0 | 0 | 0 | 114.2 | A20 S21 G27 | A20-T23 PolarHBondContact O-OG1 3.1Å; S21-T23 PolarHBondContact O-N 3.05Å; T23-G27 VanDerWaalsContact C-CA 3.46Å; T23-G27 WeakPolarHBondContact O-CA 3.35Å |
| 24 | Q | 70.6 | Confident | 84.8 | Confident | 162 Ų | 162 | 113 Ų | 113 | 76% | 0.757 | 56% | 0.559 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -98.5 | -30.9 | -173.3 | -152.5 | 170.7 | 18.4 | 0 | 0 | 113.2 | S21 | S21-Q24 WeakPolarHBondContact O-CB 3.33Å; S21-Q24 PolarHBondContact O-N 3.49Å |
| 25 | R | 68.3 | Low | 84.7 | Confident | 236 Ų | 236 | 114.1 Ų | 114.1 | 89% | 0.891 | 56% | 0.559 | S | S | * | * | S | Bend | trans | -98.2 | 98.9 | 170.5 | -160.8 | 168.1 | 179.5 | 136.5 | -2.2 | 109.2 | G27 | R25-G27 PolarHBondContact O-N 2.78Š|
| 26 | G | 78.5 | Confident | 84.8 | Confident | 47 Ų | 47 | 115.3 Ų | 115.3 | 49% | 0.485 | 57% | 0.566 | S | S | . | * | S | Bend | trans | 83.1 | -26.7 | -176.8 | 0 | 0 | 0 | 0 | 0 | 115.6 | L30 | G26-L30 WeakPolarHBondContact O-CB 3.47Å; G26-L30 PolarHBondContact O-N 3.04Å |
| 27 | G | 84.9 | Confident | 85 | Confident | 15 Ų | 15 | 115.3 Ų | 115.3 | 16% | 0.155 | 57% | 0.566 | C | S | . | * | H | α-helix | trans | 59.4 | -162.4 | 167.7 | 0 | 0 | 0 | 0 | 0 | 117.8 | T23 R25 R29 L30 H31 | T23-G27 VanDerWaalsContact C-CA 3.46Å; T23-G27 WeakPolarHBondContact O-CA 3.35Å; R25-G27 PolarHBondContact O-N 2.78Å; G27-R29 PolarHBondContact O-N 2.95Å; G27-R29 VanDerWaalsContact O-N 3.16Å; G27-L30 PolarHBondContact O-N 2.88Å; G27-L30 VanDerWaalsContact O-N 3.14Å; G27-H31 PolarHBondContact O-N 2.87Å |
| 28 | L | 82.4 | Confident | 85.2 | Confident | 128 Ų | 128 | 113.9 Ų | 113.9 | 67% | 0.67 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -57.4 | -29.3 | 179.7 | -172.8 | 65.9 | 0 | 0 | 0 | 111.7 | R32 | L28-R32 VanDerWaalsContact O-CB 3.31Å; L28-R32 WeakPolarHBondContact O-CB 3.34Å; L28-R32 PolarHBondContact O-N 3.32Å |
| 29 | R | 81.8 | Confident | 85.8 | Confident | 224 Ų | 224 | 112.9 Ų | 112.9 | 85% | 0.845 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -65.4 | -49.8 | 175.9 | -68.7 | 179.6 | 63.9 | -160.7 | -1.3 | 111.8 | G27 H31 R32 S33 | G27-R29 PolarHBondContact O-N 2.95Å; G27-R29 VanDerWaalsContact O-N 3.16Å; R29-H31 VanDerWaalsContact C-N 3.35Å; R29-R32 PolarHBondContact O-N 2.98Å; R29-S33 PolarHBondContact O-N 3.14Å; R29-S33 PolarHBondContact O-OG 3.16Å |
| 30 | L | 89.1 | Confident | 86.3 | Confident | 80 Ų | 80 | 109.9 Ų | 109.9 | 42% | 0.419 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -64.5 | -40.9 | 175.8 | -178.8 | 64.4 | 0 | 0 | 0 | 111.1 | G26 G27 R32 S33 L34 | G26-L30 WeakPolarHBondContact O-CB 3.47Å; G26-L30 PolarHBondContact O-N 3.04Å; G27-L30 PolarHBondContact O-N 2.88Å; G27-L30 VanDerWaalsContact O-N 3.14Å; L30-R32 PolarHBondContact O-N 3.37Å; L30-S33 WeakPolarHBondContact CA-OG 3.39Å; L30-S33 PolarHBondContact O-N 3.49Å; L30-S33 PolarHBondContact O-OG 2.95Å; L30-L34 HydrophobicContact CD1-CD1 3.4Å; L30-L34 HydrophobicContact CG-CD1 3.83Å; L30-L34 WeakPolarHBondContact O-CB 3.35Å; L30-L34 WeakPolarHBondContact O-CD1 3.28Å; L30-L34 PolarHBondContact O-N 2.98Å |
| 31 | H | 89.1 | Confident | 87.1 | Confident | 108 Ų | 108 | 112.3 Ų | 112.3 | 50% | 0.5 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -58.5 | -47.3 | 175.6 | 179.9 | 57 | 0 | 0 | 0 | 111.6 | G27 R29 S33 L34 L35 | G27-H31 PolarHBondContact O-N 2.87Å; R29-H31 VanDerWaalsContact C-N 3.35Å; H31-S33 PolarHBondContact O-N 2.95Å; H31-L34 PolarHBondContact O-N 3.26Å; H31-L35 WeakPolarHBondContact NE2-CD1 3.35Å; H31-L35 WeakPolarHBondContact O-CB 3.25Å; H31-L35 WeakPolarHBondContact O-CG 3.44Å; H31-L35 PolarHBondContact O-N 2.97Å |
| 32 | R | 92 | Very high | 87.9 | Confident | 196 Ų | 196 | 112.2 Ų | 112.2 | 74% | 0.74 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -63.3 | -41.3 | 177 | -172.3 | 176.2 | -175.9 | -177.5 | 1.3 | 112.1 | L28 R29 L30 L35 L36 | L28-R32 VanDerWaalsContact O-CB 3.31Å; L28-R32 WeakPolarHBondContact O-CB 3.34Å; L28-R32 PolarHBondContact O-N 3.32Å; R29-R32 PolarHBondContact O-N 2.98Å; L30-R32 PolarHBondContact O-N 3.37Å; R32-L35 PolarHBondContact O-N 3.45Å; R32-L36 WeakPolarHBondContact O-CB 3.49Å; R32-L36 PolarHBondContact O-N 2.94Å |
| 33 | S | 91.7 | Very high | 88.8 | Confident | 54 Ų | 54 | 105.6 Ų | 105.6 | 38% | 0.378 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -65.9 | -42.2 | 177.4 | 61.9 | 0 | 0 | 0 | 0 | 111.8 | R29 L30 H31 L36 S37 | R29-S33 PolarHBondContact O-N 3.14Å; R29-S33 PolarHBondContact O-OG 3.16Å; L30-S33 WeakPolarHBondContact CA-OG 3.39Å; L30-S33 PolarHBondContact O-N 3.49Å; L30-S33 PolarHBondContact O-OG 2.95Å; H31-S33 PolarHBondContact O-N 2.95Å; S33-L36 PolarHBondContact O-N 2.9Å; S33-S37 PolarHBondContact O-N 2.98Å; S33-S37 PolarHBondContact O-OG 3.02Å; S33-S37 VanDerWaalsContact O-OG 3.08Å |
| 34 | L | 92.2 | Very high | 90.2 | Very high | 105 Ų | 105 | 108.4 Ų | 108.4 | 55% | 0.55 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -62.6 | -44.4 | 175.6 | -97.7 | 67.4 | 0 | 0 | 0 | 111.9 | L30 H31 L36 S37 L38 | L30-L34 HydrophobicContact CD1-CD1 3.4Å; L30-L34 HydrophobicContact CG-CD1 3.83Å; L30-L34 WeakPolarHBondContact O-CB 3.35Å; L30-L34 WeakPolarHBondContact O-CD1 3.28Å; L30-L34 PolarHBondContact O-N 2.98Å; H31-L34 PolarHBondContact O-N 3.26Å; L34-L36 VanDerWaalsContact C-N 3.34Å; L34-L36 PolarHBondContact O-N 2.95Å; L34-S37 PolarHBondContact O-N 3.21Å; L34-L38 PolarHBondContact O-N 3.4Å |
| 35 | L | 94.4 | Very high | 91.4 | Very high | 83 Ų | 83 | 104.9 Ų | 104.9 | 44% | 0.435 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -59.2 | -45.9 | 175.5 | -75.6 | 175.9 | 0 | 0 | 0 | 111.3 | H31 R32 S37 L38 V39 | H31-L35 WeakPolarHBondContact NE2-CD1 3.35Å; H31-L35 WeakPolarHBondContact O-CB 3.25Å; H31-L35 WeakPolarHBondContact O-CG 3.44Å; H31-L35 PolarHBondContact O-N 2.97Å; R32-L35 PolarHBondContact O-N 3.45Å; L35-S37 PolarHBondContact O-N 3.26Å; L35-L38 PolarHBondContact O-N 2.93Å; L35-V39 WeakPolarHBondContact O-CG2 3.42Å; L35-V39 PolarHBondContact O-N 3.08Å |
| 36 | L | 96.9 | Very high | 92.7 | Very high | 105 Ų | 105 | 99 Ų | 99 | 55% | 0.55 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -62 | -43.3 | 177.1 | -178.1 | 61.9 | 0 | 0 | 0 | 111.5 | R32 S33 L34 L38 V39 M40 | R32-L36 WeakPolarHBondContact O-CB 3.49Å; R32-L36 PolarHBondContact O-N 2.94Å; S33-L36 PolarHBondContact O-N 2.9Å; L34-L36 VanDerWaalsContact C-N 3.34Å; L34-L36 PolarHBondContact O-N 2.95Å; L36-L38 VanDerWaalsContact C-N 3.32Å; L36-L38 PolarHBondContact O-N 3.32Å; L36-V39 PolarHBondContact O-N 2.94Å; L36-M40 HydrophobicContact CD1-CE 4.43Å; L36-M40 HydrophobicContact CD1-CG 4.11Å; L36-M40 HydrophobicContact CG-CG 4.32Å; L36-M40 WeakPolarHBondContact O-CB 3.3Å; L36-M40 VanDerWaalsContact O-CG 3.26Å; L36-M40 WeakPolarHBondContact O-CG 3.49Å; L36-M40 PolarHBondContact O-N 2.76Å |
| 37 | S | 97.1 | Very high | 93.6 | Very high | 76 Ų | 76 | 104 Ų | 104 | 53% | 0.531 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -60.3 | -40.9 | 175.8 | -64 | 0 | 0 | 0 | 0 | 112.3 | S33 L34 L35 K41 | S33-S37 PolarHBondContact O-N 2.98Å; S33-S37 PolarHBondContact O-OG 3.02Å; S33-S37 VanDerWaalsContact O-OG 3.08Å; L34-S37 PolarHBondContact O-N 3.21Å; L35-S37 PolarHBondContact O-N 3.26Å; S37-K41 WeakPolarHBondContact O-CB 3.44Å; S37-K41 PolarHBondContact O-N 2.85Å |
| 38 | L | 97.7 | Very high | 94 | Very high | 117 Ų | 117 | 107.5 Ų | 107.5 | 61% | 0.613 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -64.9 | -45.8 | 177.2 | -175.2 | 63.9 | 0 | 0 | 0 | 111.6 | L34 L35 L36 K41 S42 | L34-L38 PolarHBondContact O-N 3.4Å; L35-L38 PolarHBondContact O-N 2.93Å; L36-L38 VanDerWaalsContact C-N 3.32Å; L36-L38 PolarHBondContact O-N 3.32Å; L38-K41 PolarHBondContact O-N 3.49Å; L38-S42 PolarHBondContact O-N 3.11Å; L38-S42 PolarHBondContact O-OG 2.71Å |
| 39 | V | 98 | Very high | 94.5 | Very high | 81 Ų | 81 | 104.6 Ų | 104.6 | 49% | 0.491 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -64.6 | -42.5 | 178.1 | 172.8 | 0 | 0 | 0 | 0 | 111.6 | L35 L36 K41 S42 A43 | L35-V39 WeakPolarHBondContact O-CG2 3.42Å; L35-V39 PolarHBondContact O-N 3.08Å; L36-V39 PolarHBondContact O-N 2.94Å; V39-K41 VanDerWaalsContact C-N 3.33Å; V39-K41 PolarHBondContact O-N 3.08Å; V39-S42 PolarHBondContact O-N 3.03Å; V39-S42 PolarHBondContact O-OG 3.47Å; V39-A43 VanDerWaalsContact O-CB 3.31Å; V39-A43 WeakPolarHBondContact O-CB 3.38Å; V39-A43 PolarHBondContact O-N 2.94Å |
| 40 | M | 98.3 | Very high | 94.8 | Very high | 91 Ų | 91 | 96.9 Ų | 96.9 | 45% | 0.448 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -66.5 | -36.4 | 176.7 | -70.3 | -63.9 | 98.1 | 0 | 0 | 112.1 | L36 R44 | L36-M40 HydrophobicContact CD1-CE 4.43Å; L36-M40 HydrophobicContact CD1-CG 4.11Å; L36-M40 HydrophobicContact CG-CG 4.32Å; L36-M40 WeakPolarHBondContact O-CB 3.3Å; L36-M40 VanDerWaalsContact O-CG 3.26Å; L36-M40 WeakPolarHBondContact O-CG 3.49Å; L36-M40 PolarHBondContact O-N 2.76Å; M40-R44 WeakPolarHBondContact O-CG 3.35Å; M40-R44 PolarHBondContact O-N 3.47Å; M40-R44 VanDerWaalsContact O-N 3.13Å; M40-R44 PolarHBondContact O-NE 2.96Å |
| 41 | K | 97.8 | Very high | 94.7 | Very high | 118 Ų | 118 | 101.2 Ų | 101.2 | 51% | 0.513 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -62.2 | -53.6 | 172.1 | 175.6 | 170.9 | 168.9 | 166.4 | 0 | 110.9 | S37 L38 V39 A43 R44 D45 | S37-K41 WeakPolarHBondContact O-CB 3.44Å; S37-K41 PolarHBondContact O-N 2.85Å; L38-K41 PolarHBondContact O-N 3.49Å; V39-K41 VanDerWaalsContact C-N 3.33Å; V39-K41 PolarHBondContact O-N 3.08Å; K41-A43 VanDerWaalsContact C-N 3.29Å; K41-A43 PolarHBondContact O-N 3.26Å; K41-R44 PolarHBondContact O-N 3.2Å; K41-R44 VanDerWaalsContact O-N 3.11Å; K41-D45 PolarHBondContact O-N 3.26Å |
| 42 | S | 97.7 | Very high | 94 | Very high | 55 Ų | 55 | 103 Ų | 103 | 39% | 0.385 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -60.9 | -37.8 | -179.6 | 62.2 | 0 | 0 | 0 | 0 | 112.8 | L38 V39 D45 I46 | L38-S42 PolarHBondContact O-N 3.11Å; L38-S42 PolarHBondContact O-OG 2.71Å; V39-S42 PolarHBondContact O-N 3.03Å; V39-S42 PolarHBondContact O-OG 3.47Å; S42-D45 PolarHBondContact O-N 2.94Å; S42-I46 VanDerWaalsContact O-CG1 3.28Å; S42-I46 WeakPolarHBondContact O-CG1 3.44Å; S42-I46 PolarHBondContact O-N 3.12Å |
| 43 | A | 97.7 | Very high | 92.8 | Very high | 50 Ų | 50 | 98 Ų | 98 | 41% | 0.413 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -62.6 | -42.2 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | V39 K41 Y47 | V39-A43 VanDerWaalsContact O-CB 3.31Å; V39-A43 WeakPolarHBondContact O-CB 3.38Å; V39-A43 PolarHBondContact O-N 2.94Å; K41-A43 VanDerWaalsContact C-N 3.29Å; K41-A43 PolarHBondContact O-N 3.26Å; A43-Y47 WeakPolarHBondContact O-CB 3.48Å; A43-Y47 PolarHBondContact O-N 2.98Å |
| 44 | R | 97.2 | Very high | 91.4 | Very high | 146 Ų | 146 | 102.5 Ų | 102.5 | 55% | 0.551 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -64.1 | -44.3 | 173.7 | -74.3 | -177.8 | -66.5 | -148.4 | 1.5 | 111.8 | M40 K41 I46 Y47 H48 | M40-R44 WeakPolarHBondContact O-CG 3.35Å; M40-R44 PolarHBondContact O-N 3.47Å; M40-R44 VanDerWaalsContact O-N 3.13Å; M40-R44 PolarHBondContact O-NE 2.96Å; K41-R44 PolarHBondContact O-N 3.2Å; K41-R44 VanDerWaalsContact O-N 3.11Å; R44-I46 VanDerWaalsContact C-N 3.3Å; R44-I46 PolarHBondContact O-N 3.34Å; R44-Y47 PolarHBondContact O-N 2.79Å; R44-H48 PolarHBondContact O-CD2 3.29Å; R44-H48 PolarHBondContact O-N 2.92Å |
| 45 | D | 95.7 | Very high | 89.5 | Confident | 87 Ų | 87 | 100.7 Ų | 100.7 | 47% | 0.465 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -60.7 | -40.4 | 179.8 | -61.8 | -15.4 | 0 | 0 | 0 | 111.2 | K41 S42 S49 | K41-D45 PolarHBondContact O-N 3.26Å; S42-D45 PolarHBondContact O-N 2.94Å; D45-S49 VanDerWaalsContact O-CB 3.25Å; D45-S49 WeakPolarHBondContact O-CB 3.39Å; D45-S49 PolarHBondContact O-N 3.12Å; D45-S49 PolarHBondContact O-OG 3.5Å |
| 46 | I | 96.8 | Very high | 87.3 | Confident | 114 Ų | 114 | 102.1 Ų | 102.1 | 59% | 0.585 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -68.9 | -43.3 | 175.2 | -65.7 | 164.9 | 0 | 0 | 0 | 111.2 | S42 R44 S49 S50 | S42-I46 VanDerWaalsContact O-CG1 3.28Å; S42-I46 WeakPolarHBondContact O-CG1 3.44Å; S42-I46 PolarHBondContact O-N 3.12Å; R44-I46 VanDerWaalsContact C-N 3.3Å; R44-I46 PolarHBondContact O-N 3.34Å; I46-S49 WeakPolarHBondContact CA-OG 3.45Å; I46-S49 PolarHBondContact O-OG 3.32Å; I46-S49 VanDerWaalsContact O-OG 3.1Å; I46-S50 VanDerWaalsContact O-CB 3.25Å; I46-S50 WeakPolarHBondContact O-CB 3.35Å; I46-S50 PolarHBondContact O-N 3.49Å |
| 47 | Y | 96.3 | Very high | 85.3 | Confident | 152 Ų | 152 | 103.6 Ų | 103.6 | 60% | 0.596 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -62.2 | -45.9 | -180 | 177 | -100.9 | 0 | 0 | 0 | 112.1 | A43 R44 R51 | A43-Y47 WeakPolarHBondContact O-CB 3.48Å; A43-Y47 PolarHBondContact O-N 2.98Å; R44-Y47 PolarHBondContact O-N 2.79Å; Y47-R51 WeakPolarHBondContact O-CB 3.32Å; Y47-R51 PolarHBondContact O-N 3.36Å; Y47-R51 VanDerWaalsContact O-N 3.09Å |
| 48 | H | 94.8 | Very high | 82.6 | Confident | 87 Ų | 87 | 103.4 Ų | 103.4 | 40% | 0.403 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -70.6 | -43.9 | 178.9 | -72.9 | -66.1 | 0 | 0 | 0 | 112.1 | R44 S50 R51 E52 | R44-H48 PolarHBondContact O-CD2 3.29Å; R44-H48 PolarHBondContact O-N 2.92Å; H48-S50 VanDerWaalsContact C-N 3.31Å; H48-S50 PolarHBondContact O-N 2.84Å; H48-R51 PolarHBondContact O-N 3.41Å; H48-R51 VanDerWaalsContact O-N 3.11Å; H48-E52 WeakPolarHBondContact O-CB 3.46Å; H48-E52 WeakPolarHBondContact O-CG 3.21Å; H48-E52 PolarHBondContact O-N 2.79Å |
| 49 | S | 92.3 | Very high | 80 | Confident | 67 Ų | 67 | 101.1 Ų | 101.1 | 47% | 0.469 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -62.1 | -38.3 | 177.3 | 58.9 | 0 | 0 | 0 | 0 | 112.6 | D45 I46 S53 | D45-S49 VanDerWaalsContact O-CB 3.25Å; D45-S49 WeakPolarHBondContact O-CB 3.39Å; D45-S49 PolarHBondContact O-N 3.12Å; D45-S49 PolarHBondContact O-OG 3.5Å; I46-S49 WeakPolarHBondContact CA-OG 3.45Å; I46-S49 PolarHBondContact O-OG 3.32Å; I46-S49 VanDerWaalsContact O-OG 3.1Å; S49-S53 WeakPolarHBondContact O-CB 3.36Å; S49-S53 PolarHBondContact O-N 3.44Å; S49-S53 PolarHBondContact O-OG 3.26Å |
| 50 | S | 88.7 | Confident | 77.4 | Confident | 63 Ų | 63 | 105.2 Ų | 105.2 | 44% | 0.441 | 60% | 0.595 | S | S | . | * | H | α-helix | trans | -67 | -34.9 | 173.8 | 179.7 | 0 | 0 | 0 | 0 | 113.1 | I46 H48 S53 E54 | I46-S50 VanDerWaalsContact O-CB 3.25Å; I46-S50 WeakPolarHBondContact O-CB 3.35Å; I46-S50 PolarHBondContact O-N 3.49Å; H48-S50 VanDerWaalsContact C-N 3.31Å; H48-S50 PolarHBondContact O-N 2.84Å; S50-S53 WeakPolarHBondContact CA-OG 3.45Å; S50-S53 PolarHBondContact O-OG 3.28Å; S50-E54 WeakPolarHBondContact O-CB 3.32Å; S50-E54 VanDerWaalsContact O-CG 3.23Å; S50-E54 WeakPolarHBondContact O-CG 3.44Å; S50-E54 PolarHBondContact O-N 2.97Å; S50-E54 VanDerWaalsContact O-N 3.13Å |
| 51 | R | 86.8 | Confident | 75 | Confident | 170 Ų | 170 | 107 Ų | 107 | 64% | 0.642 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -77.3 | -32.9 | -179.7 | -167.4 | -178.3 | 169 | -135.2 | -5.5 | 112.2 | Y47 H48 | Y47-R51 WeakPolarHBondContact O-CB 3.32Å; Y47-R51 PolarHBondContact O-N 3.36Å; Y47-R51 VanDerWaalsContact O-N 3.09Å; H48-R51 PolarHBondContact O-N 3.41Å; H48-R51 VanDerWaalsContact O-N 3.11Å |
| 52 | E | 75.1 | Confident | 72.3 | Confident | 145 Ų | 145 | 105.1 Ų | 105.1 | 68% | 0.678 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -71.9 | -32 | 172.9 | -71 | 166 | -161.7 | 0 | 0 | 111.6 | H48 | H48-E52 WeakPolarHBondContact O-CB 3.46Å; H48-E52 WeakPolarHBondContact O-CG 3.21Å; H48-E52 PolarHBondContact O-N 2.79Å |
| 53 | S | 66 | Low | 70.4 | Confident | 91 Ų | 91 | 108 Ų | 108 | 64% | 0.636 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -77.7 | -26.8 | 175.4 | 64.2 | 0 | 0 | 0 | 0 | 114.5 | S49 S50 A55 | S49-S53 WeakPolarHBondContact O-CB 3.36Å; S49-S53 PolarHBondContact O-N 3.44Å; S49-S53 PolarHBondContact O-OG 3.26Å; S50-S53 WeakPolarHBondContact CA-OG 3.45Å; S50-S53 PolarHBondContact O-OG 3.28Å; S53-A55 VanDerWaalsContact C-N 3.3Å |
| 54 | E | 61 | Low | 68 | Low | 149 Ų | 149 | 114 Ų | 114 | 70% | 0.696 | 66% | 0.66 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.1 | 8.3 | 177.4 | -72.2 | -74.6 | 147.3 | 0 | 0 | 113 | S50 P56 | S50-E54 WeakPolarHBondContact O-CB 3.32Å; S50-E54 VanDerWaalsContact O-CG 3.23Å; S50-E54 WeakPolarHBondContact O-CG 3.44Å; S50-E54 PolarHBondContact O-N 2.97Å; S50-E54 VanDerWaalsContact O-N 3.13Å; E54-P56 WeakPolarHBondContact O-CD 3.49Å |
| 55 | A | 53.3 | Low | 65.4 | Low | 68 Ų | 68 | 115.2 Ų | 115.2 | 56% | 0.562 | 67% | 0.672 | S | S | * | * | trans | -87.2 | 101.8 | 169.8 | 0 | 0 | 0 | 0 | 0 | 109.8 | S53 S57 | S53-A55 VanDerWaalsContact C-N 3.3Å; A55-S57 PolarHBondContact O-N 3.37Å | ||
| 56 | P | 48.5 | Very low | 63.7 | Low | 113 Ų | 113 | 116.1 Ų | 116.1 | 73% | 0.734 | 68% | 0.682 | S | S | * | * | trans | -65.2 | 135.6 | 158.3 | 29.5 | -31.4 | 0 | 0 | 0 | 107.6 | E54 G58 | E54-P56 WeakPolarHBondContact O-CD 3.49Å; P56-G58 PolarHBondContact O-N 3.23Å | ||
| 57 | S | 53.7 | Low | 61.1 | Low | 136 Ų | 136 | 118.9 Ų | 118.9 | 95% | 0.951 | 69% | 0.694 | S | S | * | * | S | Bend | trans | -31.3 | 109 | 164.5 | -179.9 | 0 | 0 | 0 | 0 | 111.2 | A55 | A55-S57 PolarHBondContact O-N 3.37Š|
| 58 | G | 40.6 | Very low | 58.5 | Low | 71 Ų | 71 | 119.1 Ų | 119.1 | 73% | 0.732 | 71% | 0.706 | S | S | * | * | trans | -175.5 | 70.1 | -169 | 0 | 0 | 0 | 0 | 0 | 113 | P56 | P56-G58 PolarHBondContact O-N 3.23Š| ||
| 59 | G | 43.2 | Very low | 55.9 | Low | 70 Ų | 70 | 121.3 Ų | 121.3 | 72% | 0.722 | 73% | 0.726 | S | S | * | * | trans | 59.6 | 113.9 | 142.3 | 0 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 60 | L | 44.1 | Very low | 53.3 | Low | 167 Ų | 167 | 123.3 Ų | 123.3 | 87% | 0.874 | 74% | 0.74 | S | S | * | * | trans | 66.9 | 92 | 143.6 | -50 | 176.9 | 0 | 0 | 0 | 118.1 | ||||
| 61 | S | 47.3 | Very low | 50.9 | Low | 128 Ų | 128 | 126.2 Ų | 126.2 | 90% | 0.895 | 76% | 0.76 | S | S | * | * | trans | -100.9 | 83.7 | 130.8 | 66.3 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 62 | A | 41.4 | Very low | 48.9 | Very low | 79 Ų | 79 | 123 Ų | 123 | 65% | 0.653 | 76% | 0.763 | S | S | * | * | trans | -72.2 | 154.6 | 166 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 63 | P | 57.3 | Low | 47.6 | Very low | 115 Ų | 115 | 121.4 Ų | 121.4 | 75% | 0.747 | 77% | 0.766 | S | S | * | * | trans | -87.8 | 164 | -168.7 | 37.5 | -33.9 | 0 | 0 | 0 | 112.7 | ||||
| 64 | E | 47 | Very low | 46 | Very low | 177 Ų | 177 | 123.3 Ų | 123.3 | 83% | 0.827 | 77% | 0.773 | S | S | * | * | trans | 63.7 | 124.2 | 165.4 | -65.3 | -158.6 | 126.9 | 0 | 0 | 118.8 | ||||
| 65 | E | 44.5 | Very low | 45.2 | Very low | 171 Ų | 171 | 122.5 Ų | 122.5 | 80% | 0.799 | 77% | 0.773 | S | S | * | * | -170.8 | 143.5 | 90.8 | -96 | -162.6 | 151.2 | 0 | 0 | 112.5 | |||||
| 66 | P | 58.3 | Low | 44.6 | Very low | 105 Ų | 105 | 124.8 Ų | 124.8 | 68% | 0.682 | 78% | 0.782 | S | S | * | * | trans | -79.1 | 119 | 167.6 | 31.6 | -29.6 | 0 | 0 | 0 | 110.3 | D68 | P66-D68 PolarHBondContact O-N 2.87Š| ||
| 67 | M | 43.7 | Very low | 44 | Very low | 172 Ų | 172 | 126.6 Ų | 126.6 | 85% | 0.847 | 78% | 0.781 | S | S | * | * | trans | -88.9 | 93.4 | 174.5 | -73.8 | -128.7 | -81.9 | 0 | 0 | 111.1 | ||||
| 68 | D | 40.4 | Very low | 43.4 | Very low | 157 Ų | 157 | 124.7 Ų | 124.7 | 84% | 0.84 | 77% | 0.765 | S | S | * | * | trans | -99.4 | 97.6 | 156.6 | -79.8 | -50.9 | 0 | 0 | 0 | 108.8 | P66 S70 | P66-D68 PolarHBondContact O-N 2.87Å; D68-S70 PolarHBondContact O-N 2.92Å; D68-S70 VanDerWaalsContact O-N 3.12Å | ||
| 69 | T | 39.9 | Very low | 43.2 | Very low | 133 Ų | 133 | 129.8 Ų | 129.8 | 82% | 0.816 | 77% | 0.77 | S | S | * | * | trans | -79.2 | 92.4 | 169.9 | 23 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 70 | S | 38.2 | Very low | 43.1 | Very low | 109 Ų | 109 | 131.2 Ų | 131.2 | 76% | 0.762 | 77% | 0.767 | S | S | * | * | trans | 24.9 | 104.9 | 135.6 | -171.1 | 0 | 0 | 0 | 0 | 117.7 | D68 | D68-S70 PolarHBondContact O-N 2.92Å; D68-S70 VanDerWaalsContact O-N 3.12Å | ||
| 71 | S | 39.4 | Very low | 42.8 | Very low | 125 Ų | 125 | 131.4 Ų | 131.4 | 87% | 0.874 | 76% | 0.763 | S | S | * | * | trans | -145 | 97.3 | 132.4 | -164.4 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 72 | S | 44 | Very low | 42.5 | Very low | 101 Ų | 101 | 131.3 Ų | 131.3 | 71% | 0.706 | 76% | 0.759 | S | S | * | * | trans | -117.9 | 154.6 | 153.7 | 71.1 | 0 | 0 | 0 | 0 | 106.6 | ||||
| 73 | P | 47.3 | Very low | 42.5 | Very low | 113 Ų | 113 | 134.4 Ų | 134.4 | 73% | 0.734 | 76% | 0.764 | S | S | * | * | -141.7 | 152.4 | 81.5 | 36.8 | -18.8 | 0 | 0 | 0 | 110.5 | |||||
| 74 | V | 32.2 | Very low | 41.3 | Very low | 130 Ų | 130 | 133.8 Ų | 133.8 | 79% | 0.788 | 76% | 0.763 | S | S | * | * | -177.6 | 133.1 | 70.9 | 164.2 | 0 | 0 | 0 | 0 | 105.8 | |||||
| 75 | L | 45.8 | Very low | 40.5 | Very low | 132 Ų | 132 | 132.1 Ų | 132.1 | 69% | 0.691 | 76% | 0.759 | S | S | * | * | trans | -113.6 | 147.2 | 162.8 | -167.1 | 81.6 | 0 | 0 | 0 | 107.5 | E77 | L75-E77 HydrophobicContact CD2-CB 3.75Å; L75-E77 HydrophobicContact CG-CB 4.16Å | ||
| 76 | P | 39.9 | Very low | 39.9 | Very low | 116 Ų | 116 | 134 Ų | 134 | 75% | 0.753 | 76% | 0.759 | S | S | * | * | -137.6 | 118.6 | 104.2 | 22.9 | -3.7 | 0 | 0 | 0 | 110.7 | |||||
| 77 | E | 35.8 | Very low | 38.7 | Very low | 151 Ų | 151 | 136.4 Ų | 136.4 | 71% | 0.706 | 77% | 0.766 | S | S | * | * | 53.8 | 146.7 | 79.1 | -158.9 | 154.8 | 178.4 | 0 | 0 | 115 | L75 | L75-E77 HydrophobicContact CD2-CB 3.75Å; L75-E77 HydrophobicContact CG-CB 4.16Å | |||
| 78 | P | 42 | Very low | 38.2 | Very low | 96 Ų | 96 | 132.7 Ų | 132.7 | 62% | 0.623 | 76% | 0.757 | S | S | * | * | cis | -132.2 | 166.8 | -25.9 | 29.7 | -10.6 | 0 | 0 | 0 | 116.3 | ||||
| 79 | Q | 35.5 | Very low | 38 | Very low | 178 Ų | 178 | 131.1 Ų | 131.1 | 83% | 0.832 | 76% | 0.759 | S | S | * | * | trans | 71.8 | 163.4 | 145.1 | -66.3 | -97.2 | -43.9 | 0 | 0 | 120.8 | ||||
| 80 | P | 41.6 | Very low | 37.6 | Very low | 101 Ų | 101 | 132.7 Ų | 132.7 | 66% | 0.656 | 76% | 0.757 | S | S | * | * | cis | -127.1 | 171.1 | -29.3 | 26.9 | -6.4 | 0 | 0 | 0 | 113.1 | ||||
| 81 | E | 38.2 | Very low | 37.4 | Very low | 171 Ų | 171 | 134.4 Ų | 134.4 | 80% | 0.799 | 76% | 0.763 | S | S | * | * | trans | -57 | 154.2 | 163.2 | -60.9 | -170.4 | 168 | 0 | 0 | 112 | ||||
| 82 | P | 39.7 | Very low | 37.1 | Very low | 125 Ų | 125 | 134 Ų | 134 | 81% | 0.812 | 76% | 0.755 | S | S | * | * | -130.5 | 138.2 | 129.4 | 33.9 | -22.8 | 0 | 0 | 0 | 112.6 | |||||
| 83 | L | 41.2 | Very low | 36.5 | Very low | 144 Ų | 144 | 134.9 Ų | 134.9 | 75% | 0.754 | 76% | 0.756 | S | S | * | * | trans | -58.9 | 164.9 | 163.3 | -67.8 | 167.4 | 0 | 0 | 0 | 111.8 | ||||
| 84 | S | 33.5 | Very low | 36.1 | Very low | 103 Ų | 103 | 138.1 Ų | 138.1 | 72% | 0.72 | 76% | 0.761 | S | S | * | * | trans | 87.1 | 139.2 | 147.2 | 55.8 | 0 | 0 | 0 | 0 | 120.2 | ||||
| 85 | D | 28.7 | Very low | 36.4 | Very low | 141 Ų | 141 | 140.7 Ų | 140.7 | 75% | 0.754 | 77% | 0.765 | S | S | * | * | trans | 94.7 | 96.7 | 153.8 | -59.8 | -25.9 | 0 | 0 | 0 | 119.6 | ||||
| 86 | R | 32.7 | Very low | 36.1 | Very low | 212 Ų | 212 | 140.1 Ų | 140.1 | 80% | 0.8 | 77% | 0.772 | S | S | * | * | 69.2 | 112.7 | 108.8 | -173.9 | 173.2 | 151.4 | -163.9 | -5 | 116.7 | |||||
| 87 | N | 32.1 | Very low | 35.9 | Very low | 155 Ų | 155 | 141 Ų | 141 | 83% | 0.829 | 77% | 0.77 | S | S | * | * | trans | -154.3 | 103.9 | 136.1 | -101.4 | 5 | 0 | 0 | 0 | 107.6 | ||||
| 88 | S | 33.4 | Very low | 36.1 | Very low | 94 Ų | 94 | 139 Ų | 139 | 66% | 0.657 | 77% | 0.773 | S | S | * | * | 55.8 | 96.2 | 96.6 | -84.7 | 0 | 0 | 0 | 0 | 113.4 | |||||
| 89 | S | 35.9 | Very low | 36 | Very low | 124 Ų | 124 | 143.3 Ų | 143.3 | 87% | 0.867 | 78% | 0.782 | S | S | * | * | trans | -108.6 | 114 | 135 | 49.2 | 0 | 0 | 0 | 0 | 106.5 | ||||
| 90 | E | 32.7 | Very low | 36.4 | Very low | 166 Ų | 166 | 141.5 Ų | 141.5 | 78% | 0.776 | 78% | 0.783 | S | S | * | * | trans | -68.7 | 130.9 | 175.3 | -66.9 | 170.2 | 132 | 0 | 0 | 109.6 | ||||
| 91 | T | 32.8 | Very low | 36.6 | Very low | 145 Ų | 145 | 143.6 Ų | 143.6 | 89% | 0.89 | 78% | 0.784 | S | S | * | * | trans | -132.5 | 103.9 | 141.3 | 50.8 | 0 | 0 | 0 | 0 | 107.2 | ||||
| 92 | V | 34.5 | Very low | 36.8 | Very low | 116 Ų | 116 | 142.4 Ų | 142.4 | 70% | 0.703 | 78% | 0.783 | S | S | * | * | trans | -61.8 | 162.1 | 169.7 | 175.1 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 93 | T | 31.2 | Very low | 36.8 | Very low | 119 Ų | 119 | 144.7 Ų | 144.7 | 73% | 0.73 | 78% | 0.776 | S | S | * | * | trans | 103.3 | 109.8 | 154.4 | -32.9 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 94 | E | 38.4 | Very low | 37.1 | Very low | 181 Ų | 181 | 145.1 Ų | 145.1 | 85% | 0.846 | 78% | 0.779 | S | S | * | * | cis | -152 | 164.5 | -1.2 | -63.1 | -153.1 | 135 | 0 | 0 | 109.7 | ||||
| 95 | E | 39.6 | Very low | 37.5 | Very low | 184 Ų | 184 | 148.8 Ų | 148.8 | 86% | 0.86 | 78% | 0.783 | S | S | * | * | trans | -62.2 | 152.7 | 168.2 | -72.6 | -159.5 | 142.5 | 0 | 0 | 114 | ||||
| 96 | S | 38.9 | Very low | 38.1 | Very low | 121 Ų | 121 | 147.8 Ų | 147.8 | 85% | 0.846 | 78% | 0.777 | S | S | * | * | -157.4 | 121.9 | 120.8 | -167.7 | 0 | 0 | 0 | 0 | 111 | |||||
| 97 | D | 34.9 | Very low | 38.8 | Very low | 133 Ų | 133 | 141.8 Ų | 141.8 | 71% | 0.711 | 77% | 0.765 | S | S | * | * | trans | -50.9 | 137.4 | 167.9 | 176.1 | 35.4 | 0 | 0 | 0 | 114.2 | ||||
| 98 | S | 39.4 | Very low | 39.5 | Very low | 109 Ų | 109 | 139.6 Ų | 139.6 | 76% | 0.762 | 76% | 0.757 | S | S | * | * | 179.8 | 115.8 | 126.3 | 63 | 0 | 0 | 0 | 0 | 112.3 | |||||
| 99 | K | 40.3 | Very low | 40.4 | Very low | 187 Ų | 187 | 144 Ų | 144 | 81% | 0.813 | 77% | 0.767 | S | S | * | * | trans | -42.2 | 132.5 | 159.7 | 176.7 | -177 | -175.2 | 178 | 0 | 115 | ||||
| 100 | V | 44.3 | Very low | 41.2 | Very low | 140 Ų | 140 | 145 Ų | 145 | 85% | 0.848 | 76% | 0.758 | S | S | * | * | -166.2 | 128.2 | 129.4 | -100.1 | 0 | 0 | 0 | 0 | 110.8 | |||||
| 101 | E | 45.4 | Very low | 42.5 | Very low | 145 Ų | 145 | 147.1 Ų | 147.1 | 68% | 0.678 | 77% | 0.765 | S | S | * | * | trans | -62 | 132.7 | 165 | -62.7 | -79.9 | 153.2 | 0 | 0 | 110.2 | Y103 | E101-Y103 HydrophobicContact CB-CE1 4.09Š| ||
| 102 | D | 43.2 | Very low | 43.7 | Very low | 146 Ų | 146 | 147.2 Ų | 147.2 | 78% | 0.781 | 76% | 0.755 | S | S | * | * | trans | -145.6 | 138.2 | 146.8 | -166 | 29.3 | 0 | 0 | 0 | 109.6 | ||||
| 103 | Y | 39.1 | Very low | 44.9 | Very low | 173 Ų | 173 | 148.8 Ų | 148.8 | 68% | 0.678 | 76% | 0.759 | S | S | * | * | trans | -98.4 | 116.4 | -163.6 | -31.9 | -93.9 | 0 | 0 | 0 | 106.9 | E101 | E101-Y103 HydrophobicContact CB-CE1 4.09Š| ||
| 104 | D | 47.7 | Very low | 46 | Very low | 153 Ų | 153 | 150.8 Ų | 150.8 | 82% | 0.818 | 77% | 0.765 | S | S | * | * | trans | -133.1 | 93.2 | 161.2 | -161.9 | 31.7 | 0 | 0 | 0 | 109.1 | D106 | D104-D106 PolarHBondContact O-N 3.37Š| ||
| 105 | F | 41.5 | Very low | 47.1 | Very low | 181 Ų | 181 | 146.7 Ų | 146.7 | 79% | 0.794 | 76% | 0.756 | S | S | * | * | trans | -78.1 | 106.9 | 163.1 | 171.3 | -91.2 | 0 | 0 | 0 | 106.4 | ||||
| 106 | D | 42.4 | Very low | 47.7 | Very low | 119 Ų | 119 | 144.3 Ų | 144.3 | 64% | 0.636 | 76% | 0.757 | S | S | * | * | trans | -149.7 | 109.2 | 143.5 | -117.3 | -25.9 | 0 | 0 | 0 | 111.2 | D104 | D104-D106 PolarHBondContact O-N 3.37Š| ||
| 107 | T | 47 | Very low | 48.3 | Very low | 87 Ų | 87 | 142.5 Ų | 142.5 | 53% | 0.534 | 75% | 0.749 | S | S | . | * | 63.9 | 112.3 | 126.8 | 52.3 | 0 | 0 | 0 | 0 | 120.7 | |||||
| 108 | T | 46.1 | Very low | 49.4 | Very low | 109 Ų | 109 | 147.5 Ų | 147.5 | 67% | 0.669 | 76% | 0.758 | S | S | * | * | 68.7 | 103.7 | 127 | 52.3 | 0 | 0 | 0 | 0 | 119.3 | |||||
| 109 | E | 52.7 | Low | 50.3 | Low | 185 Ų | 185 | 151.8 Ų | 151.8 | 86% | 0.864 | 77% | 0.766 | S | S | * | * | 66.7 | 146.1 | 111.2 | -65.2 | -179.5 | -165.5 | 0 | 0 | 120.6 | |||||
| 110 | E | 53.3 | Low | 51 | Low | 145 Ų | 145 | 148.3 Ų | 148.3 | 68% | 0.678 | 77% | 0.765 | S | S | * | * | trans | 90.1 | 65.7 | 160.1 | -143.4 | -178.2 | 167.3 | 0 | 0 | 118.1 | E112 | E110-E112 HydrophobicContact CG-CB 3.81Å; E110-E112 PolarHBondContact O-N 3Å | ||
| 111 | K | 59.8 | Low | 52 | Low | 212 Ų | 212 | 152.4 Ų | 152.4 | 92% | 0.922 | 77% | 0.766 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.6 | 52.7 | 155.8 | -75.4 | -163 | 171.8 | 179.3 | 0 | 112.7 | ||
| 112 | E | 57.7 | Low | 52.5 | Low | 147 Ų | 147 | 155.4 Ų | 155.4 | 69% | 0.687 | 78% | 0.776 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.2 | -17.4 | 176.5 | -178.8 | 163 | 146.8 | 0 | 0 | 113.4 | E110 L114 | E110-E112 HydrophobicContact CG-CB 3.81Å; E110-E112 PolarHBondContact O-N 3Å; E112-L114 PolarHBondContact O-N 3.44Å; E112-L114 VanDerWaalsContact O-N 3.1Å |
| 113 | N | 60.4 | Low | 53.6 | Low | 148 Ų | 148 | 159.7 Ų | 159.7 | 79% | 0.791 | 78% | 0.781 | S | S | * | * | trans | -92.2 | 47.7 | -171.8 | -71 | -74.1 | 0 | 0 | 0 | 115.2 | S115 | N113-S115 PolarHBondContact O-N 3.42Å; N113-S115 VanDerWaalsContact O-N 3.15Å | ||
| 114 | L | 54.9 | Low | 54.7 | Low | 161 Ų | 161 | 163.8 Ų | 163.8 | 84% | 0.843 | 80% | 0.796 | S | S | * | * | trans | -81.8 | 88.5 | 162.7 | -68.2 | 179.1 | 0 | 0 | 0 | 109.4 | E112 | E112-L114 PolarHBondContact O-N 3.44Å; E112-L114 VanDerWaalsContact O-N 3.1Å | ||
| 115 | S | 60.1 | Low | 55.3 | Low | 95 Ų | 95 | 159.7 Ų | 159.7 | 66% | 0.664 | 79% | 0.79 | S | S | * | * | trans | -42.9 | 140.1 | 173.5 | 60.2 | 0 | 0 | 0 | 0 | 112.8 | N113 A117 | N113-S115 PolarHBondContact O-N 3.42Å; N113-S115 VanDerWaalsContact O-N 3.15Å; S115-A117 PolarHBondContact O-N 3.25Å | ||
| 116 | P | 51.7 | Low | 56.2 | Low | 134 Ų | 134 | 160.7 Ų | 160.7 | 87% | 0.87 | 79% | 0.794 | S | S | * | * | trans | -59.9 | 101.9 | 169.4 | -24.1 | 34.5 | 0 | 0 | 0 | 110.7 | R118 | P116-R118 PolarHBondContact O-N 3.04Å; P116-R118 VanDerWaalsContact O-N 3.15Å | ||
| 117 | A | 52.5 | Low | 56.9 | Low | 83 Ų | 83 | 159.7 Ų | 159.7 | 69% | 0.686 | 80% | 0.802 | S | S | * | * | trans | -58.7 | 116.7 | 174.7 | 0 | 0 | 0 | 0 | 0 | 109.9 | S115 | S115-A117 PolarHBondContact O-N 3.25Š| ||
| 118 | R | 58 | Low | 57.3 | Low | 238 Ų | 238 | 161.3 Ų | 161.3 | 90% | 0.898 | 82% | 0.817 | S | S | * | * | trans | 43.5 | 93.8 | 148.4 | -62.5 | -176.6 | 164.1 | -161.4 | -3.6 | 116.7 | P116 | P116-R118 PolarHBondContact O-N 3.04Å; P116-R118 VanDerWaalsContact O-N 3.15Å | ||
| 119 | Q | 59.1 | Low | 57.9 | Low | 199 Ų | 199 | 160.5 Ų | 160.5 | 93% | 0.93 | 82% | 0.821 | S | S | * | * | trans | -111.3 | 93.6 | 150.3 | -63.6 | -166.8 | 6.1 | 0 | 0 | 110.3 | R121 | Q119-R121 PolarHBondContact O-N 2.95Š| ||
| 120 | S | 54.8 | Low | 58.2 | Low | 115 Ų | 115 | 155.6 Ų | 155.6 | 80% | 0.804 | 81% | 0.812 | S | S | * | * | trans | -62.5 | 119 | 167.5 | -177.1 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 121 | R | 64.8 | Low | 58.6 | Low | 226 Ų | 226 | 153.6 Ų | 153.6 | 85% | 0.853 | 81% | 0.812 | S | S | * | * | trans | -164.6 | 109.9 | 131.7 | -159.7 | 163.2 | -77.8 | 171.5 | -4.9 | 111.6 | Q119 R123 | Q119-R121 PolarHBondContact O-N 2.95Å; R121-R123 PolarHBondContact O-N 3.01Å | ||
| 122 | K | 55 | Low | 58.9 | Low | 207 Ų | 207 | 150.6 Ų | 150.6 | 90% | 0.9 | 81% | 0.806 | S | S | * | * | trans | -56.6 | 115.1 | 167.5 | -68.5 | 172 | 177.1 | 175.9 | 0 | 109.8 | ||||
| 123 | R | 66.4 | Low | 59 | Low | 236 Ų | 236 | 152.2 Ų | 152.2 | 89% | 0.891 | 81% | 0.811 | S | S | * | * | trans | -110.1 | 99.9 | 154.6 | -75.2 | -174.8 | 69.5 | -157.6 | 0.7 | 108 | R121 G125 | R121-R123 PolarHBondContact O-N 3.01Å; R123-G125 PolarHBondContact O-N 3.48Å | ||
| 124 | R | 62 | Low | 59.2 | Low | 259 Ų | 259 | 151.9 Ų | 151.9 | 98% | 0.977 | 81% | 0.808 | S | S | * | * | trans | -74.2 | 107.2 | 166.2 | -174.7 | 176.9 | -166.8 | -129.9 | 2.4 | 107.5 | ||||
| 125 | G | 60.8 | Low | 59.3 | Low | 67 Ų | 67 | 149.6 Ų | 149.6 | 69% | 0.691 | 80% | 0.803 | S | S | * | * | trans | -151.7 | 76.3 | -179.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | R123 | R123-G125 PolarHBondContact O-N 3.48Š| ||
| 126 | K | 60.2 | Low | 59.3 | Low | 203 Ų | 203 | 150.9 Ų | 150.9 | 88% | 0.883 | 81% | 0.812 | S | S | * | * | trans | 33.4 | 112.6 | 146.8 | -61.7 | 166.4 | 179.5 | 177.4 | 0 | 118.6 | ||||
| 127 | A | 57.6 | Low | 59.6 | Low | 97 Ų | 97 | 153.5 Ų | 153.5 | 80% | 0.802 | 81% | 0.81 | S | S | * | * | trans | 33.3 | 114.4 | 143.9 | 0 | 0 | 0 | 0 | 0 | 119.5 | A129 | A127-A129 PolarHBondContact O-N 3.46Š| ||
| 128 | S | 56.3 | Low | 59.8 | Low | 122 Ų | 122 | 160.9 Ų | 160.9 | 85% | 0.853 | 82% | 0.82 | S | S | * | * | 22.7 | 82.9 | 129.1 | -176 | 0 | 0 | 0 | 0 | 116.5 | |||||
| 129 | A | 58.5 | Low | 59.7 | Low | 92 Ų | 92 | 153.5 Ų | 153.5 | 76% | 0.76 | 81% | 0.809 | S | S | * | * | trans | -97.2 | 114.6 | 139.8 | 0 | 0 | 0 | 0 | 0 | 105.3 | A127 | A127-A129 PolarHBondContact O-N 3.46Š| ||
| 130 | A | 58.8 | Low | 59.6 | Low | 81 Ų | 81 | 154 Ų | 154 | 67% | 0.669 | 80% | 0.803 | S | S | * | * | trans | -48.7 | 132.9 | 173.7 | 0 | 0 | 0 | 0 | 0 | 108.5 | D132 | A130-D132 PolarHBondContact O-N 2.99Š| ||
| 131 | P | 60.3 | Low | 59.4 | Low | 103 Ų | 103 | 155.5 Ų | 155.5 | 67% | 0.669 | 80% | 0.801 | S | S | * | * | trans | -63.5 | 117.7 | 180 | 28.3 | -33.7 | 0 | 0 | 0 | 107.5 | F133 | P131-F133 HydrophobicContact CB-CD2 3.88Å; P131-F133 HydrophobicContact CB-CE2 4.13Å; P131-F133 PolarHBondContact O-N 3.07Å | ||
| 132 | D | 66.9 | Low | 58.9 | Low | 149 Ų | 149 | 149.4 Ų | 149.4 | 80% | 0.797 | 78% | 0.782 | S | S | * | * | trans | -75.4 | 64.2 | -172 | -157.3 | 11.8 | 0 | 0 | 0 | 110.6 | A130 | A130-D132 PolarHBondContact O-N 2.99Š| ||
| 133 | F | 59.9 | Low | 58.8 | Low | 182 Ų | 182 | 145.2 Ų | 145.2 | 80% | 0.798 | 78% | 0.776 | S | S | * | * | trans | -106 | 35.4 | 172.7 | -69.5 | -74.5 | 0 | 0 | 0 | 111 | P131 | P131-F133 HydrophobicContact CB-CD2 3.88Å; P131-F133 HydrophobicContact CB-CE2 4.13Å; P131-F133 PolarHBondContact O-N 3.07Å | ||
| 134 | L | 63.9 | Low | 58.2 | Low | 141 Ų | 141 | 136.2 Ų | 136.2 | 74% | 0.738 | 76% | 0.757 | S | S | * | * | S | Bend | trans | -94.7 | 117.1 | 163.6 | -67.7 | 176.6 | 0 | 0 | 0 | 107.1 | S136 | L134-S136 PolarHBondContact O-N 2.74Š|
| 135 | P | 58.7 | Low | 57.8 | Low | 113 Ų | 113 | 129.2 Ų | 129.2 | 73% | 0.734 | 74% | 0.736 | S | S | * | * | trans | -54.5 | 115.3 | 167.9 | -17.7 | 28.9 | 0 | 0 | 0 | 106.8 | K137 | P135-K137 PolarHBondContact O-N 3.47Š| ||
| 136 | S | 58.4 | Low | 57.5 | Low | 121 Ų | 121 | 132.5 Ų | 132.5 | 85% | 0.846 | 73% | 0.733 | S | S | * | * | trans | -72.6 | 54 | -179 | 63.9 | 0 | 0 | 0 | 0 | 110.8 | L134 R138 | L134-S136 PolarHBondContact O-N 2.74Å; S136-R138 VanDerWaalsContact C-N 3.27Å; S136-R138 PolarHBondContact O-N 3.22Å; S136-R138 VanDerWaalsContact O-N 3.08Å | ||
| 137 | K | 59.4 | Low | 57.2 | Low | 189 Ų | 189 | 131.7 Ų | 131.7 | 82% | 0.822 | 72% | 0.724 | S | S | * | * | trans | -82.2 | 77.4 | 170.3 | -82 | -167.9 | 175.6 | -176.8 | 0 | 108.6 | P135 A139 | P135-K137 PolarHBondContact O-N 3.47Å; K137-A139 PolarHBondContact O-N 3.24Å | ||
| 138 | R | 55.2 | Low | 56.9 | Low | 239 Ų | 239 | 135.1 Ų | 135.1 | 90% | 0.902 | 72% | 0.721 | S | S | * | * | trans | -79.1 | 82 | 147.4 | -61.8 | -171 | -158.7 | -151.6 | 5.9 | 106.7 | S136 R140 | S136-R138 VanDerWaalsContact C-N 3.27Å; S136-R138 PolarHBondContact O-N 3.22Å; S136-R138 VanDerWaalsContact O-N 3.08Å; R138-R140 PolarHBondContact O-N 3.02Å | ||
| 139 | A | 56.4 | Low | 57 | Low | 82 Ų | 82 | 137.2 Ų | 137.2 | 68% | 0.678 | 71% | 0.71 | S | S | * | * | trans | -73.2 | 88.3 | 159.8 | 0 | 0 | 0 | 0 | 0 | 106.3 | K137 L141 | K137-A139 PolarHBondContact O-N 3.24Å; A139-L141 PolarHBondContact O-N 3.29Å | ||
| 140 | R | 57.6 | Low | 57 | Low | 209 Ų | 209 | 138.6 Ų | 138.6 | 79% | 0.789 | 70% | 0.701 | S | S | * | * | trans | -70.8 | 88 | 169.7 | -170.6 | 178.4 | 172.4 | 165.7 | 3.6 | 106.6 | R138 E142 | R138-R140 PolarHBondContact O-N 3.02Å; R140-E142 IonicContact CZ-OE1 3.41Å; R140-E142 IonicContact NE-OE1 2.79Å; R140-E142 PolarHBondContact NE-OE1 2.94Å; R140-E142 IonicContact NH2-OE1 3.34Å; R140-E142 PolarHBondContact NH2-OE1 3.37Å; R140-E142 PolarHBondContact O-N 3.42Å | ||
| 141 | L | 49.5 | Very low | 56.8 | Low | 147 Ų | 147 | 139.8 Ų | 139.8 | 77% | 0.77 | 70% | 0.696 | S | S | * | * | trans | -74.8 | 103.6 | 167.6 | -82.4 | 166.8 | 0 | 0 | 0 | 107.1 | A139 | A139-L141 PolarHBondContact O-N 3.29Š| ||
| 142 | E | 55.8 | Low | 56.9 | Low | 99 Ų | 99 | 137.4 Ų | 137.4 | 46% | 0.463 | 68% | 0.682 | S | S | . | * | trans | -64.3 | 129.3 | 166.4 | -70.2 | -68.9 | 142.7 | 0 | 0 | 108.4 | R140 G144 | R140-E142 IonicContact CZ-OE1 3.41Å; R140-E142 IonicContact NE-OE1 2.79Å; R140-E142 PolarHBondContact NE-OE1 2.94Å; R140-E142 IonicContact NH2-OE1 3.34Å; R140-E142 PolarHBondContact NH2-OE1 3.37Å; R140-E142 PolarHBondContact O-N 3.42Å; E142-G144 PolarHBondContact O-N 3.43Å | ||
| 143 | P | 52.7 | Low | 56.6 | Low | 118 Ų | 118 | 135.6 Ų | 135.6 | 77% | 0.766 | 67% | 0.672 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.7 | 11.1 | -176.9 | -22.3 | 32.7 | 0 | 0 | 0 | 116.4 | ||
| 144 | G | 52.8 | Low | 56.8 | Low | 48 Ų | 48 | 132.4 Ų | 132.4 | 50% | 0.495 | 66% | 0.662 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -102 | -18.7 | -174.6 | 0 | 0 | 0 | 0 | 0 | 115.7 | E142 | E142-G144 PolarHBondContact O-N 3.43Š|
| 145 | E | 55.2 | Low | 56.9 | Low | 112 Ų | 112 | 131.3 Ų | 131.3 | 52% | 0.523 | 66% | 0.657 | S | S | . | * | S | Bend | trans | -92.1 | -15.9 | -172.6 | -69.2 | -174.1 | 141.1 | 0 | 0 | 114.2 | R147 K148 R149 | E145-R147 PolarHBondContact O-N 2.87Å; E145-K148 PolarHBondContact O-N 3.48Å; E145-R149 PolarHBondContact O-N 3.17Å |
| 146 | E | 53.6 | Low | 57.1 | Low | 136 Ų | 136 | 131.3 Ų | 131.3 | 64% | 0.636 | 65% | 0.651 | S | S | * | * | H | α-helix | trans | -68.1 | -35.8 | -174.4 | -154.3 | 167 | -150.8 | 0 | 0 | 112.3 | K148 R149 Q150 | E146-K148 PolarHBondContact O-N 2.99Å; E146-R149 PolarHBondContact O-N 3.42Å; E146-Q150 WeakPolarHBondContact O-CB 3.31Å; E146-Q150 WeakPolarHBondContact O-CG 3.42Å; E146-Q150 PolarHBondContact O-N 3.15Å |
| 147 | R | 54.6 | Low | 56.8 | Low | 185 Ų | 185 | 130.7 Ų | 130.7 | 70% | 0.698 | 65% | 0.645 | S | S | * | * | H | α-helix | trans | -66.5 | -34.6 | 175.1 | -93 | -175.2 | -79.4 | 151.5 | -5.1 | 113.1 | E145 N151 | E145-R147 PolarHBondContact O-N 2.87Å; R147-N151 WeakPolarHBondContact O-CB 3.47Å; R147-N151 PolarHBondContact O-N 3.46Å; R147-N151 PolarHBondContact O-ND2 2.98Å |
| 148 | K | 51.3 | Low | 56.9 | Low | 170 Ų | 170 | 128.3 Ų | 128.3 | 74% | 0.739 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -73.8 | -37.5 | -179.8 | -69.8 | -177.2 | -179.5 | 178.6 | 0 | 111.5 | E145 E146 S152 | E145-K148 PolarHBondContact O-N 3.48Å; E146-K148 PolarHBondContact O-N 2.99Å; K148-S152 PolarHBondContact O-N 2.96Å |
| 149 | R | 57.8 | Low | 56.6 | Low | 166 Ų | 166 | 128.3 Ų | 128.3 | 63% | 0.626 | 65% | 0.647 | S | S | * | * | H | α-helix | trans | -74.2 | -36.4 | 177.7 | -64.5 | -166.8 | -174.6 | -165.2 | 3.8 | 113.2 | E145 E146 S152 L153 | E145-R149 PolarHBondContact O-N 3.17Å; E146-R149 PolarHBondContact O-N 3.42Å; R149-S152 PolarHBondContact O-N 3.1Å; R149-S152 PolarHBondContact O-OG 2.98Å; R149-S152 VanDerWaalsContact O-OG 3.07Å; R149-L153 WeakPolarHBondContact O-CB 3.25Å; R149-L153 WeakPolarHBondContact O-CG 3.3Å; R149-L153 PolarHBondContact O-N 3.42Å |
| 150 | Q | 57.7 | Low | 56.6 | Low | 120 Ų | 120 | 130.7 Ų | 130.7 | 56% | 0.561 | 65% | 0.645 | S | S | * | * | H | α-helix | trans | -65.8 | -41 | 174 | -77.4 | 175.9 | -7.3 | 0 | 0 | 111.7 | E146 L154 | E146-Q150 WeakPolarHBondContact O-CB 3.31Å; E146-Q150 WeakPolarHBondContact O-CG 3.42Å; E146-Q150 PolarHBondContact O-N 3.15Å; Q150-L154 VanDerWaalsContact O-CB 3.22Å; Q150-L154 WeakPolarHBondContact O-CB 3.37Å; Q150-L154 PolarHBondContact O-N 3.41Å |
| 151 | N | 55.7 | Low | 56.6 | Low | 107 Ų | 107 | 126.5 Ų | 126.5 | 57% | 0.572 | 64% | 0.638 | S | S | * | * | H | α-helix | trans | -70 | -34.7 | 176.7 | -75.1 | -57.7 | 0 | 0 | 0 | 112.8 | R147 L155 | R147-N151 WeakPolarHBondContact O-CB 3.47Å; R147-N151 PolarHBondContact O-N 3.46Å; R147-N151 PolarHBondContact O-ND2 2.98Å; N151-L155 WeakPolarHBondContact O-CB 3.36Å; N151-L155 PolarHBondContact O-N 3.19Å; N151-L155 VanDerWaalsContact O-N 3.1Å |
| 152 | S | 61.8 | Low | 57 | Low | 53 Ų | 53 | 125.4 Ų | 125.4 | 37% | 0.371 | 63% | 0.631 | S | S | . | * | H | α-helix | trans | -68.5 | -45.4 | 175.2 | 72.5 | 0 | 0 | 0 | 0 | 111.6 | K148 R149 L154 L155 D156 | K148-S152 PolarHBondContact O-N 2.96Å; R149-S152 PolarHBondContact O-N 3.1Å; R149-S152 PolarHBondContact O-OG 2.98Å; R149-S152 VanDerWaalsContact O-OG 3.07Å; S152-L154 VanDerWaalsContact C-N 3.31Å; S152-L154 PolarHBondContact O-N 2.98Å; S152-L155 PolarHBondContact O-N 3.29Å; S152-D156 WeakPolarHBondContact O-CB 3.22Å; S152-D156 PolarHBondContact O-N 3.27Å |
| 153 | L | 60.8 | Low | 57 | Low | 111 Ų | 111 | 126.9 Ų | 126.9 | 58% | 0.581 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -66.4 | -33.8 | 178.9 | -68.8 | 171.5 | 0 | 0 | 0 | 112.2 | R149 C157 | R149-L153 WeakPolarHBondContact O-CB 3.25Å; R149-L153 WeakPolarHBondContact O-CG 3.3Å; R149-L153 PolarHBondContact O-N 3.42Å; L153-C157 PolarHBondContact O-N 2.96Å; L153-C157 VanDerWaalsContact O-N 3.15Å; L153-C157 PolarHBondContact O-SG 3.42Å |
| 154 | L | 65.1 | Low | 57.3 | Low | 114 Ų | 114 | 127.5 Ų | 127.5 | 60% | 0.597 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -72.2 | -31.8 | 176.2 | -163.5 | 142.2 | 0 | 0 | 0 | 112.2 | Q150 S152 | Q150-L154 VanDerWaalsContact O-CB 3.22Å; Q150-L154 WeakPolarHBondContact O-CB 3.37Å; Q150-L154 PolarHBondContact O-N 3.41Å; S152-L154 VanDerWaalsContact C-N 3.31Å; S152-L154 PolarHBondContact O-N 2.98Å |
| 155 | L | 65.6 | Low | 57.6 | Low | 119 Ų | 119 | 132.8 Ų | 132.8 | 62% | 0.623 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -76.7 | -32.2 | 175.4 | -161.6 | 67.6 | 0 | 0 | 0 | 112.5 | N151 S152 L158 | N151-L155 WeakPolarHBondContact O-CB 3.36Å; N151-L155 PolarHBondContact O-N 3.19Å; N151-L155 VanDerWaalsContact O-N 3.1Å; S152-L155 PolarHBondContact O-N 3.29Å; L155-L158 PolarHBondContact O-N 3.35Å |
| 156 | D | 62.6 | Low | 57.8 | Low | 113 Ų | 113 | 134.3 Ų | 134.3 | 60% | 0.604 | 65% | 0.65 | S | S | * | * | H | α-helix | trans | -74.2 | -25.6 | 175.6 | -72.4 | -21.7 | 0 | 0 | 0 | 112.6 | S152 L158 | S152-D156 WeakPolarHBondContact O-CB 3.22Å; S152-D156 PolarHBondContact O-N 3.27Å; D156-L158 VanDerWaalsContact C-N 3.33Å |
| 157 | C | 52.5 | Low | 58.1 | Low | 108 Ų | 108 | 134.2 Ų | 134.2 | 73% | 0.73 | 65% | 0.651 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.1 | -5.3 | 173 | -74.7 | 0 | 0 | 0 | 0 | 114.5 | L153 | L153-C157 PolarHBondContact O-N 2.96Å; L153-C157 VanDerWaalsContact O-N 3.15Å; L153-C157 PolarHBondContact O-SG 3.42Å |
| 158 | L | 60.6 | Low | 58.4 | Low | 138 Ų | 138 | 129.9 Ų | 129.9 | 72% | 0.723 | 65% | 0.648 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -105.4 | 10.8 | -179.5 | -108.5 | 88.7 | 0 | 0 | 0 | 114.1 | L155 D156 | L155-L158 PolarHBondContact O-N 3.35Å; D156-L158 VanDerWaalsContact C-N 3.33Å |
| 159 | K | 49.4 | Very low | 59 | Low | 240 Ų | 240 | 126.3 Ų | 126.3 | 100% | 1.043 | 64% | 0.639 | S | S | * | * | trans | -111.2 | 0 | 166.5 | -83.1 | 174.8 | 177.3 | 158.4 | 0 | 110.1 |
Retrieved 159 of 159 residues in 247.4 ms
(Link to these results)