| 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 | A | 65.8 | Low | 82 | Confident | 82 Ų | 82 | 80.1 Ų | 80.1 | 68% | 0.678 | 48% | 0.48 | S | S | * | . | 0 | -96.3 | 0 | 0 | 0 | 0 | 0 | 0 | 111.8 | G3 V4 V5 | A1-G3 PolarHBondContact O-N 3.48Å; A1-G3 VanDerWaalsContact O-N 3.13Å; A1-V4 WeakPolarHBondContact O-CB 3.29Å; A1-V4 PolarHBondContact O-N 3.49Å; A1-V5 PolarHBondContact O-N 2.98Å | |||
| 2 | S | 77.9 | Confident | 82.1 | Confident | 107 Ų | 107 | 79.3 Ų | 79.3 | 75% | 0.748 | 47% | 0.472 | S | S | * | . | H | α-helix | trans | -50.3 | -46.7 | -160.4 | -36.6 | 0 | 0 | 0 | 0 | 116.2 | V4 V5 G6 | S2-V4 PolarHBondContact O-N 3.41Å; S2-V5 PolarHBondContact O-N 3.48Å; S2-G6 PolarHBondContact O-N 2.67Å |
| 3 | G | 83.4 | Confident | 81.9 | Confident | 50 Ų | 50 | 89.4 Ų | 89.4 | 52% | 0.515 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -61.5 | -38.3 | 177.4 | 0 | 0 | 0 | 0 | 0 | 113.9 | A1 G6 Q7 | A1-G3 PolarHBondContact O-N 3.48Å; A1-G3 VanDerWaalsContact O-N 3.13Å; G3-G6 PolarHBondContact O-N 3.5Å; G3-Q7 WeakPolarHBondContact O-CB 3.47Å; G3-Q7 VanDerWaalsContact O-CG 3.3Å; G3-Q7 WeakPolarHBondContact O-CG 3.21Å; G3-Q7 PolarHBondContact O-N 3.04Å |
| 4 | V | 84.9 | Confident | 81.7 | Confident | 32 Ų | 32 | 95.4 Ų | 95.4 | 19% | 0.194 | 52% | 0.515 | C | S | . | . | H | α-helix | trans | -68.7 | -38.3 | 177.4 | 179.8 | 0 | 0 | 0 | 0 | 111 | A1 S2 T8 M27 | A1-V4 WeakPolarHBondContact O-CB 3.29Å; A1-V4 PolarHBondContact O-N 3.49Å; S2-V4 PolarHBondContact O-N 3.41Å; V4-T8 WeakPolarHBondContact O-CB 3.14Å; V4-T8 PolarHBondContact O-N 3.27Å; V4-T8 PolarHBondContact O-OG1 3.03Å; V4-M27 HydrophobicContact CG1-CB 4.46Å; V4-M27 HydrophobicContact CG1-CG 4.18Å; V4-M27 HydrophobicContact CG1-SD 4.09Å |
| 5 | V | 84 | Confident | 81.6 | Confident | 72 Ų | 72 | 98.5 Ų | 98.5 | 44% | 0.436 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -66.2 | -44.4 | 175.1 | 179.9 | 0 | 0 | 0 | 0 | 110.5 | A1 S2 T8 W9 | A1-V5 PolarHBondContact O-N 2.98Å; S2-V5 PolarHBondContact O-N 3.48Å; V5-T8 PolarHBondContact O-N 3.4Å; V5-W9 WeakPolarHBondContact O-CB 3.37Å; V5-W9 PolarHBondContact O-N 2.93Å |
| 6 | G | 85.8 | Confident | 80.6 | Confident | 38 Ų | 38 | 103.4 Ų | 103.4 | 39% | 0.392 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -63.9 | -46.8 | 176.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | S2 G3 W9 V10 | S2-G6 PolarHBondContact O-N 2.67Å; G3-G6 PolarHBondContact O-N 3.5Å; G6-W9 PolarHBondContact O-N 3.37Å; G6-V10 PolarHBondContact O-N 2.91Å |
| 7 | Q | 83.4 | Confident | 80.1 | Confident | 132 Ų | 132 | 103.6 Ų | 103.6 | 62% | 0.617 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -61.9 | -44.1 | 174.5 | -74.8 | 172.6 | -31 | 0 | 0 | 111.4 | G3 W9 V10 L11 | G3-Q7 WeakPolarHBondContact O-CB 3.47Å; G3-Q7 VanDerWaalsContact O-CG 3.3Å; G3-Q7 WeakPolarHBondContact O-CG 3.21Å; G3-Q7 PolarHBondContact O-N 3.04Å; Q7-W9 VanDerWaalsContact C-N 3.33Å; Q7-W9 PolarHBondContact O-N 3.07Å; Q7-V10 PolarHBondContact O-N 3.34Å; Q7-L11 VanDerWaalsContact O-CD1 3.32Å; Q7-L11 WeakPolarHBondContact O-CD1 3.31Å; Q7-L11 PolarHBondContact O-N 3.23Å |
| 8 | T | 85.5 | Confident | 79.8 | Confident | 6 Ų | 6 | 102.7 Ų | 102.7 | 4% | 0.037 | 55% | 0.55 | C | S | . | . | H | α-helix | trans | -66.2 | -35.5 | 178.4 | -57.7 | 0 | 0 | 0 | 0 | 111.4 | V4 V5 V10 L11 N12 L19 Q24 | V4-T8 WeakPolarHBondContact O-CB 3.14Å; V4-T8 PolarHBondContact O-N 3.27Å; V4-T8 PolarHBondContact O-OG1 3.03Å; V5-T8 PolarHBondContact O-N 3.4Å; T8-V10 VanDerWaalsContact C-N 3.35Å; T8-V10 PolarHBondContact O-N 3.47Å; T8-L11 PolarHBondContact O-N 3.45Å; T8-N12 WeakPolarHBondContact O-CB 3.29Å; T8-N12 PolarHBondContact O-N 2.95Å; T8-L19 HydrophobicContact CG2-CB 3.73Å; T8-L19 HydrophobicContact CG2-CD1 3.87Å; T8-L19 HydrophobicContact CG2-CG 4.46Å; T8-Q24 HydrophobicContact CG2-CG 3.71Å |
| 9 | W | 84.3 | Confident | 79.6 | Confident | 198 Ų | 198 | 99.3 Ų | 99.3 | 75% | 0.75 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -60 | -42.7 | 173.1 | -179.2 | 86.5 | 0 | 0 | 0 | 112.2 | V5 G6 Q7 R13 | V5-W9 WeakPolarHBondContact O-CB 3.37Å; V5-W9 PolarHBondContact O-N 2.93Å; G6-W9 PolarHBondContact O-N 3.37Å; Q7-W9 VanDerWaalsContact C-N 3.33Å; Q7-W9 PolarHBondContact O-N 3.07Å; W9-R13 PolarHBondContact O-N 3.37Å |
| 10 | V | 85.7 | Confident | 79.6 | Confident | 71 Ų | 71 | 98.5 Ų | 98.5 | 43% | 0.43 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -66.2 | -49.1 | 174.1 | 178.8 | 0 | 0 | 0 | 0 | 111.4 | G6 Q7 T8 N12 R13 F14 | G6-V10 PolarHBondContact O-N 2.91Å; Q7-V10 PolarHBondContact O-N 3.34Å; T8-V10 VanDerWaalsContact C-N 3.35Å; T8-V10 PolarHBondContact O-N 3.47Å; V10-N12 VanDerWaalsContact C-N 3.28Å; V10-N12 PolarHBondContact O-N 3.17Å; V10-R13 VanDerWaalsContact O-CB 3.29Å; V10-R13 WeakPolarHBondContact O-CB 3.49Å; V10-R13 PolarHBondContact O-N 2.97Å; V10-F14 WeakPolarHBondContact O-CD2 3.41Å |
| 11 | L | 81.9 | Confident | 79.5 | Confident | 93 Ų | 93 | 101.6 Ų | 101.6 | 49% | 0.487 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -62.1 | -35.4 | 179.2 | -92.4 | 67.3 | 0 | 0 | 0 | 112.3 | Q7 T8 R13 F14 R15 | Q7-L11 VanDerWaalsContact O-CD1 3.32Å; Q7-L11 WeakPolarHBondContact O-CD1 3.31Å; Q7-L11 PolarHBondContact O-N 3.23Å; T8-L11 PolarHBondContact O-N 3.45Å; L11-R13 PolarHBondContact O-N 3.42Å; L11-F14 PolarHBondContact O-N 2.89Å; L11-F14 VanDerWaalsContact O-N 3.07Å; L11-R15 PolarHBondContact O-N 3.05Å |
| 12 | N | 82.4 | Confident | 80 | Confident | 70 Ų | 70 | 101.2 Ų | 101.2 | 37% | 0.374 | 52% | 0.521 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -70.3 | -10.2 | 176.5 | -166.5 | 42.8 | 0 | 0 | 0 | 113.3 | T8 V10 F14 P18 | T8-N12 WeakPolarHBondContact O-CB 3.29Å; T8-N12 PolarHBondContact O-N 2.95Å; V10-N12 VanDerWaalsContact C-N 3.28Å; V10-N12 PolarHBondContact O-N 3.17Å; N12-F14 VanDerWaalsContact C-N 3.34Å; N12-P18 WeakPolarHBondContact OD1-CA 3.44Å; N12-P18 WeakPolarHBondContact OD1-CB 3.32Å |
| 13 | R | 80.4 | Confident | 80.1 | Confident | 211 Ų | 211 | 100 Ų | 100 | 80% | 0.796 | 51% | 0.507 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -79.8 | -18.3 | 169.4 | -166.1 | 59.6 | 178.6 | -177.6 | 3.3 | 112.8 | W9 V10 L11 | W9-R13 PolarHBondContact O-N 3.37Å; V10-R13 VanDerWaalsContact O-CB 3.29Å; V10-R13 WeakPolarHBondContact O-CB 3.49Å; V10-R13 PolarHBondContact O-N 2.97Å; L11-R13 PolarHBondContact O-N 3.42Å |
| 14 | F | 78.9 | Confident | 80 | Confident | 173 Ų | 173 | 99.1 Ų | 99.1 | 76% | 0.759 | 49% | 0.489 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -120.5 | -14.4 | -175.7 | -62.6 | -78.2 | 0 | 0 | 0 | 114.5 | V10 L11 N12 | V10-F14 WeakPolarHBondContact O-CD2 3.41Å; L11-F14 PolarHBondContact O-N 2.89Å; L11-F14 VanDerWaalsContact O-N 3.07Å; N12-F14 VanDerWaalsContact C-N 3.34Å |
| 15 | R | 79.8 | Confident | 79.7 | Confident | 143 Ų | 143 | 100.7 Ų | 100.7 | 54% | 0.54 | 50% | 0.499 | S | S | . | . | trans | -84.3 | 140.8 | 172 | -91.5 | -171.2 | 167.4 | -164.1 | -2.6 | 112 | L11 | L11-R15 PolarHBondContact O-N 3.05Š| ||
| 16 | L | 65.2 | Low | 79.5 | Confident | 176 Ų | 176 | 99.1 Ų | 99.1 | 92% | 0.921 | 49% | 0.489 | S | S | * | . | S | Bend | trans | -74.3 | -23.4 | 168.4 | -73.7 | 89.7 | 0 | 0 | 0 | 113.4 | ||
| 17 | V | 73.4 | Confident | 79.3 | Confident | 107 Ų | 107 | 102.4 Ų | 102.4 | 65% | 0.648 | 50% | 0.495 | S | S | * | . | S | Bend | trans | -110.4 | 112.8 | 178.8 | -177.4 | 0 | 0 | 0 | 0 | 109.4 | ||
| 18 | P | 74.2 | Confident | 79.1 | Confident | 88 Ų | 88 | 97.9 Ų | 97.9 | 57% | 0.571 | 48% | 0.479 | S | S | * | . | P | Polyproline II helix | trans | -72.5 | 139.8 | -179.8 | 29.3 | -34.6 | 0 | 0 | 0 | 112.2 | N12 | N12-P18 WeakPolarHBondContact OD1-CA 3.44Å; N12-P18 WeakPolarHBondContact OD1-CB 3.32Å |
| 19 | L | 76.2 | Confident | 78.9 | Confident | 37 Ų | 37 | 101 Ų | 101 | 19% | 0.194 | 49% | 0.49 | C | S | . | . | P | Polyproline II helix | trans | -81.8 | 119.8 | 171.8 | -82.7 | 159.7 | 0 | 0 | 0 | 109.6 | T8 D23 Q24 | T8-L19 HydrophobicContact CG2-CB 3.73Å; T8-L19 HydrophobicContact CG2-CD1 3.87Å; T8-L19 HydrophobicContact CG2-CG 4.46Å; L19-D23 HydrophobicContact CD2-CB 4.24Å; L19-Q24 PolarHBondContact O-NE2 3Å |
| 20 | D | 78.8 | Confident | 78.5 | Confident | 83 Ų | 83 | 93.8 Ų | 93.8 | 44% | 0.444 | 48% | 0.478 | S | S | . | . | P | Polyproline II helix | trans | -67.5 | 158.1 | -178.4 | -172.3 | 28.6 | 0 | 0 | 0 | 112 | I22 D23 Q24 | D20-I22 PolarHBondContact O-N 3.37Å; D20-I22 WeakPolarHBondContact OD2-CB 3.36Å; D20-I22 WeakPolarHBondContact OD2-CD1 3.5Å; D20-I22 WeakPolarHBondContact OD2-CG1 3.32Å; D20-D23 PolarHBondContact O-N 2.89Å; D20-D23 VanDerWaalsContact O-N 3.13Å; D20-Q24 WeakPolarHBondContact O-CG 3.18Å; D20-Q24 PolarHBondContact O-N 3.12Å |
| 21 | K | 77.7 | Confident | 78 | Confident | 164 Ų | 164 | 92.3 Ų | 92.3 | 71% | 0.713 | 48% | 0.476 | S | S | * | . | H | α-helix | trans | -59.3 | -31.8 | 176.6 | -61.9 | 177.6 | -176.1 | 174.9 | 0 | 111.5 | V25 | K21-V25 WeakPolarHBondContact O-CG2 3.47Å; K21-V25 PolarHBondContact O-N 3.2Å |
| 22 | I | 77.3 | Confident | 77.3 | Confident | 74 Ų | 74 | 95.9 Ų | 95.9 | 38% | 0.379 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -60.2 | -54.7 | 172.8 | -65.7 | 178.6 | 0 | 0 | 0 | 109.8 | D20 Q24 V25 V26 L81 | D20-I22 PolarHBondContact O-N 3.37Å; D20-I22 WeakPolarHBondContact OD2-CB 3.36Å; D20-I22 WeakPolarHBondContact OD2-CD1 3.5Å; D20-I22 WeakPolarHBondContact OD2-CG1 3.32Å; I22-Q24 VanDerWaalsContact C-N 3.34Å; I22-Q24 PolarHBondContact O-N 3.41Å; I22-V25 PolarHBondContact O-N 2.85Å; I22-V26 WeakPolarHBondContact O-CG2 3.43Å; I22-V26 PolarHBondContact O-N 3.32Å; I22-L81 HydrophobicContact CB-CD2 4.23Å; I22-L81 HydrophobicContact CG1-CG 4.45Å; I22-L81 HydrophobicContact CG2-CB 4.26Å; I22-L81 HydrophobicContact CG2-CD2 3.77Å; I22-L81 HydrophobicContact CG2-CG 3.97Å; I22-L81 VanDerWaalsContact O-CD2 3.32Å; I22-L81 WeakPolarHBondContact O-CD2 3.4Å |
| 23 | D | 78.7 | Confident | 76.6 | Confident | 83 Ų | 83 | 100 Ų | 100 | 44% | 0.444 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -64 | -37.7 | 179.7 | -63.8 | -30.9 | 0 | 0 | 0 | 112.2 | L19 D20 V25 V26 M27 | L19-D23 HydrophobicContact CD2-CB 4.24Å; D20-D23 PolarHBondContact O-N 2.89Å; D20-D23 VanDerWaalsContact O-N 3.13Å; D23-V25 VanDerWaalsContact C-N 3.34Å; D23-V25 PolarHBondContact O-N 2.86Å; D23-V26 PolarHBondContact O-N 2.84Å; D23-M27 WeakPolarHBondContact O-CB 3.48Å; D23-M27 PolarHBondContact O-N 3.28Å |
| 24 | Q | 81.8 | Confident | 76.2 | Confident | 31 Ų | 31 | 90.9 Ų | 90.9 | 15% | 0.145 | 48% | 0.478 | C | S | . | . | H | α-helix | trans | -61.5 | -40.2 | 174.7 | -71.6 | 175.6 | 46 | 0 | 0 | 112.3 | T8 L19 D20 I22 S28 | T8-Q24 HydrophobicContact CG2-CG 3.71Å; L19-Q24 PolarHBondContact O-NE2 3Å; D20-Q24 WeakPolarHBondContact O-CG 3.18Å; D20-Q24 PolarHBondContact O-N 3.12Å; I22-Q24 VanDerWaalsContact C-N 3.34Å; I22-Q24 PolarHBondContact O-N 3.41Å; Q24-S28 WeakPolarHBondContact O-CB 3.36Å; Q24-S28 PolarHBondContact O-N 3.43Å; Q24-S28 PolarHBondContact O-OG 3.04Å |
| 25 | V | 78.9 | Confident | 76.3 | Confident | 65 Ų | 65 | 86.4 Ų | 86.4 | 39% | 0.394 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -66.1 | -49.3 | 175.8 | 165.5 | 0 | 0 | 0 | 0 | 110.3 | K21 I22 D23 M27 S28 Y29 L81 | K21-V25 WeakPolarHBondContact O-CG2 3.47Å; K21-V25 PolarHBondContact O-N 3.2Å; I22-V25 PolarHBondContact O-N 2.85Å; D23-V25 VanDerWaalsContact C-N 3.34Å; D23-V25 PolarHBondContact O-N 2.86Å; V25-M27 PolarHBondContact O-N 3.1Å; V25-S28 CarbonylContact O-C 3.59Å; V25-S28 PolarHBondContact O-N 2.85Å; V25-S28 VanDerWaalsContact O-N 3.16Å; V25-S28 PolarHBondContact O-OG 3.4Å; V25-Y29 WeakPolarHBondContact O-CB 3.16Å; V25-Y29 PolarHBondContact O-N 2.78Å; V25-L81 HydrophobicContact CB-CD2 3.83Å; V25-L81 HydrophobicContact CG1-CD1 4.41Å; V25-L81 HydrophobicContact CG1-CD2 3.68Å |
| 26 | V | 80.1 | Confident | 76.7 | Confident | 39 Ų | 39 | 85 Ų | 85 | 24% | 0.236 | 48% | 0.479 | C | S | . | . | H | α-helix | trans | -59 | -48.2 | 177.5 | 176.4 | 0 | 0 | 0 | 0 | 111.3 | I22 D23 S28 Y29 G30 I74 V78 L81 | I22-V26 WeakPolarHBondContact O-CG2 3.43Å; I22-V26 PolarHBondContact O-N 3.32Å; D23-V26 PolarHBondContact O-N 2.84Å; V26-S28 VanDerWaalsContact C-N 3.29Å; V26-S28 PolarHBondContact O-N 2.87Å; V26-Y29 PolarHBondContact O-N 2.94Å; V26-G30 PolarHBondContact O-N 3.27Å; V26-I74 HydrophobicContact CG1-CD1 4.36Å; V26-V78 HydrophobicContact CG1-CG2 3.99Å; V26-V78 HydrophobicContact CG2-CG2 4.1Å; V26-L81 HydrophobicContact CG2-CD2 3.79Å |
| 27 | M | 80.3 | Confident | 77.6 | Confident | 106 Ų | 106 | 78.9 Ų | 78.9 | 52% | 0.522 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -60 | -38.8 | 176.4 | -177.2 | -179.3 | -72.6 | 0 | 0 | 111.8 | V4 D23 V25 Y29 | V4-M27 HydrophobicContact CG1-CB 4.46Å; V4-M27 HydrophobicContact CG1-CG 4.18Å; V4-M27 HydrophobicContact CG1-SD 4.09Å; D23-M27 WeakPolarHBondContact O-CB 3.48Å; D23-M27 PolarHBondContact O-N 3.28Å; V25-M27 PolarHBondContact O-N 3.1Å; M27-Y29 PolarHBondContact O-N 3.42Å |
| 28 | S | 80.4 | Confident | 78.2 | Confident | 38 Ų | 38 | 78.1 Ų | 78.1 | 27% | 0.266 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -75.5 | -11.7 | 177.4 | 88.7 | 0 | 0 | 0 | 0 | 114.5 | Q24 V25 V26 | Q24-S28 WeakPolarHBondContact O-CB 3.36Å; Q24-S28 PolarHBondContact O-N 3.43Å; Q24-S28 PolarHBondContact O-OG 3.04Å; V25-S28 CarbonylContact O-C 3.59Å; V25-S28 PolarHBondContact O-N 2.85Å; V25-S28 VanDerWaalsContact O-N 3.16Å; V25-S28 PolarHBondContact O-OG 3.4Å; V26-S28 VanDerWaalsContact C-N 3.29Å; V26-S28 PolarHBondContact O-N 2.87Å |
| 29 | Y | 81.3 | Confident | 78.8 | Confident | 70 Ų | 70 | 76 Ų | 76 | 28% | 0.275 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -100.7 | -38.7 | 177.7 | -160.4 | -96.1 | 0 | 0 | 0 | 112.7 | V25 V26 M27 G31 Q70 T73 I74 L77 | V25-Y29 WeakPolarHBondContact O-CB 3.16Å; V25-Y29 PolarHBondContact O-N 2.78Å; V26-Y29 PolarHBondContact O-N 2.94Å; M27-Y29 PolarHBondContact O-N 3.42Å; Y29-G31 PolarHBondContact O-N 3.13Å; Y29-Q70 HydrophobicContact CE1-CB 3.97Å; Y29-Q70 HydrophobicContact CE1-CG 3.99Å; Y29-Q70 PolarHBondContact O-NE2 2.94Å; Y29-T73 WeakPolarHBondContact CE1-OG1 3.33Å; Y29-T73 PolarHBondContact OH-OG1 3.01Å; Y29-I74 HydrophobicContact CD1-CD1 4.05Å; Y29-L77 HydrophobicContact CD1-CD2 3.5Å; Y29-L77 HydrophobicContact CD2-CD2 3.87Å; Y29-L77 HydrophobicContact CE1-CD2 3.92Å; Y29-L77 HydrophobicContact CE2-CD2 4.27Å; Y29-L77 HydrophobicContact CG-CD2 3.49Å; Y29-L77 VanDerWaalsContact CG-CD2 3.49Å |
| 30 | G | 75.9 | Confident | 79.3 | Confident | 48 Ų | 48 | 79.8 Ų | 79.8 | 50% | 0.495 | 45% | 0.452 | S | S | . | . | trans | -77.6 | 8.7 | -179.2 | 0 | 0 | 0 | 0 | 0 | 115.5 | V26 L32 | V26-G30 PolarHBondContact O-N 3.27Å; G30-L32 PolarHBondContact O-N 3.24Å; G30-L32 VanDerWaalsContact O-N 3.12Å | ||
| 31 | G | 73.6 | Confident | 79.7 | Confident | 39 Ų | 39 | 76.5 Ų | 76.5 | 40% | 0.402 | 44% | 0.435 | S | S | . | . | trans | -66.1 | 108.7 | 173.6 | 0 | 0 | 0 | 0 | 0 | 111 | Y29 R33 Q70 | Y29-G31 PolarHBondContact O-N 3.13Å; G31-R33 WeakPolarHBondContact O-CG 3.04Å; G31-R33 PolarHBondContact O-N 3.42Å; G31-Q70 PolarHBondContact O-NE2 3.27Å | ||
| 32 | L | 67.6 | Low | 80 | Confident | 169 Ų | 169 | 72 Ų | 72 | 89% | 0.885 | 42% | 0.421 | S | S | * | . | trans | -53.9 | 102.9 | 174.7 | -78.9 | 163.5 | 0 | 0 | 0 | 110.2 | G30 | G30-L32 PolarHBondContact O-N 3.24Å; G30-L32 VanDerWaalsContact O-N 3.12Å | ||
| 33 | R | 69.1 | Low | 80.3 | Confident | 156 Ų | 156 | 75.3 Ų | 75.3 | 59% | 0.589 | 44% | 0.439 | S | S | * | . | trans | -79.9 | 133 | -173.6 | -75.5 | -159.8 | 171.2 | -144.8 | -4.5 | 111.9 | G31 Q70 | G31-R33 WeakPolarHBondContact O-CG 3.04Å; G31-R33 PolarHBondContact O-N 3.42Å; R33-Q70 VanDerWaalsContact CD-OE1 3.26Å | ||
| 34 | G | 70.9 | Confident | 80.5 | Confident | 20 Ų | 20 | 74.8 Ų | 74.8 | 21% | 0.206 | 44% | 0.436 | C | S | . | . | S | Bend | trans | 94.9 | -7.3 | 148.8 | 0 | 0 | 0 | 0 | 0 | 118 | V36 A37 F38 | G34-V36 VanDerWaalsContact C-N 3.28Å; G34-V36 PolarHBondContact O-N 2.72Å; G34-A37 PolarHBondContact O-N 2.91Å; G34-F38 WeakPolarHBondContact O-CB 3.17Å; G34-F38 PolarHBondContact O-N 3.29Å |
| 35 | A | 81.5 | Confident | 80.3 | Confident | 79 Ų | 79 | 78.1 Ų | 78.1 | 65% | 0.653 | 46% | 0.455 | S | S | * | . | H | α-helix | trans | -55.1 | -44.1 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | A39 | A35-A39 PolarHBondContact O-N 3.31Å |
| 36 | V | 87.2 | Confident | 79.8 | Confident | 112 Ų | 112 | 77.8 Ų | 77.8 | 68% | 0.679 | 46% | 0.459 | S | S | * | . | H | α-helix | trans | -69.6 | -37.8 | 174.7 | -177.7 | 0 | 0 | 0 | 0 | 112 | G34 A39 L40 | G34-V36 VanDerWaalsContact C-N 3.28Å; G34-V36 PolarHBondContact O-N 2.72Å; V36-A39 PolarHBondContact O-N 2.78Å; V36-L40 HydrophobicContact CG1-CD1 4.16Å; V36-L40 VanDerWaalsContact O-CG 3.29Å; V36-L40 WeakPolarHBondContact O-CG 3.24Å; V36-L40 PolarHBondContact O-N 2.68Å |
| 37 | A | 85.5 | Confident | 79.1 | Confident | 48 Ų | 48 | 84.7 Ų | 84.7 | 40% | 0.397 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -67.6 | -37.9 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | G34 L40 V41 | G34-A37 PolarHBondContact O-N 2.91Å; A37-L40 PolarHBondContact O-N 3.01Å; A37-V41 PolarHBondContact O-N 2.98Å |
| 38 | F | 86.3 | Confident | 78.3 | Confident | 91 Ų | 91 | 87.9 Ų | 87.9 | 40% | 0.399 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -65.8 | -44.6 | 173 | 178.9 | -105.2 | 0 | 0 | 0 | 111.3 | G34 L40 V41 V42 I60 | G34-F38 WeakPolarHBondContact O-CB 3.17Å; G34-F38 PolarHBondContact O-N 3.29Å; F38-L40 VanDerWaalsContact C-N 3.33Å; F38-L40 PolarHBondContact O-N 2.89Å; F38-V41 HydrophobicContact CD2-CG1 4.47Å; F38-V41 WeakPolarHBondContact O-CG1 3.3Å; F38-V41 PolarHBondContact O-N 3.42Å; F38-V42 HydrophobicContact CD1-CG2 4.45Å; F38-V42 HydrophobicContact CD2-CG2 4.28Å; F38-V42 HydrophobicContact CE1-CG2 4.06Å; F38-V42 HydrophobicContact CE2-CG2 3.87Å; F38-V42 HydrophobicContact CZ-CG2 3.75Å; F38-V42 WeakPolarHBondContact O-CB 3.35Å; F38-V42 WeakPolarHBondContact O-CG2 3.36Å; F38-V42 PolarHBondContact O-N 2.85Å; F38-I60 HydrophobicContact CD2-CG1 4.07Å; F38-I60 HydrophobicContact CE2-CD1 4.07Å; F38-I60 HydrophobicContact CE2-CG1 3.71Å |
| 39 | A | 86.5 | Confident | 77.6 | Confident | 45 Ų | 45 | 88.4 Ų | 88.4 | 37% | 0.372 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -57.5 | -45.5 | 173.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | A35 V36 V42 L43 | A35-A39 PolarHBondContact O-N 3.31Å; V36-A39 PolarHBondContact O-N 2.78Å; A39-V42 PolarHBondContact O-N 2.85Å; A39-L43 VanDerWaalsContact O-CB 3.31Å; A39-L43 WeakPolarHBondContact O-CB 3.46Å; A39-L43 WeakPolarHBondContact O-CD1 3.34Å; A39-L43 WeakPolarHBondContact O-CG 3.26Å; A39-L43 PolarHBondContact O-N 3.17Å |
| 40 | L | 85.7 | Confident | 76.9 | Confident | 115 Ų | 115 | 96.7 Ų | 96.7 | 60% | 0.602 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -63.4 | -39.8 | 177.4 | -71.4 | 169.5 | 0 | 0 | 0 | 113.2 | V36 A37 F38 L43 L44 | V36-L40 HydrophobicContact CG1-CD1 4.16Å; V36-L40 VanDerWaalsContact O-CG 3.29Å; V36-L40 WeakPolarHBondContact O-CG 3.24Å; V36-L40 PolarHBondContact O-N 2.68Å; A37-L40 PolarHBondContact O-N 3.01Å; F38-L40 VanDerWaalsContact C-N 3.33Å; F38-L40 PolarHBondContact O-N 2.89Å; L40-L43 PolarHBondContact O-N 2.7Å; L40-L44 PolarHBondContact O-N 3.13Å |
| 41 | V | 86.8 | Confident | 76.7 | Confident | 14 Ų | 14 | 96.2 Ų | 96.2 | 9% | 0.085 | 53% | 0.525 | C | S | . | . | H | α-helix | trans | -75.3 | -28.1 | 180 | 87.2 | 0 | 0 | 0 | 0 | 112.9 | A37 F38 K52 F55 V56 T59 | A37-V41 PolarHBondContact O-N 2.98Å; F38-V41 HydrophobicContact CD2-CG1 4.47Å; F38-V41 WeakPolarHBondContact O-CG1 3.3Å; F38-V41 PolarHBondContact O-N 3.42Å; V41-K52 WeakPolarHBondContact O-CE 3.21Å; V41-F55 HydrophobicContact CG2-CB 3.73Å; V41-V56 HydrophobicContact CG1-CG2 4.17Å; V41-V56 HydrophobicContact CG2-CG2 4.19Å; V41-T59 HydrophobicContact CG1-CG2 3.94Å |
| 42 | V | 83.9 | Confident | 76.9 | Confident | 69 Ų | 69 | 96.1 Ų | 96.1 | 42% | 0.418 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -72.4 | -40.7 | 172 | 171.3 | 0 | 0 | 0 | 0 | 110.9 | F38 A39 L44 K52 | F38-V42 HydrophobicContact CD1-CG2 4.45Å; F38-V42 HydrophobicContact CD2-CG2 4.28Å; F38-V42 HydrophobicContact CE1-CG2 4.06Å; F38-V42 HydrophobicContact CE2-CG2 3.87Å; F38-V42 HydrophobicContact CZ-CG2 3.75Å; F38-V42 WeakPolarHBondContact O-CB 3.35Å; F38-V42 WeakPolarHBondContact O-CG2 3.36Å; F38-V42 PolarHBondContact O-N 2.85Å; A39-V42 PolarHBondContact O-N 2.85Å; V42-L44 VanDerWaalsContact C-N 3.32Å; V42-L44 PolarHBondContact O-N 3.05Å; V42-K52 PolarHBondContact O-NZ 3.36Å |
| 43 | L | 85.1 | Confident | 77.5 | Confident | 144 Ų | 144 | 93.9 Ų | 93.9 | 75% | 0.754 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -73.9 | -14.9 | 177.2 | -71.9 | 169.4 | 0 | 0 | 0 | 114.5 | A39 L40 D45 | A39-L43 VanDerWaalsContact O-CB 3.31Å; A39-L43 WeakPolarHBondContact O-CB 3.46Å; A39-L43 WeakPolarHBondContact O-CD1 3.34Å; A39-L43 WeakPolarHBondContact O-CG 3.26Å; A39-L43 PolarHBondContact O-N 3.17Å; L40-L43 PolarHBondContact O-N 2.7Å; L43-D45 PolarHBondContact O-N 3.12Å |
| 44 | L | 82.5 | Confident | 78.4 | Confident | 72 Ų | 72 | 94.9 Ų | 94.9 | 38% | 0.377 | 51% | 0.508 | S | S | . | . | S | Bend | trans | -60 | 133.8 | 174.4 | -177.2 | 64.4 | 0 | 0 | 0 | 110.2 | L40 V42 K52 | L40-L44 PolarHBondContact O-N 3.13Å; V42-L44 VanDerWaalsContact C-N 3.32Å; V42-L44 PolarHBondContact O-N 3.05Å; L44-K52 WeakPolarHBondContact O-CD 3.24Å; L44-K52 WeakPolarHBondContact O-CE 3.4Å; L44-K52 PolarHBondContact O-NZ 3.44Å |
| 45 | D | 77.4 | Confident | 79 | Confident | 102 Ų | 102 | 99.5 Ų | 99.5 | 55% | 0.545 | 52% | 0.523 | S | S | . | . | trans | -71.6 | 142.7 | -173.3 | -146 | -30.9 | 0 | 0 | 0 | 112.7 | L43 | L43-D45 PolarHBondContact O-N 3.12Š| ||
| 46 | A | 68.3 | Low | 79.3 | Confident | 58 Ų | 58 | 97.1 Ų | 97.1 | 48% | 0.479 | 50% | 0.5 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -81.3 | -32.3 | -174.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | K52 | A46-K52 HydrophobicContact CB-CD 4.16Š|
| 47 | E | 64.9 | Low | 79.4 | Confident | 183 Ų | 183 | 94.2 Ų | 94.2 | 86% | 0.855 | 49% | 0.487 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -71.7 | -34.1 | -176.1 | -64.3 | -164.2 | 143.1 | 0 | 0 | 113.1 | ||
| 48 | Q | 64.8 | Low | 79.6 | Confident | 173 Ų | 173 | 96 Ų | 96 | 81% | 0.808 | 49% | 0.494 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77.8 | -24.1 | -179.5 | -67.3 | -167.5 | 11.2 | 0 | 0 | 113.8 | ||
| 49 | V | 65.1 | Low | 79.7 | Confident | 49 Ų | 49 | 93.1 Ų | 93.1 | 30% | 0.297 | 48% | 0.483 | S | S | . | . | trans | -136.3 | 91 | -171.9 | -172.1 | 0 | 0 | 0 | 0 | 111 | A51 K52 | V49-A51 HydrophobicContact CG1-CB 4.14Å; V49-A51 PolarHBondContact O-N 2.89Å; V49-K52 WeakPolarHBondContact O-CB 3.43Å; V49-K52 PolarHBondContact O-N 3.02Å | ||
| 50 | R | 65.5 | Low | 79.8 | Confident | 245 Ų | 245 | 94.9 Ų | 94.9 | 93% | 0.925 | 49% | 0.486 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57.7 | -6.7 | 172.6 | -71.1 | 179.5 | 62.9 | 131.4 | -1.6 | 115 | ||
| 51 | A | 72.6 | Confident | 80 | Confident | 37 Ų | 37 | 94.1 Ų | 94.1 | 31% | 0.306 | 49% | 0.486 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -99.4 | 7.1 | 173.7 | 0 | 0 | 0 | 0 | 0 | 113.9 | V49 D53 Y54 F55 | V49-A51 HydrophobicContact CG1-CB 4.14Å; V49-A51 PolarHBondContact O-N 2.89Å; A51-D53 VanDerWaalsContact C-N 3.25Å; A51-D53 PolarHBondContact O-N 2.92Å; A51-Y54 HydrophobicContact CB-CD2 4.16Å; A51-Y54 PolarHBondContact O-N 3.4Å; A51-Y54 VanDerWaalsContact O-N 3.12Å; A51-F55 WeakPolarHBondContact O-CD2 3.31Å; A51-F55 PolarHBondContact O-N 2.95Å |
| 52 | K | 77.8 | Confident | 80.1 | Confident | 38 Ų | 38 | 97 Ų | 97 | 17% | 0.165 | 50% | 0.503 | C | S | . | . | H | α-helix | trans | -49.9 | -44.5 | -177.5 | 177.3 | 178.3 | 175.6 | 175.1 | 0 | 112.4 | V41 V42 L44 A46 V49 Y54 F55 V56 | V41-K52 WeakPolarHBondContact O-CE 3.21Å; V42-K52 PolarHBondContact O-NZ 3.36Å; L44-K52 WeakPolarHBondContact O-CD 3.24Å; L44-K52 WeakPolarHBondContact O-CE 3.4Å; L44-K52 PolarHBondContact O-NZ 3.44Å; A46-K52 HydrophobicContact CB-CD 4.16Å; V49-K52 WeakPolarHBondContact O-CB 3.43Å; V49-K52 PolarHBondContact O-N 3.02Å; K52-Y54 VanDerWaalsContact C-N 3.29Å; K52-Y54 PolarHBondContact O-N 3.23Å; K52-F55 CarbonylContact O-C 3.58Å; K52-F55 WeakPolarHBondContact O-CA 3.23Å; K52-F55 WeakPolarHBondContact O-CB 3.32Å; K52-F55 PolarHBondContact O-N 2.97Å; K52-V56 HydrophobicContact CG-CG2 3.99Å; K52-V56 WeakPolarHBondContact O-CG2 3.38Å; K52-V56 PolarHBondContact O-N 3.16Å |
| 53 | D | 80.6 | Confident | 80.4 | Confident | 121 Ų | 121 | 95.4 Ų | 95.4 | 65% | 0.647 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -64.7 | -32.7 | -175 | -58.2 | -39.8 | 0 | 0 | 0 | 112.7 | A51 V56 A57 | A51-D53 VanDerWaalsContact C-N 3.25Å; A51-D53 PolarHBondContact O-N 2.92Å; D53-V56 PolarHBondContact O-N 2.68Å; D53-A57 VanDerWaalsContact O-CB 3.24Å; D53-A57 WeakPolarHBondContact O-CB 3.46Å; D53-A57 PolarHBondContact O-N 3.41Å |
| 54 | Y | 86.9 | Confident | 80.5 | Confident | 177 Ų | 177 | 95.2 Ų | 95.2 | 69% | 0.694 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -66.2 | -41.4 | 171.3 | -58.8 | -68 | 0 | 0 | 0 | 111.5 | A51 K52 T58 | A51-Y54 HydrophobicContact CB-CD2 4.16Å; A51-Y54 PolarHBondContact O-N 3.4Å; A51-Y54 VanDerWaalsContact O-N 3.12Å; K52-Y54 VanDerWaalsContact C-N 3.29Å; K52-Y54 PolarHBondContact O-N 3.23Å; Y54-T58 VanDerWaalsContact O-CB 3.26Å; Y54-T58 WeakPolarHBondContact O-CB 3.27Å; Y54-T58 PolarHBondContact O-N 3.38Å; Y54-T58 PolarHBondContact O-OG1 3.12Å |
| 55 | F | 84.6 | Confident | 80.6 | Confident | 118 Ų | 118 | 97.3 Ų | 97.3 | 52% | 0.518 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -64.5 | -41.3 | 174 | -77.6 | -78.1 | 0 | 0 | 0 | 112.3 | V41 A51 K52 T59 | V41-F55 HydrophobicContact CG2-CB 3.73Å; A51-F55 WeakPolarHBondContact O-CD2 3.31Å; A51-F55 PolarHBondContact O-N 2.95Å; K52-F55 CarbonylContact O-C 3.58Å; K52-F55 WeakPolarHBondContact O-CA 3.23Å; K52-F55 WeakPolarHBondContact O-CB 3.32Å; K52-F55 PolarHBondContact O-N 2.97Å; F55-T59 VanDerWaalsContact O-CB 3.24Å; F55-T59 WeakPolarHBondContact O-CB 3.26Å; F55-T59 PolarHBondContact O-N 3.31Å; F55-T59 PolarHBondContact O-OG1 3.41Å |
| 56 | V | 87.2 | Confident | 81 | Confident | 28 Ų | 28 | 93.7 Ų | 93.7 | 17% | 0.17 | 48% | 0.475 | C | S | . | . | H | α-helix | trans | -62.2 | -52.4 | 175.6 | 175.1 | 0 | 0 | 0 | 0 | 110.1 | V41 K52 D53 T59 I60 | V41-V56 HydrophobicContact CG1-CG2 4.17Å; V41-V56 HydrophobicContact CG2-CG2 4.19Å; K52-V56 HydrophobicContact CG-CG2 3.99Å; K52-V56 WeakPolarHBondContact O-CG2 3.38Å; K52-V56 PolarHBondContact O-N 3.16Å; D53-V56 PolarHBondContact O-N 2.68Å; V56-T59 PolarHBondContact O-N 3.4Å; V56-I60 HydrophobicContact CG1-CD1 3.82Å; V56-I60 WeakPolarHBondContact O-CG1 3.36Å; V56-I60 PolarHBondContact O-N 2.85Å |
| 57 | A | 88.9 | Confident | 81.7 | Confident | 51 Ų | 51 | 94 Ų | 94 | 42% | 0.421 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -61.5 | -47.3 | 179.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | D53 T59 I60 V61 | D53-A57 VanDerWaalsContact O-CB 3.24Å; D53-A57 WeakPolarHBondContact O-CB 3.46Å; D53-A57 PolarHBondContact O-N 3.41Å; A57-T59 VanDerWaalsContact C-N 3.31Å; A57-T59 PolarHBondContact O-N 2.87Å; A57-I60 PolarHBondContact O-N 3.22Å; A57-V61 WeakPolarHBondContact O-CG2 3.47Å; A57-V61 PolarHBondContact O-N 2.83Å |
| 58 | T | 89.7 | Confident | 82.6 | Confident | 87 Ų | 87 | 89.6 Ų | 89.6 | 53% | 0.534 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -61 | -39.7 | 175.2 | -62.7 | 0 | 0 | 0 | 0 | 111.5 | Y54 V61 V62 | Y54-T58 VanDerWaalsContact O-CB 3.26Å; Y54-T58 WeakPolarHBondContact O-CB 3.27Å; Y54-T58 PolarHBondContact O-N 3.38Å; Y54-T58 PolarHBondContact O-OG1 3.12Å; T58-V61 PolarHBondContact O-N 2.91Å; T58-V62 HydrophobicContact CG2-CG2 4.22Å; T58-V62 WeakPolarHBondContact O-CB 3.47Å; T58-V62 VanDerWaalsContact O-CG2 3.27Å; T58-V62 WeakPolarHBondContact O-CG2 3.44Å; T58-V62 PolarHBondContact O-N 2.92Å |
| 59 | T | 89.3 | Confident | 83.3 | Confident | 29 Ų | 29 | 86.8 Ų | 86.8 | 18% | 0.178 | 44% | 0.437 | C | S | . | . | H | α-helix | trans | -65.3 | -44 | 176.6 | -58.2 | 0 | 0 | 0 | 0 | 111.2 | V41 F55 V56 A57 V61 V62 V63 | V41-T59 HydrophobicContact CG1-CG2 3.94Å; F55-T59 VanDerWaalsContact O-CB 3.24Å; F55-T59 WeakPolarHBondContact O-CB 3.26Å; F55-T59 PolarHBondContact O-N 3.31Å; F55-T59 PolarHBondContact O-OG1 3.41Å; V56-T59 PolarHBondContact O-N 3.4Å; A57-T59 VanDerWaalsContact C-N 3.31Å; A57-T59 PolarHBondContact O-N 2.87Å; T59-V61 PolarHBondContact O-N 3.49Å; T59-V62 PolarHBondContact O-N 3.27Å; T59-V63 HydrophobicContact CG2-CG2 4.16Å; T59-V63 VanDerWaalsContact O-CB 3.32Å; T59-V63 WeakPolarHBondContact O-CB 3.33Å; T59-V63 VanDerWaalsContact O-CG2 3.23Å; T59-V63 WeakPolarHBondContact O-CG2 3.2Å; T59-V63 PolarHBondContact O-N 3.45Å |
| 60 | I | 88.8 | Confident | 84 | Confident | 82 Ų | 82 | 85.9 Ų | 85.9 | 42% | 0.421 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -59.1 | -48.3 | 175.3 | -68.6 | 165.2 | 0 | 0 | 0 | 110.5 | F38 V56 A57 V63 F64 | F38-I60 HydrophobicContact CD2-CG1 4.07Å; F38-I60 HydrophobicContact CE2-CD1 4.07Å; F38-I60 HydrophobicContact CE2-CG1 3.71Å; V56-I60 HydrophobicContact CG1-CD1 3.82Å; V56-I60 WeakPolarHBondContact O-CG1 3.36Å; V56-I60 PolarHBondContact O-N 2.85Å; A57-I60 PolarHBondContact O-N 3.22Å; I60-V63 PolarHBondContact O-N 2.91Å; I60-F64 VanDerWaalsContact O-CB 3.26Å; I60-F64 WeakPolarHBondContact O-CB 3.36Å; I60-F64 PolarHBondContact O-N 3.42Å |
| 61 | V | 89.9 | Confident | 84.6 | Confident | 99 Ų | 99 | 76.4 Ų | 76.4 | 60% | 0.6 | 41% | 0.407 | S | S | * | . | H | α-helix | trans | -61.8 | -46.3 | 178.7 | 171 | 0 | 0 | 0 | 0 | 111.5 | A57 T58 T59 F65 | A57-V61 WeakPolarHBondContact O-CG2 3.47Å; A57-V61 PolarHBondContact O-N 2.83Å; T58-V61 PolarHBondContact O-N 2.91Å; T59-V61 PolarHBondContact O-N 3.49Å; V61-F65 WeakPolarHBondContact O-CB 3.5Å; V61-F65 PolarHBondContact O-N 2.7Å |
| 62 | V | 88.4 | Confident | 84.9 | Confident | 76 Ų | 76 | 79.3 Ų | 79.3 | 46% | 0.461 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -65.9 | -41.4 | 179.1 | 169.3 | 0 | 0 | 0 | 0 | 111.5 | T58 T59 T66 | T58-V62 HydrophobicContact CG2-CG2 4.22Å; T58-V62 WeakPolarHBondContact O-CB 3.47Å; T58-V62 VanDerWaalsContact O-CG2 3.27Å; T58-V62 WeakPolarHBondContact O-CG2 3.44Å; T58-V62 PolarHBondContact O-N 2.92Å; T59-V62 PolarHBondContact O-N 3.27Å; V62-T66 HydrophobicContact CG1-CG2 4.42Å; V62-T66 VanDerWaalsContact O-CB 3.31Å; V62-T66 WeakPolarHBondContact O-CB 3.44Å; V62-T66 VanDerWaalsContact O-CG2 3.3Å; V62-T66 WeakPolarHBondContact O-CG2 3.45Å; V62-T66 PolarHBondContact O-N 3.43Å; V62-T66 PolarHBondContact O-OG1 2.98Å |
| 63 | V | 90.4 | Very high | 84.7 | Confident | 34 Ų | 34 | 79.6 Ų | 79.6 | 21% | 0.206 | 42% | 0.423 | C | S | . | . | H | α-helix | trans | -67.2 | -47.5 | 177.2 | 172.2 | 0 | 0 | 0 | 0 | 110.6 | T59 I60 T66 V67 | T59-V63 HydrophobicContact CG2-CG2 4.16Å; T59-V63 VanDerWaalsContact O-CB 3.32Å; T59-V63 WeakPolarHBondContact O-CB 3.33Å; T59-V63 VanDerWaalsContact O-CG2 3.23Å; T59-V63 WeakPolarHBondContact O-CG2 3.2Å; T59-V63 PolarHBondContact O-N 3.45Å; I60-V63 PolarHBondContact O-N 2.91Å; V63-T66 PolarHBondContact O-N 2.96Å; V63-T66 PolarHBondContact O-OG1 3.5Å; V63-V67 HydrophobicContact CG1-CG2 4.2Å; V63-V67 VanDerWaalsContact O-CB 3.27Å; V63-V67 WeakPolarHBondContact O-CB 3.43Å; V63-V67 VanDerWaalsContact O-CG2 3.24Å; V63-V67 WeakPolarHBondContact O-CG2 3.34Å; V63-V67 PolarHBondContact O-N 3.26Å |
| 64 | F | 86.5 | Confident | 84.5 | Confident | 140 Ų | 140 | 76.2 Ų | 76.2 | 61% | 0.614 | 40% | 0.404 | S | S | * | . | H | α-helix | trans | -63.1 | -45.5 | 178.7 | -166.2 | -92.3 | 0 | 0 | 0 | 111.9 | I60 M68 | I60-F64 VanDerWaalsContact O-CB 3.26Å; I60-F64 WeakPolarHBondContact O-CB 3.36Å; I60-F64 PolarHBondContact O-N 3.42Å; F64-M68 HydrophobicContact CD1-CG 4.24Å; F64-M68 HydrophobicContact CD1-SD 4.18Å; F64-M68 HydrophobicContact CE1-CG 3.9Å; F64-M68 HydrophobicContact CE1-SD 3.48Å; F64-M68 WeakPolarHBondContact CE1-SD 3.31Å; F64-M68 HydrophobicContact CZ-CG 4.33Å; F64-M68 HydrophobicContact CZ-SD 4.11Å; F64-M68 WeakPolarHBondContact O-CB 3.32Å; F64-M68 PolarHBondContact O-N 3.05Å |
| 65 | F | 84.6 | Confident | 83.5 | Confident | 116 Ų | 116 | 74 Ų | 74 | 51% | 0.509 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -61.3 | -47.6 | 176.1 | 178.9 | -92 | 0 | 0 | 0 | 112 | V61 M68 F69 | V61-F65 WeakPolarHBondContact O-CB 3.5Å; V61-F65 PolarHBondContact O-N 2.7Å; F65-M68 PolarHBondContact O-N 3.13Å; F65-F69 HydrophobicContact CD1-CD2 4.4Å; F65-F69 AromaticContact CD2-CD2 3.99Å; F65-F69 HydrophobicContact CD2-CD2 3.99Å; F65-F69 HydrophobicContact CD2-CE2 4.11Å; F65-F69 AromaticContact CE1-CD2 3.98Å; F65-F69 HydrophobicContact CE1-CD2 3.98Å; F65-F69 HydrophobicContact CE1-CE2 4.41Å; F65-F69 HydrophobicContact CE1-CG 4.41Å; F65-F69 AromaticContact CE2-CD2 3.55Å; F65-F69 HydrophobicContact CE2-CD2 3.55Å; F65-F69 AromaticContact CE2-CE2 3.35Å; F65-F69 HydrophobicContact CE2-CE2 3.35Å; F65-F69 HydrophobicContact CE2-CZ 4.3Å; F65-F69 HydrophobicContact CG-CD2 4.4Å; F65-F69 AromaticContact CZ-CD2 3.53Å; F65-F69 HydrophobicContact CZ-CD2 3.53Å; F65-F69 AromaticContact CZ-CE2 3.52Å; F65-F69 HydrophobicContact CZ-CE2 3.52Å; F65-F69 HydrophobicContact CZ-CG 4.24Å; F65-F69 HydrophobicContact CZ-CZ 4.2Å; F65-F69 WeakPolarHBondContact O-CB 3.27Å; F65-F69 PolarHBondContact O-N 3.21Å |
| 66 | T | 86.1 | Confident | 82.8 | Confident | 26 Ų | 26 | 71.9 Ų | 71.9 | 16% | 0.16 | 40% | 0.396 | C | S | . | . | H | α-helix | trans | -69.8 | -38.9 | -179.3 | 53.6 | 0 | 0 | 0 | 0 | 112.3 | V62 V63 F69 Q70 | V62-T66 HydrophobicContact CG1-CG2 4.42Å; V62-T66 VanDerWaalsContact O-CB 3.31Å; V62-T66 WeakPolarHBondContact O-CB 3.44Å; V62-T66 VanDerWaalsContact O-CG2 3.3Å; V62-T66 WeakPolarHBondContact O-CG2 3.45Å; V62-T66 PolarHBondContact O-N 3.43Å; V62-T66 PolarHBondContact O-OG1 2.98Å; V63-T66 PolarHBondContact O-N 2.96Å; V63-T66 PolarHBondContact O-OG1 3.5Å; T66-F69 PolarHBondContact O-N 3.41Å; T66-Q70 WeakPolarHBondContact O-CB 3.24Å; T66-Q70 WeakPolarHBondContact O-CG 3.14Å; T66-Q70 PolarHBondContact O-N 3.43Å; T66-Q70 PolarHBondContact O-OE1 3.37Å |
| 67 | V | 84.4 | Confident | 82 | Confident | 66 Ų | 66 | 72.4 Ų | 72.4 | 40% | 0.4 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -67.8 | -38.3 | 174.5 | 173 | 0 | 0 | 0 | 0 | 111.6 | V63 G71 | V63-V67 HydrophobicContact CG1-CG2 4.2Å; V63-V67 VanDerWaalsContact O-CB 3.27Å; V63-V67 WeakPolarHBondContact O-CB 3.43Å; V63-V67 VanDerWaalsContact O-CG2 3.24Å; V63-V67 WeakPolarHBondContact O-CG2 3.34Å; V63-V67 PolarHBondContact O-N 3.26Å; V67-G71 VanDerWaalsContact O-CA 3.31Å; V67-G71 WeakPolarHBondContact O-CA 3.2Å; V67-G71 PolarHBondContact O-N 3.45Å |
| 68 | M | 81.8 | Confident | 80.9 | Confident | 90 Ų | 90 | 72.5 Ų | 72.5 | 44% | 0.443 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -63.3 | -53.4 | 171 | -88.8 | -158 | 71.1 | 0 | 0 | 111.7 | F64 F65 G71 L72 | F64-M68 HydrophobicContact CD1-CG 4.24Å; F64-M68 HydrophobicContact CD1-SD 4.18Å; F64-M68 HydrophobicContact CE1-CG 3.9Å; F64-M68 HydrophobicContact CE1-SD 3.48Å; F64-M68 WeakPolarHBondContact CE1-SD 3.31Å; F64-M68 HydrophobicContact CZ-CG 4.33Å; F64-M68 HydrophobicContact CZ-SD 4.11Å; F64-M68 WeakPolarHBondContact O-CB 3.32Å; F64-M68 PolarHBondContact O-N 3.05Å; F65-M68 PolarHBondContact O-N 3.13Å; M68-G71 PolarHBondContact O-N 3.03Å; M68-L72 HydrophobicContact CE-CD1 3.75Å; M68-L72 VanDerWaalsContact O-CB 3.28Å; M68-L72 WeakPolarHBondContact O-CB 3.3Å; M68-L72 VanDerWaalsContact O-CG 3.29Å; M68-L72 WeakPolarHBondContact O-CG 3.17Å; M68-L72 PolarHBondContact O-N 3.46Å |
| 69 | F | 80.8 | Confident | 79.8 | Confident | 114 Ų | 114 | 73.4 Ų | 73.4 | 50% | 0.5 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -63 | -47.3 | -178.2 | -100.3 | -94.9 | 0 | 0 | 0 | 111.7 | F65 T66 T73 | F65-F69 HydrophobicContact CD1-CD2 4.4Å; F65-F69 AromaticContact CD2-CD2 3.99Å; F65-F69 HydrophobicContact CD2-CD2 3.99Å; F65-F69 HydrophobicContact CD2-CE2 4.11Å; F65-F69 AromaticContact CE1-CD2 3.98Å; F65-F69 HydrophobicContact CE1-CD2 3.98Å; F65-F69 HydrophobicContact CE1-CE2 4.41Å; F65-F69 HydrophobicContact CE1-CG 4.41Å; F65-F69 AromaticContact CE2-CD2 3.55Å; F65-F69 HydrophobicContact CE2-CD2 3.55Å; F65-F69 AromaticContact CE2-CE2 3.35Å; F65-F69 HydrophobicContact CE2-CE2 3.35Å; F65-F69 HydrophobicContact CE2-CZ 4.3Å; F65-F69 HydrophobicContact CG-CD2 4.4Å; F65-F69 AromaticContact CZ-CD2 3.53Å; F65-F69 HydrophobicContact CZ-CD2 3.53Å; F65-F69 AromaticContact CZ-CE2 3.52Å; F65-F69 HydrophobicContact CZ-CE2 3.52Å; F65-F69 HydrophobicContact CZ-CG 4.24Å; F65-F69 HydrophobicContact CZ-CZ 4.2Å; F65-F69 WeakPolarHBondContact O-CB 3.27Å; F65-F69 PolarHBondContact O-N 3.21Å; T66-F69 PolarHBondContact O-N 3.41Å; F69-T73 VanDerWaalsContact O-CB 3.29Å; F69-T73 WeakPolarHBondContact O-CB 3.37Å; F69-T73 VanDerWaalsContact O-CG2 3.28Å; F69-T73 WeakPolarHBondContact O-CG2 3.48Å; F69-T73 PolarHBondContact O-N 3.18Å; F69-T73 PolarHBondContact O-OG1 3.49Å |
| 70 | Q | 78.5 | Confident | 78.7 | Confident | 29 Ų | 29 | 81.3 Ų | 81.3 | 14% | 0.136 | 42% | 0.416 | C | S | . | . | H | α-helix | trans | -66.5 | -40.4 | 177.8 | -66.4 | 172.5 | -97.2 | 0 | 0 | 111.5 | Y29 G31 R33 T66 I74 | Y29-Q70 HydrophobicContact CE1-CB 3.97Å; Y29-Q70 HydrophobicContact CE1-CG 3.99Å; Y29-Q70 PolarHBondContact O-NE2 2.94Å; G31-Q70 PolarHBondContact O-NE2 3.27Å; R33-Q70 VanDerWaalsContact CD-OE1 3.26Å; T66-Q70 WeakPolarHBondContact O-CB 3.24Å; T66-Q70 WeakPolarHBondContact O-CG 3.14Å; T66-Q70 PolarHBondContact O-N 3.43Å; T66-Q70 PolarHBondContact O-OE1 3.37Å; Q70-I74 VanDerWaalsContact O-CB 3.23Å; Q70-I74 WeakPolarHBondContact O-CB 3.47Å; Q70-I74 WeakPolarHBondContact O-CG2 3.38Å; Q70-I74 PolarHBondContact O-N 2.81Å |
| 71 | G | 78.6 | Confident | 77.6 | Confident | 46 Ų | 46 | 79 Ų | 79 | 47% | 0.474 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -72.4 | -34.2 | -178.8 | 0 | 0 | 0 | 0 | 0 | 114.5 | V67 M68 I74 | V67-G71 VanDerWaalsContact O-CA 3.31Å; V67-G71 WeakPolarHBondContact O-CA 3.2Å; V67-G71 PolarHBondContact O-N 3.45Å; M68-G71 PolarHBondContact O-N 3.03Å; G71-I74 WeakPolarHBondContact O-CG2 3.37Å |
| 72 | L | 80.3 | Confident | 76.2 | Confident | 98 Ų | 98 | 81.7 Ų | 81.7 | 51% | 0.513 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -74.4 | -42.4 | 171.5 | -70.6 | 174.8 | 0 | 0 | 0 | 111.2 | M68 P76 | M68-L72 HydrophobicContact CE-CD1 3.75Å; M68-L72 VanDerWaalsContact O-CB 3.28Å; M68-L72 WeakPolarHBondContact O-CB 3.3Å; M68-L72 VanDerWaalsContact O-CG 3.29Å; M68-L72 WeakPolarHBondContact O-CG 3.17Å; M68-L72 PolarHBondContact O-N 3.46Å; L72-P76 WeakPolarHBondContact O-CD 3.2Å |
| 73 | T | 72.4 | Confident | 74.5 | Confident | 45 Ų | 45 | 81.4 Ų | 81.4 | 28% | 0.276 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -86.5 | -15.4 | -174.3 | 64.5 | 0 | 0 | 0 | 0 | 114.7 | Y29 F69 K75 P76 L77 | Y29-T73 WeakPolarHBondContact CE1-OG1 3.33Å; Y29-T73 PolarHBondContact OH-OG1 3.01Å; F69-T73 VanDerWaalsContact O-CB 3.29Å; F69-T73 WeakPolarHBondContact O-CB 3.37Å; F69-T73 VanDerWaalsContact O-CG2 3.28Å; F69-T73 WeakPolarHBondContact O-CG2 3.48Å; F69-T73 PolarHBondContact O-N 3.18Å; F69-T73 PolarHBondContact O-OG1 3.49Å; T73-K75 VanDerWaalsContact C-N 3.27Å; T73-K75 PolarHBondContact O-N 3.41Å; T73-P76 VanDerWaalsContact O-CD 3.23Å; T73-P76 WeakPolarHBondContact O-CD 3.37Å; T73-P76 WeakPolarHBondContact O-CG 3.34Å; T73-L77 WeakPolarHBondContact O-CA 3.36Å; T73-L77 WeakPolarHBondContact O-CB 3.24Å; T73-L77 PolarHBondContact O-N 2.8Å |
| 74 | I | 75.8 | Confident | 72.7 | Confident | 50 Ų | 50 | 86.1 Ų | 86.1 | 26% | 0.256 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -58.4 | -38.6 | 176.7 | -171.9 | 67.9 | 0 | 0 | 0 | 111.8 | V26 Y29 Q70 G71 V78 | V26-I74 HydrophobicContact CG1-CD1 4.36Å; Y29-I74 HydrophobicContact CD1-CD1 4.05Å; Q70-I74 VanDerWaalsContact O-CB 3.23Å; Q70-I74 WeakPolarHBondContact O-CB 3.47Å; Q70-I74 WeakPolarHBondContact O-CG2 3.38Å; Q70-I74 PolarHBondContact O-N 2.81Å; G71-I74 WeakPolarHBondContact O-CG2 3.37Å; I74-V78 HydrophobicContact CD1-CG2 3.92Å; I74-V78 HydrophobicContact CG1-CG2 4.17Å; I74-V78 VanDerWaalsContact O-CB 3.24Å; I74-V78 WeakPolarHBondContact O-CB 3.05Å; I74-V78 WeakPolarHBondContact O-CG2 3.48Å; I74-V78 PolarHBondContact O-N 2.77Å |
| 75 | K | 65.7 | Low | 71 | Confident | 131 Ų | 131 | 91.1 Ų | 91.1 | 57% | 0.57 | 45% | 0.452 | S | S | * | . | H | α-helix | trans | -62.6 | -59 | 176.4 | -76.8 | -176.3 | 176.6 | -177.3 | 0 | 112.3 | T73 L77 V78 K79 | T73-K75 VanDerWaalsContact C-N 3.27Å; T73-K75 PolarHBondContact O-N 3.41Å; K75-L77 PolarHBondContact O-N 3.05Å; K75-V78 PolarHBondContact O-N 3.47Å; K75-K79 WeakPolarHBondContact O-CG 3.37Å; K75-K79 PolarHBondContact O-N 3.28Å |
| 76 | P | 70.9 | Confident | 69.1 | Low | 73 Ų | 73 | 89.5 Ų | 89.5 | 47% | 0.474 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -67.1 | -32 | 177.4 | 26.3 | -34.6 | 0 | 0 | 0 | 113 | L72 T73 K79 W80 | L72-P76 WeakPolarHBondContact O-CD 3.2Å; T73-P76 VanDerWaalsContact O-CD 3.23Å; T73-P76 WeakPolarHBondContact O-CD 3.37Å; T73-P76 WeakPolarHBondContact O-CG 3.34Å; P76-K79 PolarHBondContact O-N 3.46Å; P76-W80 WeakPolarHBondContact O-CB 3.41Å; P76-W80 PolarHBondContact O-N 2.84Å |
| 77 | L | 69.4 | Low | 66.9 | Low | 39 Ų | 39 | 93.7 Ų | 93.7 | 20% | 0.204 | 48% | 0.481 | C | S | . | . | H | α-helix | trans | -65.3 | -44.1 | 175.1 | -175.7 | 68.3 | 0 | 0 | 0 | 111 | Y29 T73 K75 W80 L81 | Y29-L77 HydrophobicContact CD1-CD2 3.5Å; Y29-L77 HydrophobicContact CD2-CD2 3.87Å; Y29-L77 HydrophobicContact CE1-CD2 3.92Å; Y29-L77 HydrophobicContact CE2-CD2 4.27Å; Y29-L77 HydrophobicContact CG-CD2 3.49Å; Y29-L77 VanDerWaalsContact CG-CD2 3.49Å; T73-L77 WeakPolarHBondContact O-CA 3.36Å; T73-L77 WeakPolarHBondContact O-CB 3.24Å; T73-L77 PolarHBondContact O-N 2.8Å; K75-L77 PolarHBondContact O-N 3.05Å; L77-W80 HydrophobicContact CD1-CE3 4.08Å; L77-W80 HydrophobicContact CD1-CZ3 4.49Å; L77-W80 PolarHBondContact O-N 2.82Å; L77-L81 WeakPolarHBondContact O-CB 3.29Å; L77-L81 PolarHBondContact O-N 3.4Å |
| 78 | V | 66.2 | Low | 65 | Low | 53 Ų | 53 | 98.4 Ų | 98.4 | 32% | 0.321 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -66.8 | -40.2 | 173.7 | 170.7 | 0 | 0 | 0 | 0 | 110.9 | V26 I74 K75 W80 K82 | V26-V78 HydrophobicContact CG1-CG2 3.99Å; V26-V78 HydrophobicContact CG2-CG2 4.1Å; I74-V78 HydrophobicContact CD1-CG2 3.92Å; I74-V78 HydrophobicContact CG1-CG2 4.17Å; I74-V78 VanDerWaalsContact O-CB 3.24Å; I74-V78 WeakPolarHBondContact O-CB 3.05Å; I74-V78 WeakPolarHBondContact O-CG2 3.48Å; I74-V78 PolarHBondContact O-N 2.77Å; K75-V78 PolarHBondContact O-N 3.47Å; V78-W80 VanDerWaalsContact C-N 3.3Å; V78-W80 PolarHBondContact O-N 3.49Å; V78-K82 WeakPolarHBondContact O-CB 3.45Å; V78-K82 PolarHBondContact O-N 2.87Å |
| 79 | K | 66.4 | Low | 63.6 | Low | 106 Ų | 106 | 103.8 Ų | 103.8 | 46% | 0.461 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -61.1 | -36.2 | 172.1 | -72.6 | -176.4 | 177.7 | -168.4 | 0 | 112.1 | K75 P76 E95 E99 | K75-K79 WeakPolarHBondContact O-CG 3.37Å; K75-K79 PolarHBondContact O-N 3.28Å; P76-K79 PolarHBondContact O-N 3.46Å; K79-E95 WeakPolarHBondContact CE-OE1 3.23Å; K79-E95 IonicContact NZ-OE1 2.69Å; K79-E95 PolarHBondContact NZ-OE1 2.85Å; K79-E99 IonicContact NZ-OE1 2.73Å; K79-E99 PolarHBondContact NZ-OE1 2.81Å |
| 80 | W | 66.8 | Low | 61.9 | Low | 195 Ų | 195 | 107.1 Ų | 107.1 | 74% | 0.739 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -79 | -41.8 | -178.1 | -178.9 | 79.6 | 0 | 0 | 0 | 113.6 | P76 L77 V78 K82 | P76-W80 WeakPolarHBondContact O-CB 3.41Å; P76-W80 PolarHBondContact O-N 2.84Å; L77-W80 HydrophobicContact CD1-CE3 4.08Å; L77-W80 HydrophobicContact CD1-CZ3 4.49Å; L77-W80 PolarHBondContact O-N 2.82Å; V78-W80 VanDerWaalsContact C-N 3.3Å; V78-W80 PolarHBondContact O-N 3.49Å; W80-K82 PolarHBondContact O-N 2.86Å |
| 81 | L | 65.9 | Low | 60.8 | Low | 32 Ų | 32 | 109.5 Ų | 109.5 | 17% | 0.168 | 55% | 0.551 | C | S | . | * | H | α-helix | trans | -68.2 | -25.2 | 173 | -132 | 69 | 0 | 0 | 0 | 111.3 | I22 V25 V26 L77 V83 | I22-L81 HydrophobicContact CB-CD2 4.23Å; I22-L81 HydrophobicContact CG1-CG 4.45Å; I22-L81 HydrophobicContact CG2-CB 4.26Å; I22-L81 HydrophobicContact CG2-CD2 3.77Å; I22-L81 HydrophobicContact CG2-CG 3.97Å; I22-L81 VanDerWaalsContact O-CD2 3.32Å; I22-L81 WeakPolarHBondContact O-CD2 3.4Å; V25-L81 HydrophobicContact CB-CD2 3.83Å; V25-L81 HydrophobicContact CG1-CD1 4.41Å; V25-L81 HydrophobicContact CG1-CD2 3.68Å; V26-L81 HydrophobicContact CG2-CD2 3.79Å; L77-L81 WeakPolarHBondContact O-CB 3.29Å; L77-L81 PolarHBondContact O-N 3.4Å; L81-V83 VanDerWaalsContact C-N 3.26Å; L81-V83 PolarHBondContact O-N 3.44Å |
| 82 | K | 59.4 | Low | 59.9 | Low | 156 Ų | 156 | 111.5 Ų | 111.5 | 68% | 0.678 | 55% | 0.554 | S | S | * | * | S | Bend | trans | -85 | 68.5 | 175.9 | -159.2 | 165.8 | -165.1 | 164.1 | 0 | 112.2 | V78 W80 | V78-K82 WeakPolarHBondContact O-CB 3.45Å; V78-K82 PolarHBondContact O-N 2.87Å; W80-K82 PolarHBondContact O-N 2.86Å |
| 83 | V | 53.8 | Low | 59.3 | Low | 71 Ų | 71 | 112.4 Ų | 112.4 | 43% | 0.43 | 56% | 0.559 | S | S | . | * | trans | 87.1 | 123.5 | 157.2 | -163 | 0 | 0 | 0 | 0 | 117.2 | L81 R85 | L81-V83 VanDerWaalsContact C-N 3.26Å; L81-V83 PolarHBondContact O-N 3.44Å; V83-R85 VanDerWaalsContact C-N 3.3Å; V83-R85 PolarHBondContact O-N 3.01Å | ||
| 84 | P | 53.3 | Low | 58.9 | Low | 132 Ų | 132 | 115.6 Ų | 115.6 | 86% | 0.857 | 57% | 0.574 | S | S | * | * | S | Bend | trans | -69.2 | 88.2 | 155 | 30.8 | -32.7 | 0 | 0 | 0 | 109.9 | ||
| 85 | R | 50.3 | Low | 58.3 | Low | 245 Ų | 245 | 116.7 Ų | 116.7 | 93% | 0.925 | 58% | 0.578 | S | S | * | * | S | Bend | trans | 59 | 92.3 | -180 | -67.2 | -178.2 | 172.7 | 170.6 | -3.3 | 116.9 | V83 | V83-R85 VanDerWaalsContact C-N 3.3Å; V83-R85 PolarHBondContact O-N 3.01Å |
| 86 | S | 43.8 | Very low | 58.3 | Low | 82 Ų | 82 | 113.9 Ų | 113.9 | 57% | 0.573 | 57% | 0.567 | S | S | * | * | trans | -155.3 | 162.2 | 138.2 | 75.5 | 0 | 0 | 0 | 0 | 111 | ||||
| 87 | T | 39.5 | Very low | 58.4 | Low | 115 Ų | 115 | 114.8 Ų | 114.8 | 71% | 0.706 | 57% | 0.567 | S | S | * | * | trans | 56 | 96.1 | -178.1 | -151.4 | 0 | 0 | 0 | 0 | 116.6 | R89 | T87-R89 PolarHBondContact O-N 2.99Š| ||
| 88 | N | 45.7 | Very low | 58.5 | Low | 164 Ų | 164 | 118.3 Ų | 118.3 | 88% | 0.877 | 58% | 0.582 | S | S | * | * | trans | -73.6 | 84.7 | 159.1 | -170.8 | -41.7 | 0 | 0 | 0 | 108 | ||||
| 89 | R | 51.8 | Low | 58.7 | Low | 204 Ų | 204 | 120.1 Ų | 120.1 | 77% | 0.77 | 59% | 0.587 | S | S | * | * | P | Polyproline II helix | trans | -81 | 119.8 | 178.6 | -168.7 | 173 | -173.7 | 139.4 | -0.9 | 108.1 | T87 P91 | T87-R89 PolarHBondContact O-N 2.99Å; R89-P91 VanDerWaalsContact O-N 3.15Å |
| 90 | K | 45.5 | Very low | 58.8 | Low | 184 Ų | 184 | 121.4 Ų | 121.4 | 80% | 0.8 | 59% | 0.589 | S | S | * | * | P | Polyproline II helix | trans | -49.4 | 122.2 | 173.7 | -63.7 | -175.7 | -178.5 | -175.8 | 0 | 108.5 | T92 | K90-T92 PolarHBondContact O-N 3.15Š|
| 91 | P | 55.2 | Low | 59 | Low | 78 Ų | 78 | 114 Ų | 114 | 51% | 0.506 | 57% | 0.57 | S | S | . | * | P | Polyproline II helix | trans | -60.9 | 139.8 | -177.5 | 24.9 | -33.3 | 0 | 0 | 0 | 109 | R89 | R89-P91 VanDerWaalsContact O-N 3.15Š|
| 92 | T | 60.5 | Low | 59.4 | Low | 88 Ų | 88 | 117.6 Ų | 117.6 | 54% | 0.54 | 58% | 0.584 | S | S | . | * | P | Polyproline II helix | trans | -73.9 | 150.5 | 173.9 | 53.1 | 0 | 0 | 0 | 0 | 109.3 | K90 N94 E95 E96 | K90-T92 PolarHBondContact O-N 3.15Å; T92-N94 PolarHBondContact O-N 3.47Å; T92-E95 WeakPolarHBondContact O-CA 3.44Å; T92-E95 WeakPolarHBondContact O-CB 3.48Å; T92-E95 PolarHBondContact O-N 3.44Å; T92-E96 PolarHBondContact O-N 2.89Å |
| 93 | I | 67.1 | Low | 59.8 | Low | 118 Ų | 118 | 114.3 Ų | 114.3 | 61% | 0.605 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -50.9 | -35.6 | -179.8 | -68.6 | 168.8 | 0 | 0 | 0 | 111.7 | E96 I97 | I93-E96 WeakPolarHBondContact O-CB 3.48Å; I93-E96 PolarHBondContact O-N 2.82Å; I93-I97 HydrophobicContact CG2-CD1 3.66Å; I93-I97 HydrophobicContact CG2-CG1 4.25Å; I93-I97 WeakPolarHBondContact O-CB 3.23Å; I93-I97 VanDerWaalsContact O-CG1 3.23Å; I93-I97 WeakPolarHBondContact O-CG1 3.29Å; I93-I97 PolarHBondContact O-N 3.38Å |
| 94 | N | 64.1 | Low | 60.9 | Low | 111 Ų | 111 | 117.4 Ų | 117.4 | 59% | 0.594 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -66.9 | -35.8 | 177.2 | -60.9 | 13.9 | 0 | 0 | 0 | 113 | T92 H98 | T92-N94 PolarHBondContact O-N 3.47Å; N94-H98 WeakPolarHBondContact O-CB 3.28Å; N94-H98 PolarHBondContact O-CD2 2.98Å; N94-H98 VanDerWaalsContact O-CG 3.32Å; N94-H98 PolarHBondContact O-N 3.03Å |
| 95 | E | 63.9 | Low | 62.1 | Low | 73 Ų | 73 | 116.1 Ų | 116.1 | 34% | 0.341 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -67.9 | -45.2 | 172.8 | -173.7 | 166.7 | -156.2 | 0 | 0 | 110 | K79 T92 I97 H98 E99 | K79-E95 WeakPolarHBondContact CE-OE1 3.23Å; K79-E95 IonicContact NZ-OE1 2.69Å; K79-E95 PolarHBondContact NZ-OE1 2.85Å; T92-E95 WeakPolarHBondContact O-CA 3.44Å; T92-E95 WeakPolarHBondContact O-CB 3.48Å; T92-E95 PolarHBondContact O-N 3.44Å; E95-I97 VanDerWaalsContact C-N 3.34Å; E95-I97 PolarHBondContact O-N 2.99Å; E95-H98 PolarHBondContact O-N 3.06Å; E95-H98 VanDerWaalsContact O-N 3.11Å; E95-E99 HydrophobicContact CG-CG 4.35Å; E95-E99 VanDerWaalsContact O-CG 3.29Å; E95-E99 WeakPolarHBondContact O-CG 3.28Å; E95-E99 PolarHBondContact O-N 3.48Å |
| 96 | E | 64.6 | Low | 62.8 | Low | 73 Ų | 73 | 107.6 Ų | 107.6 | 34% | 0.341 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -60.7 | -38.6 | 177.1 | -155.1 | -171.7 | 154.4 | 0 | 0 | 113 | T92 I93 R100 | T92-E96 PolarHBondContact O-N 2.89Å; I93-E96 WeakPolarHBondContact O-CB 3.48Å; I93-E96 PolarHBondContact O-N 2.82Å; E96-R100 VanDerWaalsContact CD-NH1 3.29Å; E96-R100 WeakPolarHBondContact O-CB 3.26Å; E96-R100 WeakPolarHBondContact O-CG 3.31Å; E96-R100 PolarHBondContact O-N 3.3Å; E96-R100 VanDerWaalsContact O-N 3.15Å; E96-R100 IonicContact OE1-CZ 3.09Å; E96-R100 IonicContact OE1-NH1 2.71Å; E96-R100 PolarHBondContact OE1-NH1 2.77Å; E96-R100 IonicContact OE1-NH2 2.69Å; E96-R100 PolarHBondContact OE1-NH2 3.28Å |
| 97 | I | 73.3 | Confident | 64 | Low | 92 Ų | 92 | 107.2 Ų | 107.2 | 47% | 0.472 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -67.1 | -43 | 172.6 | -71.9 | 166.6 | 0 | 0 | 0 | 111 | I93 E95 A101 | I93-I97 HydrophobicContact CG2-CD1 3.66Å; I93-I97 HydrophobicContact CG2-CG1 4.25Å; I93-I97 WeakPolarHBondContact O-CB 3.23Å; I93-I97 VanDerWaalsContact O-CG1 3.23Å; I93-I97 WeakPolarHBondContact O-CG1 3.29Å; I93-I97 PolarHBondContact O-N 3.38Å; E95-I97 VanDerWaalsContact C-N 3.34Å; E95-I97 PolarHBondContact O-N 2.99Å; I97-A101 WeakPolarHBondContact O-CB 3.3Å; I97-A101 PolarHBondContact O-N 2.85Å |
| 98 | H | 71.4 | Confident | 65.5 | Low | 112 Ų | 112 | 103.9 Ų | 103.9 | 52% | 0.519 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -70.7 | -38.3 | -178.6 | -77.7 | -46.8 | 0 | 0 | 0 | 113.4 | N94 E95 F102 | N94-H98 WeakPolarHBondContact O-CB 3.28Å; N94-H98 PolarHBondContact O-CD2 2.98Å; N94-H98 VanDerWaalsContact O-CG 3.32Å; N94-H98 PolarHBondContact O-N 3.03Å; E95-H98 PolarHBondContact O-N 3.06Å; E95-H98 VanDerWaalsContact O-N 3.11Å; H98-F102 WeakPolarHBondContact O-CB 3.15Å; H98-F102 PolarHBondContact O-N 3.23Å |
| 99 | E | 71.4 | Confident | 66.4 | Low | 92 Ų | 92 | 100 Ų | 100 | 43% | 0.43 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -66 | -47 | 174.3 | -56.5 | -80.5 | -178.9 | 0 | 0 | 109.3 | K79 E95 A101 F102 D103 | K79-E99 IonicContact NZ-OE1 2.73Å; K79-E99 PolarHBondContact NZ-OE1 2.81Å; E95-E99 HydrophobicContact CG-CG 4.35Å; E95-E99 VanDerWaalsContact O-CG 3.29Å; E95-E99 WeakPolarHBondContact O-CG 3.28Å; E95-E99 PolarHBondContact O-N 3.48Å; E99-A101 PolarHBondContact O-N 2.63Å; E99-F102 WeakPolarHBondContact O-CB 3.02Å; E99-F102 PolarHBondContact O-N 3.39Å; E99-F102 VanDerWaalsContact O-N 3.14Å; E99-D103 PolarHBondContact O-N 3.48Å |
| 100 | R | 67.9 | Low | 67.1 | Low | 133 Ų | 133 | 94 Ų | 94 | 50% | 0.502 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -60.5 | -41.8 | 174.7 | -77.1 | -177.5 | 180 | 121.3 | 11.5 | 114.1 | E96 F102 D103 H104 | E96-R100 VanDerWaalsContact CD-NH1 3.29Å; E96-R100 WeakPolarHBondContact O-CB 3.26Å; E96-R100 WeakPolarHBondContact O-CG 3.31Å; E96-R100 PolarHBondContact O-N 3.3Å; E96-R100 VanDerWaalsContact O-N 3.15Å; E96-R100 IonicContact OE1-CZ 3.09Å; E96-R100 IonicContact OE1-NH1 2.71Å; E96-R100 PolarHBondContact OE1-NH1 2.77Å; E96-R100 IonicContact OE1-NH2 2.69Å; E96-R100 PolarHBondContact OE1-NH2 3.28Å; R100-F102 VanDerWaalsContact C-N 3.28Å; R100-F102 PolarHBondContact O-N 2.84Å; R100-D103 PolarHBondContact O-N 3.38Å; R100-H104 PolarHBondContact O-CD2 2.87Å; R100-H104 PolarHBondContact O-N 3.41Å |
| 101 | A | 69.9 | Low | 67.8 | Low | 40 Ų | 40 | 91.4 Ų | 91.4 | 33% | 0.331 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -64.5 | -37.1 | 176.8 | 0 | 0 | 0 | 0 | 0 | 110.9 | I97 E99 I105 | I97-A101 WeakPolarHBondContact O-CB 3.3Å; I97-A101 PolarHBondContact O-N 2.85Å; E99-A101 PolarHBondContact O-N 2.63Å; A101-I105 WeakPolarHBondContact O-CB 3.43Å; A101-I105 WeakPolarHBondContact O-CD1 3.18Å; A101-I105 WeakPolarHBondContact O-CG1 3.17Å; A101-I105 PolarHBondContact O-N 3.1Å |
| 102 | F | 74.4 | Confident | 68.4 | Low | 106 Ų | 106 | 94.8 Ų | 94.8 | 47% | 0.465 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -66.5 | -43.3 | 173.8 | -168.6 | -96.3 | 0 | 0 | 0 | 111.8 | H98 E99 R100 H104 I105 L106 | H98-F102 WeakPolarHBondContact O-CB 3.15Å; H98-F102 PolarHBondContact O-N 3.23Å; E99-F102 WeakPolarHBondContact O-CB 3.02Å; E99-F102 PolarHBondContact O-N 3.39Å; E99-F102 VanDerWaalsContact O-N 3.14Å; R100-F102 VanDerWaalsContact C-N 3.28Å; R100-F102 PolarHBondContact O-N 2.84Å; F102-H104 PolarHBondContact O-N 2.96Å; F102-I105 PolarHBondContact O-N 3.12Å; F102-L106 VanDerWaalsContact O-CB 3.28Å; F102-L106 WeakPolarHBondContact O-CB 3.32Å; F102-L106 PolarHBondContact O-N 2.84Å |
| 103 | D | 68.6 | Low | 68.5 | Low | 87 Ų | 87 | 93.7 Ų | 93.7 | 47% | 0.465 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -61 | -41.4 | 174.9 | -73.7 | -25.4 | 0 | 0 | 0 | 112.4 | E99 R100 L106 T107 | E99-D103 PolarHBondContact O-N 3.48Å; R100-D103 PolarHBondContact O-N 3.38Å; D103-L106 PolarHBondContact O-N 3.03Å; D103-T107 WeakPolarHBondContact O-CB 3.43Å; D103-T107 PolarHBondContact O-N 3.26Å; D103-T107 PolarHBondContact O-OG1 2.97Å |
| 104 | H | 77.3 | Confident | 68.2 | Low | 136 Ų | 136 | 91 Ų | 91 | 63% | 0.63 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -68 | -38.7 | 175.5 | -71.6 | -49 | 0 | 0 | 0 | 112.8 | R100 F102 T107 A108 | R100-H104 PolarHBondContact O-CD2 2.87Å; R100-H104 PolarHBondContact O-N 3.41Å; F102-H104 PolarHBondContact O-N 2.96Å; H104-T107 PolarHBondContact O-N 3.42Å; H104-A108 WeakPolarHBondContact O-CB 3.41Å; H104-A108 PolarHBondContact O-N 2.91Å |
| 105 | I | 77 | Confident | 67.7 | Low | 105 Ų | 105 | 92.7 Ų | 92.7 | 54% | 0.538 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -65.8 | -41.7 | 172.9 | -70.7 | 164.3 | 0 | 0 | 0 | 110.3 | A101 F102 T107 A108 V109 | A101-I105 WeakPolarHBondContact O-CB 3.43Å; A101-I105 WeakPolarHBondContact O-CD1 3.18Å; A101-I105 WeakPolarHBondContact O-CG1 3.17Å; A101-I105 PolarHBondContact O-N 3.1Å; F102-I105 PolarHBondContact O-N 3.12Å; I105-T107 VanDerWaalsContact C-N 3.33Å; I105-T107 PolarHBondContact O-N 3.48Å; I105-A108 PolarHBondContact O-N 3.04Å; I105-V109 HydrophobicContact CG2-CG2 4.4Å; I105-V109 WeakPolarHBondContact O-CB 3.41Å; I105-V109 VanDerWaalsContact O-CG2 3.29Å; I105-V109 WeakPolarHBondContact O-CG2 3.42Å; I105-V109 PolarHBondContact O-N 3.41Å |
| 106 | L | 65.7 | Low | 67.4 | Low | 66 Ų | 66 | 95.6 Ų | 95.6 | 35% | 0.346 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -64.1 | -38.8 | 177.2 | -168 | 72.3 | 0 | 0 | 0 | 111.3 | F102 D103 V109 E110 Y118 | F102-L106 VanDerWaalsContact O-CB 3.28Å; F102-L106 WeakPolarHBondContact O-CB 3.32Å; F102-L106 PolarHBondContact O-N 2.84Å; D103-L106 PolarHBondContact O-N 3.03Å; L106-V109 PolarHBondContact O-N 3.35Å; L106-E110 WeakPolarHBondContact O-CB 3.47Å; L106-E110 PolarHBondContact O-N 2.83Å; L106-Y118 HydrophobicContact CD2-CD2 4.13Å; L106-Y118 HydrophobicContact CD2-CE2 4.43Å |
| 107 | T | 68.8 | Low | 67.1 | Low | 74 Ų | 74 | 93 Ų | 93 | 45% | 0.454 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -64.3 | -46.2 | 173.7 | -53.8 | 0 | 0 | 0 | 0 | 111.1 | D103 H104 I105 V109 E110 D111 | D103-T107 WeakPolarHBondContact O-CB 3.43Å; D103-T107 PolarHBondContact O-N 3.26Å; D103-T107 PolarHBondContact O-OG1 2.97Å; H104-T107 PolarHBondContact O-N 3.42Å; I105-T107 VanDerWaalsContact C-N 3.33Å; I105-T107 PolarHBondContact O-N 3.48Å; T107-V109 VanDerWaalsContact C-N 3.31Å; T107-V109 PolarHBondContact O-N 3.49Å; T107-E110 WeakPolarHBondContact O-CB 3.47Å; T107-E110 PolarHBondContact O-N 3.28Å; T107-E110 VanDerWaalsContact O-N 3.15Å; T107-D111 PolarHBondContact O-N 2.78Å |
| 108 | A | 72 | Confident | 66.1 | Low | 46 Ų | 46 | 96.1 Ų | 96.1 | 38% | 0.38 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -64.3 | -34.9 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | H104 I105 I112 | H104-A108 WeakPolarHBondContact O-CB 3.41Å; H104-A108 PolarHBondContact O-N 2.91Å; I105-A108 PolarHBondContact O-N 3.04Å; A108-I112 WeakPolarHBondContact O-CB 3.29Å; A108-I112 WeakPolarHBondContact O-CD1 3.33Å; A108-I112 WeakPolarHBondContact O-CG1 3.45Å; A108-I112 PolarHBondContact O-N 2.86Å |
| 109 | V | 65 | Low | 65.5 | Low | 81 Ų | 81 | 96.6 Ų | 96.6 | 49% | 0.491 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -71.1 | -34.2 | 172.8 | 169.6 | 0 | 0 | 0 | 0 | 111.5 | I105 L106 T107 A113 | I105-V109 HydrophobicContact CG2-CG2 4.4Å; I105-V109 WeakPolarHBondContact O-CB 3.41Å; I105-V109 VanDerWaalsContact O-CG2 3.29Å; I105-V109 WeakPolarHBondContact O-CG2 3.42Å; I105-V109 PolarHBondContact O-N 3.41Å; L106-V109 PolarHBondContact O-N 3.35Å; T107-V109 VanDerWaalsContact C-N 3.31Å; T107-V109 PolarHBondContact O-N 3.49Å; V109-A113 WeakPolarHBondContact O-CB 3.07Å; V109-A113 PolarHBondContact O-N 3.01Å |
| 110 | E | 64.8 | Low | 64.9 | Low | 80 Ų | 80 | 95.9 Ų | 95.9 | 37% | 0.374 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -65.6 | -43.4 | 172.7 | -168.8 | 177.5 | 136.4 | 0 | 0 | 111.2 | L106 T107 A113 G114 G117 Y118 | L106-E110 WeakPolarHBondContact O-CB 3.47Å; L106-E110 PolarHBondContact O-N 2.83Å; T107-E110 WeakPolarHBondContact O-CB 3.47Å; T107-E110 PolarHBondContact O-N 3.28Å; T107-E110 VanDerWaalsContact O-N 3.15Å; E110-A113 PolarHBondContact O-N 3.05Å; E110-G114 PolarHBondContact O-N 3.23Å; E110-G117 WeakPolarHBondContact OE1-CA 3.4Å; E110-G117 PolarHBondContact OE1-N 2.93Å; E110-G117 WeakPolarHBondContact OE2-CA 3.39Å; E110-Y118 PolarHBondContact OE2-N 2.99Å |
| 111 | D | 60.1 | Low | 64.6 | Low | 128 Ų | 128 | 99.7 Ų | 99.7 | 68% | 0.684 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -63.4 | -43.5 | 174.3 | -76.5 | -30.9 | 0 | 0 | 0 | 112 | T107 G114 | T107-D111 PolarHBondContact O-N 2.78Å; D111-G114 PolarHBondContact O-N 2.86Å |
| 112 | I | 67.8 | Low | 64.2 | Low | 149 Ų | 149 | 103.2 Ų | 103.2 | 76% | 0.764 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -69.4 | -36.1 | 177.3 | -70.4 | 164.4 | 0 | 0 | 0 | 111.9 | A108 G114 | A108-I112 WeakPolarHBondContact O-CB 3.29Å; A108-I112 WeakPolarHBondContact O-CD1 3.33Å; A108-I112 WeakPolarHBondContact O-CG1 3.45Å; A108-I112 PolarHBondContact O-N 2.86Å; I112-G114 PolarHBondContact O-N 3.28Å |
| 113 | A | 64.2 | Low | 63.9 | Low | 66 Ų | 66 | 101 Ų | 101 | 55% | 0.545 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -71.7 | -17.5 | 179 | 0 | 0 | 0 | 0 | 0 | 113.1 | V109 E110 L115 | V109-A113 WeakPolarHBondContact O-CB 3.07Å; V109-A113 PolarHBondContact O-N 3.01Å; E110-A113 PolarHBondContact O-N 3.05Å; A113-L115 PolarHBondContact O-N 3.49Å |
| 114 | G | 60 | Low | 63.9 | Low | 61 Ų | 61 | 102.5 Ų | 102.5 | 63% | 0.629 | 53% | 0.525 | S | S | * | . | trans | 68.2 | -15.9 | 169.7 | 0 | 0 | 0 | 0 | 0 | 116.6 | E110 D111 I112 | E110-G114 PolarHBondContact O-N 3.23Å; D111-G114 PolarHBondContact O-N 2.86Å; I112-G114 PolarHBondContact O-N 3.28Å | ||
| 115 | L | 54 | Low | 63.3 | Low | 146 Ų | 146 | 104 Ų | 104 | 76% | 0.764 | 53% | 0.526 | S | S | * | . | S | Bend | trans | -132.3 | 108.4 | -179.1 | -74.6 | 175.7 | 0 | 0 | 0 | 112.2 | A113 | A113-L115 PolarHBondContact O-N 3.49Š|
| 116 | Q | 56.5 | Low | 63.1 | Low | 135 Ų | 135 | 102 Ų | 102 | 63% | 0.631 | 51% | 0.514 | S | S | * | . | trans | 69.4 | 88.5 | 152.2 | -150.4 | 87.3 | -12.6 | 0 | 0 | 116.5 | H120 | Q116-H120 HydrophobicContact CB-CB 3.86Å; Q116-H120 HydrophobicContact CG-CB 3.6Å; Q116-H120 WeakPolarHBondContact O-CB 3.49Å | ||
| 117 | G | 58.9 | Low | 63.6 | Low | 19 Ų | 19 | 104.2 Ų | 104.2 | 20% | 0.196 | 52% | 0.523 | C | S | . | . | 64.4 | 131.5 | 120.3 | 0 | 0 | 0 | 0 | 0 | 119.8 | E110 H119 H120 | E110-G117 WeakPolarHBondContact OE1-CA 3.4Å; E110-G117 PolarHBondContact OE1-N 2.93Å; E110-G117 WeakPolarHBondContact OE2-CA 3.39Å; G117-H119 CarbonylContact O-C 3.59Å; G117-H119 PolarHBondContact O-N 3.23Å; G117-H120 WeakPolarHBondContact O-CB 3.23Å; G117-H120 PolarHBondContact O-N 3.43Å | |||
| 118 | Y | 53.4 | Low | 64 | Low | 156 Ų | 156 | 105.3 Ų | 105.3 | 61% | 0.612 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -37.9 | -37.5 | 158 | -175.3 | -98.4 | 0 | 0 | 0 | 114.2 | L106 E110 R122 | L106-Y118 HydrophobicContact CD2-CD2 4.13Å; L106-Y118 HydrophobicContact CD2-CE2 4.43Å; E110-Y118 PolarHBondContact OE2-N 2.99Å; Y118-R122 WeakPolarHBondContact O-CB 3.44Å; Y118-R122 PolarHBondContact O-N 3.07Å |
| 119 | H | 57.5 | Low | 64.2 | Low | 123 Ų | 123 | 105.8 Ų | 105.8 | 57% | 0.569 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -69.1 | -33.3 | 175 | -67.4 | -75.2 | 0 | 0 | 0 | 114.5 | G117 R122 D123 | G117-H119 CarbonylContact O-C 3.59Å; G117-H119 PolarHBondContact O-N 3.23Å; H119-R122 WeakPolarHBondContact O-CB 3.39Å; H119-R122 PolarHBondContact O-N 2.86Å; H119-D123 WeakPolarHBondContact O-CB 3.2Å; H119-D123 PolarHBondContact O-N 3.43Å |
| 120 | H | 60.1 | Low | 64.7 | Low | 76 Ų | 76 | 106.3 Ų | 106.3 | 35% | 0.352 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -66.2 | -46.2 | -176 | -165.4 | 62.7 | 0 | 0 | 0 | 112.6 | Q116 G117 R122 D123 K124 | Q116-H120 HydrophobicContact CB-CB 3.86Å; Q116-H120 HydrophobicContact CG-CB 3.6Å; Q116-H120 WeakPolarHBondContact O-CB 3.49Å; G117-H120 WeakPolarHBondContact O-CB 3.23Å; G117-H120 PolarHBondContact O-N 3.43Å; H120-R122 VanDerWaalsContact C-N 3.33Å; H120-D123 PolarHBondContact O-N 2.74Å; H120-K124 WeakPolarHBondContact NE2-CE 3.43Å; H120-K124 WeakPolarHBondContact O-CB 3.21Å; H120-K124 WeakPolarHBondContact O-CG 3.42Å; H120-K124 PolarHBondContact O-N 2.94Å |
| 121 | W | 60.4 | Low | 65.2 | Low | 213 Ų | 213 | 106.4 Ų | 106.4 | 81% | 0.807 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -63.3 | -41.8 | 174.8 | -82.4 | 79.5 | 0 | 0 | 0 | 111.2 | D123 W125 | W121-D123 PolarHBondContact O-N 3.38Å; W121-W125 VanDerWaalsContact O-CB 3.24Å; W121-W125 WeakPolarHBondContact O-CB 3.29Å; W121-W125 PolarHBondContact O-N 2.77Å |
| 122 | R | 62.8 | Low | 65.6 | Low | 114 Ų | 114 | 107.6 Ų | 107.6 | 43% | 0.43 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -61.5 | -42.7 | 175.6 | -161.9 | -157.4 | 77.6 | 85.1 | 13.5 | 112.2 | Y118 H119 H120 W125 E126 | Y118-R122 WeakPolarHBondContact O-CB 3.44Å; Y118-R122 PolarHBondContact O-N 3.07Å; H119-R122 WeakPolarHBondContact O-CB 3.39Å; H119-R122 PolarHBondContact O-N 2.86Å; H120-R122 VanDerWaalsContact C-N 3.33Å; R122-W125 PolarHBondContact O-N 2.98Å; R122-E126 IonicContact CZ-OE2 2.75Å; R122-E126 IonicContact NH1-OE2 3.21Å; R122-E126 PolarHBondContact NH1-OE2 3.47Å; R122-E126 IonicContact NH2-OE2 2.86Å; R122-E126 PolarHBondContact NH2-OE2 3.03Å; R122-E126 WeakPolarHBondContact O-CB 3.42Å; R122-E126 PolarHBondContact O-N 2.69Å |
| 123 | D | 66.7 | Low | 65.7 | Low | 60 Ų | 60 | 103.4 Ų | 103.4 | 32% | 0.321 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -80.4 | -34.5 | -176.2 | -62.1 | -10.5 | 0 | 0 | 0 | 111.5 | H119 H120 W121 W125 E126 Q127 | H119-D123 WeakPolarHBondContact O-CB 3.2Å; H119-D123 PolarHBondContact O-N 3.43Å; H120-D123 PolarHBondContact O-N 2.74Å; W121-D123 PolarHBondContact O-N 3.38Å; D123-W125 VanDerWaalsContact C-N 3.34Å; D123-E126 PolarHBondContact O-N 2.73Å; D123-Q127 VanDerWaalsContact O-CB 3.3Å; D123-Q127 WeakPolarHBondContact O-CB 3.47Å; D123-Q127 WeakPolarHBondContact O-CG 3.37Å; D123-Q127 PolarHBondContact O-N 3.06Å |
| 124 | K | 69.5 | Low | 65.8 | Low | 118 Ų | 118 | 100.7 Ų | 100.7 | 51% | 0.513 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -60 | -43.7 | 166 | -75.5 | -94.9 | -169.7 | 168.4 | 0 | 110.9 | H120 Q127 F128 | H120-K124 WeakPolarHBondContact NE2-CE 3.43Å; H120-K124 WeakPolarHBondContact O-CB 3.21Å; H120-K124 WeakPolarHBondContact O-CG 3.42Å; H120-K124 PolarHBondContact O-N 2.94Å; K124-Q127 PolarHBondContact O-N 2.84Å; K124-F128 WeakPolarHBondContact O-CB 3.17Å; K124-F128 PolarHBondContact O-N 3.39Å |
| 125 | W | 64.8 | Low | 66.2 | Low | 169 Ų | 169 | 104.6 Ų | 104.6 | 64% | 0.64 | 47% | 0.467 | S | S | * | . | H | α-helix | trans | -66.4 | -43.5 | 175.1 | -175.1 | -91 | 0 | 0 | 0 | 111.5 | W121 R122 D123 Q127 F128 D129 | W121-W125 VanDerWaalsContact O-CB 3.24Å; W121-W125 WeakPolarHBondContact O-CB 3.29Å; W121-W125 PolarHBondContact O-N 2.77Å; R122-W125 PolarHBondContact O-N 2.98Å; D123-W125 VanDerWaalsContact C-N 3.34Å; W125-Q127 VanDerWaalsContact C-N 3.29Å; W125-Q127 PolarHBondContact O-N 3.11Å; W125-F128 PolarHBondContact O-N 2.83Å; W125-D129 VanDerWaalsContact O-CB 3.27Å; W125-D129 WeakPolarHBondContact O-CB 3.38Å; W125-D129 PolarHBondContact O-N 3.31Å |
| 126 | E | 71.8 | Confident | 66.9 | Low | 63 Ų | 63 | 104.6 Ų | 104.6 | 29% | 0.294 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -65.3 | -31.9 | 176.4 | -158.7 | -178.6 | 130 | 0 | 0 | 111.9 | R122 D123 K130 | R122-E126 IonicContact CZ-OE2 2.75Å; R122-E126 IonicContact NH1-OE2 3.21Å; R122-E126 PolarHBondContact NH1-OE2 3.47Å; R122-E126 IonicContact NH2-OE2 2.86Å; R122-E126 PolarHBondContact NH2-OE2 3.03Å; R122-E126 WeakPolarHBondContact O-CB 3.42Å; R122-E126 PolarHBondContact O-N 2.69Å; D123-E126 PolarHBondContact O-N 2.73Å; E126-K130 HydrophobicContact CG-CD 4.39Å; E126-K130 VanDerWaalsContact O-CB 3.29Å; E126-K130 WeakPolarHBondContact O-CB 3.18Å; E126-K130 WeakPolarHBondContact O-CD 3.21Å; E126-K130 WeakPolarHBondContact O-CG 3.16Å; E126-K130 PolarHBondContact O-N 2.9Å; E126-K130 WeakPolarHBondContact OE1-CE 3.29Å; E126-K130 IonicContact OE1-NZ 2.58Å; E126-K130 PolarHBondContact OE1-NZ 3.41Å |
| 127 | Q | 75.8 | Confident | 67.2 | Low | 112 Ų | 112 | 104.1 Ų | 104.1 | 52% | 0.523 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -70.8 | -41.4 | 170.5 | -74.3 | 164.6 | 13.5 | 0 | 0 | 112.3 | D123 K124 W125 N131 | D123-Q127 VanDerWaalsContact O-CB 3.3Å; D123-Q127 WeakPolarHBondContact O-CB 3.47Å; D123-Q127 WeakPolarHBondContact O-CG 3.37Å; D123-Q127 PolarHBondContact O-N 3.06Å; K124-Q127 PolarHBondContact O-N 2.84Å; W125-Q127 VanDerWaalsContact C-N 3.29Å; W125-Q127 PolarHBondContact O-N 3.11Å; Q127-N131 WeakPolarHBondContact O-CB 3.16Å; Q127-N131 PolarHBondContact O-N 2.84Å; Q127-N131 PolarHBondContact O-ND2 3.14Å; Q127-N131 VanDerWaalsContact O-ND2 3.12Å |
| 128 | F | 77 | Confident | 67.4 | Low | 97 Ų | 97 | 107 Ų | 107 | 43% | 0.425 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -67.5 | -43.4 | 176.5 | -179.6 | -95.9 | 0 | 0 | 0 | 111.6 | K124 W125 N131 Y132 L133 | K124-F128 WeakPolarHBondContact O-CB 3.17Å; K124-F128 PolarHBondContact O-N 3.39Å; W125-F128 PolarHBondContact O-N 2.83Å; F128-N131 PolarHBondContact O-N 3.15Å; F128-Y132 AromaticContact CD2-CD2 3.46Å; F128-Y132 HydrophobicContact CD2-CD2 3.46Å; F128-Y132 VanDerWaalsContact CD2-CD2 3.46Å; F128-Y132 AromaticContact CD2-CE2 3.99Å; F128-Y132 HydrophobicContact CD2-CE2 3.99Å; F128-Y132 HydrophobicContact CD2-CG 4.32Å; F128-Y132 AromaticContact CE2-CD2 3.66Å; F128-Y132 HydrophobicContact CE2-CD2 3.66Å; F128-Y132 HydrophobicContact CE2-CE2 4.27Å; F128-Y132 HydrophobicContact CE2-CG 4.12Å; F128-Y132 HydrophobicContact CG-CD2 4.19Å; F128-Y132 WeakPolarHBondContact O-CB 3.38Å; F128-Y132 PolarHBondContact O-N 3.02Å; F128-L133 PolarHBondContact O-N 2.96Å |
| 129 | D | 77.1 | Confident | 67.6 | Low | 56 Ų | 56 | 109.6 Ų | 109.6 | 30% | 0.299 | 49% | 0.488 | S | S | . | . | I | π-helix | trans | -56.5 | -59.7 | 172 | 177.5 | 67.6 | 0 | 0 | 0 | 110.3 | W125 N131 L133 S134 | W125-D129 VanDerWaalsContact O-CB 3.27Å; W125-D129 WeakPolarHBondContact O-CB 3.38Å; W125-D129 PolarHBondContact O-N 3.31Å; D129-N131 VanDerWaalsContact C-N 3.31Å; D129-N131 PolarHBondContact O-N 2.91Å; D129-L133 HydrophobicContact CB-CB 4.49Å; D129-L133 CarbonylContact O-C 3.59Å; D129-L133 PolarHBondContact O-N 3.33Å; D129-L133 VanDerWaalsContact O-N 3.07Å; D129-L133 WeakPolarHBondContact OD1-CD2 3.27Å; D129-S134 WeakPolarHBondContact O-CB 3.3Å; D129-S134 PolarHBondContact O-N 3.48Å |
| 130 | K | 74.6 | Confident | 67.4 | Low | 92 Ų | 92 | 113.3 Ų | 113.3 | 40% | 0.4 | 50% | 0.502 | S | S | . | . | I | π-helix | trans | -57.6 | -41.1 | 178.4 | -73.3 | 170 | -176 | 169.8 | 0 | 112.9 | E126 S134 | E126-K130 HydrophobicContact CG-CD 4.39Å; E126-K130 VanDerWaalsContact O-CB 3.29Å; E126-K130 WeakPolarHBondContact O-CB 3.18Å; E126-K130 WeakPolarHBondContact O-CD 3.21Å; E126-K130 WeakPolarHBondContact O-CG 3.16Å; E126-K130 PolarHBondContact O-N 2.9Å; E126-K130 WeakPolarHBondContact OE1-CE 3.29Å; E126-K130 IonicContact OE1-NZ 2.58Å; E126-K130 PolarHBondContact OE1-NZ 3.41Å; K130-S134 PolarHBondContact O-OG 3.4Å |
| 131 | N | 75.1 | Confident | 67.2 | Low | 81 Ų | 81 | 113.9 Ų | 113.9 | 43% | 0.433 | 52% | 0.515 | S | S | . | . | I | π-helix | trans | -81.2 | -32 | -174.3 | -80.5 | -46.8 | 0 | 0 | 0 | 115.7 | Q127 F128 D129 K135 | Q127-N131 WeakPolarHBondContact O-CB 3.16Å; Q127-N131 PolarHBondContact O-N 2.84Å; Q127-N131 PolarHBondContact O-ND2 3.14Å; Q127-N131 VanDerWaalsContact O-ND2 3.12Å; F128-N131 PolarHBondContact O-N 3.15Å; D129-N131 VanDerWaalsContact C-N 3.31Å; D129-N131 PolarHBondContact O-N 2.91Å; N131-K135 WeakPolarHBondContact O-CD 3.45Å; N131-K135 WeakPolarHBondContact O-CE 3.49Å; N131-K135 PolarHBondContact O-NZ 3.47Å; N131-K135 PolarHBondContact OD1-NZ 2.84Å |
| 132 | Y | 69.8 | Low | 66.9 | Low | 154 Ų | 154 | 108.1 Ų | 108.1 | 60% | 0.604 | 50% | 0.503 | S | S | * | . | I | π-helix | trans | -121.6 | -59.8 | -174.6 | -60 | -80.4 | 0 | 0 | 0 | 111 | F128 S134 K135 L136 | F128-Y132 AromaticContact CD2-CD2 3.46Å; F128-Y132 HydrophobicContact CD2-CD2 3.46Å; F128-Y132 VanDerWaalsContact CD2-CD2 3.46Å; F128-Y132 AromaticContact CD2-CE2 3.99Å; F128-Y132 HydrophobicContact CD2-CE2 3.99Å; F128-Y132 HydrophobicContact CD2-CG 4.32Å; F128-Y132 AromaticContact CE2-CD2 3.66Å; F128-Y132 HydrophobicContact CE2-CD2 3.66Å; F128-Y132 HydrophobicContact CE2-CE2 4.27Å; F128-Y132 HydrophobicContact CE2-CG 4.12Å; F128-Y132 HydrophobicContact CG-CD2 4.19Å; F128-Y132 WeakPolarHBondContact O-CB 3.38Å; F128-Y132 PolarHBondContact O-N 3.02Å; Y132-S134 PolarHBondContact O-N 3.28Å; Y132-K135 PolarHBondContact O-N 3.29Å; Y132-L136 VanDerWaalsContact O-CB 3.3Å; Y132-L136 WeakPolarHBondContact O-CB 3.24Å; Y132-L136 PolarHBondContact O-N 3.41Å |
| 133 | L | 69.3 | Low | 66.3 | Low | 61 Ų | 61 | 110 Ų | 110 | 32% | 0.319 | 51% | 0.511 | S | S | . | . | I | π-helix | trans | -63.6 | -44.7 | -171.4 | -146.7 | 78.2 | 0 | 0 | 0 | 112.1 | F128 D129 K135 L136 L137 | F128-L133 PolarHBondContact O-N 2.96Å; D129-L133 HydrophobicContact CB-CB 4.49Å; D129-L133 CarbonylContact O-C 3.59Å; D129-L133 PolarHBondContact O-N 3.33Å; D129-L133 VanDerWaalsContact O-N 3.07Å; D129-L133 WeakPolarHBondContact OD1-CD2 3.27Å; L133-K135 PolarHBondContact O-N 3.46Å; L133-L136 PolarHBondContact O-N 2.78Å; L133-L137 HydrophobicContact CD1-CD1 4.48Å; L133-L137 HydrophobicContact CD2-CD1 4.21Å; L133-L137 HydrophobicContact CG-CD1 3.8Å; L133-L137 HydrophobicContact CG-CG 4.47Å; L133-L137 VanDerWaalsContact O-CB 3.32Å; L133-L137 WeakPolarHBondContact O-CB 3.2Å; L133-L137 VanDerWaalsContact O-CG 3.31Å; L133-L137 WeakPolarHBondContact O-CG 3.11Å; L133-L137 PolarHBondContact O-N 3.38Å |
| 134 | S | 65.9 | Low | 65.6 | Low | 9 Ų | 9 | 117.6 Ų | 117.6 | 6% | 0.063 | 54% | 0.535 | C | S | . | . | H | α-helix | trans | -66.3 | -37.3 | 177.7 | 93.8 | 0 | 0 | 0 | 0 | 112 | D129 K130 Y132 L136 L138 | D129-S134 WeakPolarHBondContact O-CB 3.3Å; D129-S134 PolarHBondContact O-N 3.48Å; K130-S134 PolarHBondContact O-OG 3.4Å; Y132-S134 PolarHBondContact O-N 3.28Å; S134-L136 VanDerWaalsContact C-N 3.33Å; S134-L138 WeakPolarHBondContact O-CA 3.06Å; S134-L138 WeakPolarHBondContact O-CB 3.28Å; S134-L138 PolarHBondContact O-N 2.8Å |
| 135 | K | 68.9 | Low | 64.9 | Low | 142 Ų | 142 | 118.5 Ų | 118.5 | 62% | 0.617 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -73.8 | -25.5 | 177.2 | -58.4 | -173.5 | -161.6 | 141.7 | 0 | 112.6 | N131 Y132 L133 | N131-K135 WeakPolarHBondContact O-CD 3.45Å; N131-K135 WeakPolarHBondContact O-CE 3.49Å; N131-K135 PolarHBondContact O-NZ 3.47Å; N131-K135 PolarHBondContact OD1-NZ 2.84Å; Y132-K135 PolarHBondContact O-N 3.29Å; L133-K135 PolarHBondContact O-N 3.46Å |
| 136 | L | 68.3 | Low | 64.7 | Low | 146 Ų | 146 | 113.5 Ų | 113.5 | 76% | 0.764 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -84 | -37.9 | 177.2 | -162.4 | 78.3 | 0 | 0 | 0 | 112.3 | Y132 L133 S134 | Y132-L136 VanDerWaalsContact O-CB 3.3Å; Y132-L136 WeakPolarHBondContact O-CB 3.24Å; Y132-L136 PolarHBondContact O-N 3.41Å; L133-L136 PolarHBondContact O-N 2.78Å; S134-L136 VanDerWaalsContact C-N 3.33Å |
| 137 | L | 63.5 | Low | 64.7 | Low | 126 Ų | 126 | 118.8 Ų | 118.8 | 66% | 0.66 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -100.5 | -33.9 | -173.2 | -58.8 | 179.1 | 0 | 0 | 0 | 114.1 | L133 | L133-L137 HydrophobicContact CD1-CD1 4.48Å; L133-L137 HydrophobicContact CD2-CD1 4.21Å; L133-L137 HydrophobicContact CG-CD1 3.8Å; L133-L137 HydrophobicContact CG-CG 4.47Å; L133-L137 VanDerWaalsContact O-CB 3.32Å; L133-L137 WeakPolarHBondContact O-CB 3.2Å; L133-L137 VanDerWaalsContact O-CG 3.31Å; L133-L137 WeakPolarHBondContact O-CG 3.11Å; L133-L137 PolarHBondContact O-N 3.38Å |
| 138 | L | 62.4 | Low | 64.6 | Low | 78 Ų | 78 | 119.9 Ų | 119.9 | 41% | 0.408 | 56% | 0.563 | S | S | . | * | S | Bend | trans | -89.6 | 111.4 | 179.9 | -56.8 | 177.8 | 0 | 0 | 0 | 111 | S134 V142 Y143 | S134-L138 WeakPolarHBondContact O-CA 3.06Å; S134-L138 WeakPolarHBondContact O-CB 3.28Å; S134-L138 PolarHBondContact O-N 2.8Å; L138-V142 HydrophobicContact CD2-CG1 4.27Å; L138-Y143 HydrophobicContact CD1-CD2 4.4Å |
| 139 | R | 58.3 | Low | 64.4 | Low | 211 Ų | 211 | 122.2 Ų | 122.2 | 80% | 0.796 | 57% | 0.569 | S | S | * | * | trans | -59.3 | 138.8 | 167 | -174.6 | 171.6 | -72.5 | -132.8 | -1.2 | 109.5 | S141 V142 | R139-S141 PolarHBondContact O-N 2.97Å; R139-V142 PolarHBondContact O-N 2.8Å | ||
| 140 | K | 53.7 | Low | 64.5 | Low | 201 Ų | 201 | 124.1 Ų | 124.1 | 87% | 0.874 | 58% | 0.576 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -46.9 | -22 | -169.1 | -70.4 | -177.2 | 176 | 179.6 | 0 | 117.1 | ||
| 141 | S | 56.2 | Low | 64.8 | Low | 89 Ų | 89 | 121.9 Ų | 121.9 | 62% | 0.622 | 58% | 0.575 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.6 | -29 | 176.3 | 45.8 | 0 | 0 | 0 | 0 | 114.3 | R139 | R139-S141 PolarHBondContact O-N 2.97Š|
| 142 | V | 53.6 | Low | 65.2 | Low | 91 Ų | 91 | 124.4 Ų | 124.4 | 55% | 0.552 | 58% | 0.58 | S | S | * | * | S | Bend | trans | -85.9 | -19.7 | -172.2 | -174.4 | 0 | 0 | 0 | 0 | 112.8 | L138 R139 R144 | L138-V142 HydrophobicContact CD2-CG1 4.27Å; R139-V142 PolarHBondContact O-N 2.8Å; V142-R144 CarbonylContact O-C 3.59Å; V142-R144 PolarHBondContact O-N 3.24Å |
| 143 | Y | 50.7 | Low | 65.7 | Low | 153 Ų | 153 | 121.3 Ų | 121.3 | 60% | 0.6 | 57% | 0.571 | S | S | * | * | S | Bend | trans | -72.8 | -17.3 | 179.4 | -152.1 | -85.9 | 0 | 0 | 0 | 113.1 | L138 K145 | L138-Y143 HydrophobicContact CD1-CD2 4.4Å; Y143-K145 VanDerWaalsContact C-N 3.34Å; Y143-K145 PolarHBondContact O-N 3.26Å |
| 144 | R | 52.2 | Low | 66.6 | Low | 220 Ų | 220 | 125.2 Ų | 125.2 | 83% | 0.83 | 59% | 0.585 | S | S | * | * | S | Bend | trans | -72.2 | 96 | 157.6 | -68.7 | -168.4 | -161.4 | 176.1 | 6.1 | 107.9 | V142 S146 | V142-R144 CarbonylContact O-C 3.59Å; V142-R144 PolarHBondContact O-N 3.24Å; R144-S146 PolarHBondContact O-N 2.84Å; R144-S146 VanDerWaalsContact O-N 3.12Å |
| 145 | K | 54.7 | Low | 67.5 | Low | 138 Ų | 138 | 128.9 Ų | 128.9 | 60% | 0.6 | 60% | 0.603 | S | S | * | * | trans | -50.2 | 120.3 | 146.2 | -67.6 | -176.8 | -178 | -178.3 | 0 | 106.6 | Y143 E150 | Y143-K145 VanDerWaalsContact C-N 3.34Å; Y143-K145 PolarHBondContact O-N 3.26Å; K145-E150 HydrophobicContact CB-CG 4.49Å; K145-E150 HydrophobicContact CD-CG 4.15Å; K145-E150 WeakPolarHBondContact CD-OE1 3.42Å; K145-E150 IonicContact NZ-OE1 3.43Å; K145-E150 PolarHBondContact NZ-OE1 2.82Å | ||
| 146 | S | 60.1 | Low | 68.1 | Low | 63 Ų | 63 | 126.1 Ų | 126.1 | 44% | 0.441 | 60% | 0.595 | S | S | . | * | trans | -64.8 | 140.6 | 171.4 | 50 | 0 | 0 | 0 | 0 | 108.5 | R144 L148 W149 E150 | R144-S146 PolarHBondContact O-N 2.84Å; R144-S146 VanDerWaalsContact O-N 3.12Å; S146-L148 PolarHBondContact O-N 2.88Å; S146-L148 VanDerWaalsContact O-N 3.1Å; S146-W149 WeakPolarHBondContact O-CB 3.46Å; S146-W149 PolarHBondContact O-N 3.39Å; S146-E150 PolarHBondContact O-N 2.99Å | ||
| 147 | E | 70.7 | Confident | 68.8 | Low | 175 Ų | 175 | 123.4 Ų | 123.4 | 82% | 0.818 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -56.7 | -28.7 | 174.5 | -61.1 | -178.8 | 149.1 | 0 | 0 | 110.9 | W149 E150 A151 | E147-W149 VanDerWaalsContact C-N 3.32Å; E147-W149 PolarHBondContact O-N 3.42Å; E147-E150 PolarHBondContact O-N 3.12Å; E147-A151 VanDerWaalsContact O-CB 3.25Å; E147-A151 WeakPolarHBondContact O-CB 3.45Å; E147-A151 PolarHBondContact O-N 3.18Å |
| 148 | L | 73.5 | Confident | 69.8 | Low | 135 Ų | 135 | 125 Ų | 125 | 71% | 0.707 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -53.7 | -40.5 | 168.8 | -176.1 | 65.4 | 0 | 0 | 0 | 113.7 | S146 Y152 | S146-L148 PolarHBondContact O-N 2.88Å; S146-L148 VanDerWaalsContact O-N 3.1Å; L148-Y152 WeakPolarHBondContact O-CB 3.42Å; L148-Y152 PolarHBondContact O-N 2.87Å |
| 149 | W | 74.6 | Confident | 70.5 | Confident | 145 Ų | 145 | 125 Ų | 125 | 55% | 0.549 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -70.5 | -42.3 | 177.4 | -179.5 | -90.6 | 0 | 0 | 0 | 111.6 | S146 E147 Y152 Q153 | S146-W149 WeakPolarHBondContact O-CB 3.46Å; S146-W149 PolarHBondContact O-N 3.39Å; E147-W149 VanDerWaalsContact C-N 3.32Å; E147-W149 PolarHBondContact O-N 3.42Å; W149-Y152 PolarHBondContact O-N 2.82Å; W149-Q153 VanDerWaalsContact O-CB 3.31Å; W149-Q153 WeakPolarHBondContact O-CB 3.4Å; W149-Q153 PolarHBondContact O-N 3.38Å |
| 150 | E | 78.9 | Confident | 71.3 | Confident | 96 Ų | 96 | 117.4 Ų | 117.4 | 45% | 0.449 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -71.8 | -34 | 178.6 | -57.8 | -155.1 | 145.5 | 0 | 0 | 111.5 | K145 S146 E147 K154 | K145-E150 HydrophobicContact CB-CG 4.49Å; K145-E150 HydrophobicContact CD-CG 4.15Å; K145-E150 WeakPolarHBondContact CD-OE1 3.42Å; K145-E150 IonicContact NZ-OE1 3.43Å; K145-E150 PolarHBondContact NZ-OE1 2.82Å; S146-E150 PolarHBondContact O-N 2.99Å; E147-E150 PolarHBondContact O-N 3.12Å; E150-K154 WeakPolarHBondContact O-CB 3.11Å; E150-K154 PolarHBondContact O-N 3.47Å |
| 151 | A | 81.4 | Confident | 72.4 | Confident | 45 Ų | 45 | 112.9 Ų | 112.9 | 37% | 0.372 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -63.5 | -48.2 | 169.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | E147 Q153 K154 I155 | E147-A151 VanDerWaalsContact O-CB 3.25Å; E147-A151 WeakPolarHBondContact O-CB 3.45Å; E147-A151 PolarHBondContact O-N 3.18Å; A151-Q153 PolarHBondContact O-N 3.31Å; A151-K154 PolarHBondContact O-N 3.5Å; A151-I155 WeakPolarHBondContact O-CB 3.34Å; A151-I155 VanDerWaalsContact O-CG1 3.27Å; A151-I155 WeakPolarHBondContact O-CG1 3.13Å; A151-I155 PolarHBondContact O-N 3.44Å |
| 152 | Y | 81.7 | Confident | 73.2 | Confident | 134 Ų | 134 | 110.6 Ų | 110.6 | 53% | 0.525 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -59.8 | -46.2 | 176.2 | 177.4 | -103.6 | 0 | 0 | 0 | 111.9 | L148 W149 K154 I155 N156 | L148-Y152 WeakPolarHBondContact O-CB 3.42Å; L148-Y152 PolarHBondContact O-N 2.87Å; W149-Y152 PolarHBondContact O-N 2.82Å; Y152-K154 VanDerWaalsContact C-N 3.34Å; Y152-K154 PolarHBondContact O-N 2.89Å; Y152-I155 PolarHBondContact O-N 2.8Å; Y152-N156 VanDerWaalsContact O-CB 3.3Å; Y152-N156 WeakPolarHBondContact O-CB 3.21Å; Y152-N156 PolarHBondContact O-N 2.69Å |
| 153 | Q | 81.1 | Confident | 74.3 | Confident | 90 Ų | 90 | 111 Ų | 111 | 42% | 0.421 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -63.3 | -39.4 | 176.2 | -176.1 | 173.1 | -9.3 | 0 | 0 | 111.9 | W149 A151 I157 | W149-Q153 VanDerWaalsContact O-CB 3.31Å; W149-Q153 WeakPolarHBondContact O-CB 3.4Å; W149-Q153 PolarHBondContact O-N 3.38Å; A151-Q153 PolarHBondContact O-N 3.31Å; Q153-I157 HydrophobicContact CG-CD1 3.84Å; Q153-I157 WeakPolarHBondContact O-CB 3.49Å; Q153-I157 VanDerWaalsContact O-CG1 3.23Å; Q153-I157 WeakPolarHBondContact O-CG1 3Å; Q153-I157 PolarHBondContact O-N 3.13Å |
| 154 | K | 87.5 | Confident | 75.1 | Confident | 142 Ų | 142 | 110.3 Ų | 110.3 | 62% | 0.617 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -68.7 | -35.1 | 177.3 | -176 | 177.1 | -175.6 | 176.5 | 0 | 113 | E150 A151 Y152 R158 | E150-K154 WeakPolarHBondContact O-CB 3.11Å; E150-K154 PolarHBondContact O-N 3.47Å; A151-K154 PolarHBondContact O-N 3.5Å; Y152-K154 VanDerWaalsContact C-N 3.34Å; Y152-K154 PolarHBondContact O-N 2.89Å; K154-R158 VanDerWaalsContact O-CB 3.28Å; K154-R158 WeakPolarHBondContact O-CB 3.28Å; K154-R158 PolarHBondContact O-N 2.86Å; K154-R158 VanDerWaalsContact O-N 3.13Å |
| 155 | I | 85.9 | Confident | 75.9 | Confident | 87 Ų | 87 | 106.6 Ų | 106.6 | 45% | 0.446 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -67.5 | -55.9 | 171.7 | -70.1 | 163 | 0 | 0 | 0 | 109.1 | A151 Y152 I157 R158 D159 | A151-I155 WeakPolarHBondContact O-CB 3.34Å; A151-I155 VanDerWaalsContact O-CG1 3.27Å; A151-I155 WeakPolarHBondContact O-CG1 3.13Å; A151-I155 PolarHBondContact O-N 3.44Å; Y152-I155 PolarHBondContact O-N 2.8Å; I155-I157 VanDerWaalsContact C-N 3.29Å; I155-I157 PolarHBondContact O-N 2.95Å; I155-R158 CarbonylContact O-C 3.56Å; I155-R158 WeakPolarHBondContact O-CA 3.45Å; I155-R158 WeakPolarHBondContact O-CB 3.48Å; I155-R158 PolarHBondContact O-N 3.36Å; I155-D159 VanDerWaalsContact CG2-OD2 3.24Å; I155-D159 WeakPolarHBondContact CG2-OD2 3.25Å; I155-D159 PolarHBondContact O-N 3.43Å |
| 156 | N | 81.8 | Confident | 76.3 | Confident | 83 Ų | 83 | 106.9 Ų | 106.9 | 44% | 0.444 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -58.5 | -37.5 | -176.9 | -160.5 | -7.4 | 0 | 0 | 0 | 112.8 | Y152 A160 | Y152-N156 VanDerWaalsContact O-CB 3.3Å; Y152-N156 WeakPolarHBondContact O-CB 3.21Å; Y152-N156 PolarHBondContact O-N 2.69Å; N156-A160 WeakPolarHBondContact O-CB 2.99Å; N156-A160 PolarHBondContact O-N 2.71Å; N156-A160 VanDerWaalsContact O-N 3.07Å |
| 157 | I | 83.4 | Confident | 75.7 | Confident | 90 Ų | 90 | 104.9 Ų | 104.9 | 46% | 0.462 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -68.1 | -42.7 | 171.8 | -70 | 169.1 | 0 | 0 | 0 | 112 | Q153 I155 I161 | Q153-I157 HydrophobicContact CG-CD1 3.84Å; Q153-I157 WeakPolarHBondContact O-CB 3.49Å; Q153-I157 VanDerWaalsContact O-CG1 3.23Å; Q153-I157 WeakPolarHBondContact O-CG1 3Å; Q153-I157 PolarHBondContact O-N 3.13Å; I155-I157 VanDerWaalsContact C-N 3.29Å; I155-I157 PolarHBondContact O-N 2.95Å; I157-I161 HydrophobicContact CG2-CD1 3.79Å; I157-I161 WeakPolarHBondContact O-CB 3.14Å; I157-I161 WeakPolarHBondContact O-CD1 3.31Å; I157-I161 VanDerWaalsContact O-CG1 3.24Å; I157-I161 WeakPolarHBondContact O-CG1 3.43Å; I157-I161 PolarHBondContact O-N 2.73Å |
| 158 | R | 82.6 | Confident | 74.8 | Confident | 158 Ų | 158 | 99.8 Ų | 99.8 | 60% | 0.596 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -62.7 | -44.3 | 176.8 | 174.4 | -175.5 | -70 | 169.9 | -7.2 | 111.2 | K154 I155 I161 S162 | K154-R158 VanDerWaalsContact O-CB 3.28Å; K154-R158 WeakPolarHBondContact O-CB 3.28Å; K154-R158 PolarHBondContact O-N 2.86Å; K154-R158 VanDerWaalsContact O-N 3.13Å; I155-R158 CarbonylContact O-C 3.56Å; I155-R158 WeakPolarHBondContact O-CA 3.45Å; I155-R158 WeakPolarHBondContact O-CB 3.48Å; I155-R158 PolarHBondContact O-N 3.36Å; R158-I161 PolarHBondContact O-N 2.95Å; R158-S162 WeakPolarHBondContact O-CB 3.41Å; R158-S162 PolarHBondContact O-N 2.89Å; R158-S162 PolarHBondContact O-OG 3.15Å |
| 159 | D | 78.9 | Confident | 73.8 | Confident | 78 Ų | 78 | 99 Ų | 99 | 42% | 0.417 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -65 | -48.2 | -177.5 | -62.3 | -8 | 0 | 0 | 0 | 109.5 | I155 I161 S162 V163 | I155-D159 VanDerWaalsContact CG2-OD2 3.24Å; I155-D159 WeakPolarHBondContact CG2-OD2 3.25Å; I155-D159 PolarHBondContact O-N 3.43Å; D159-I161 VanDerWaalsContact C-N 3.32Å; D159-I161 PolarHBondContact O-N 2.82Å; D159-S162 WeakPolarHBondContact CA-OG 3.3Å; D159-S162 PolarHBondContact O-N 3.23Å; D159-S162 VanDerWaalsContact O-N 3.08Å; D159-S162 PolarHBondContact O-OG 3.43Å; D159-V163 WeakPolarHBondContact O-CG2 3.35Å; D159-V163 PolarHBondContact O-N 2.85Å |
| 160 | A | 74.8 | Confident | 72.7 | Confident | 52 Ų | 52 | 96.8 Ų | 96.8 | 43% | 0.43 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -56.9 | -40.9 | 173.3 | 0 | 0 | 0 | 0 | 0 | 113.2 | N156 I164 | N156-A160 WeakPolarHBondContact O-CB 2.99Å; N156-A160 PolarHBondContact O-N 2.71Å; N156-A160 VanDerWaalsContact O-N 3.07Å; A160-I164 WeakPolarHBondContact O-CD1 3.36Å; A160-I164 WeakPolarHBondContact O-CG1 3.2Å; A160-I164 PolarHBondContact O-N 2.82Å |
| 161 | I | 75.5 | Confident | 71.3 | Confident | 106 Ų | 106 | 100 Ų | 100 | 54% | 0.544 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -65.8 | -44.5 | 173.9 | -70.1 | 166.5 | 0 | 0 | 0 | 110.7 | I157 R158 D159 V163 I164 D165 | I157-I161 HydrophobicContact CG2-CD1 3.79Å; I157-I161 WeakPolarHBondContact O-CB 3.14Å; I157-I161 WeakPolarHBondContact O-CD1 3.31Å; I157-I161 VanDerWaalsContact O-CG1 3.24Å; I157-I161 WeakPolarHBondContact O-CG1 3.43Å; I157-I161 PolarHBondContact O-N 2.73Å; R158-I161 PolarHBondContact O-N 2.95Å; D159-I161 VanDerWaalsContact C-N 3.32Å; D159-I161 PolarHBondContact O-N 2.82Å; I161-V163 VanDerWaalsContact C-N 3.33Å; I161-V163 PolarHBondContact O-N 3.43Å; I161-I164 PolarHBondContact O-N 2.95Å; I161-I164 VanDerWaalsContact O-N 3.1Å; I161-D165 WeakPolarHBondContact O-CB 3.09Å; I161-D165 PolarHBondContact O-N 3.12Å |
| 162 | S | 73.9 | Confident | 69.6 | Low | 42 Ų | 42 | 102.9 Ų | 102.9 | 29% | 0.294 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -66.1 | -32.2 | -179.2 | 71.7 | 0 | 0 | 0 | 0 | 113.3 | R158 D159 I164 D165 Q166 | R158-S162 WeakPolarHBondContact O-CB 3.41Å; R158-S162 PolarHBondContact O-N 2.89Å; R158-S162 PolarHBondContact O-OG 3.15Å; D159-S162 WeakPolarHBondContact CA-OG 3.3Å; D159-S162 PolarHBondContact O-N 3.23Å; D159-S162 VanDerWaalsContact O-N 3.08Å; D159-S162 PolarHBondContact O-OG 3.43Å; S162-I164 VanDerWaalsContact C-N 3.33Å; S162-D165 PolarHBondContact O-N 3.06Å; S162-Q166 WeakPolarHBondContact O-CB 3.3Å; S162-Q166 VanDerWaalsContact O-CG 3.31Å; S162-Q166 WeakPolarHBondContact O-CG 3.27Å; S162-Q166 PolarHBondContact O-N 3.38Å |
| 163 | V | 75.8 | Confident | 67.6 | Low | 100 Ų | 100 | 101 Ų | 101 | 61% | 0.606 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -65.9 | -36.4 | 172 | 169.2 | 0 | 0 | 0 | 0 | 111.2 | D159 I161 G167 | D159-V163 WeakPolarHBondContact O-CG2 3.35Å; D159-V163 PolarHBondContact O-N 2.85Å; I161-V163 VanDerWaalsContact C-N 3.33Å; I161-V163 PolarHBondContact O-N 3.43Å; V163-G167 VanDerWaalsContact O-CA 3.28Å; V163-G167 WeakPolarHBondContact O-CA 3.48Å; V163-G167 PolarHBondContact O-N 3.35Å |
| 164 | I | 68.5 | Low | 65.9 | Low | 138 Ų | 138 | 101.2 Ų | 101.2 | 71% | 0.708 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -73.5 | -33.6 | 175.6 | -65.7 | 165.1 | 0 | 0 | 0 | 111.5 | A160 I161 S162 G167 | A160-I164 WeakPolarHBondContact O-CD1 3.36Å; A160-I164 WeakPolarHBondContact O-CG1 3.2Å; A160-I164 PolarHBondContact O-N 2.82Å; I161-I164 PolarHBondContact O-N 2.95Å; I161-I164 VanDerWaalsContact O-N 3.1Å; S162-I164 VanDerWaalsContact C-N 3.33Å; I164-G167 WeakPolarHBondContact O-CA 3.32Å |
| 165 | D | 68.1 | Low | 63.8 | Low | 141 Ų | 141 | 105.4 Ų | 105.4 | 75% | 0.754 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -80.3 | -39.3 | -177.5 | -159.5 | 51.4 | 0 | 0 | 0 | 112.9 | I161 S162 | I161-D165 WeakPolarHBondContact O-CB 3.09Å; I161-D165 PolarHBondContact O-N 3.12Å; S162-D165 PolarHBondContact O-N 3.06Å |
| 166 | Q | 63.4 | Low | 61.6 | Low | 145 Ų | 145 | 108.9 Ų | 108.9 | 68% | 0.678 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -70.9 | -41.2 | 168.1 | -65.8 | 175.6 | 5.7 | 0 | 0 | 110.5 | S162 | S162-Q166 WeakPolarHBondContact O-CB 3.3Å; S162-Q166 VanDerWaalsContact O-CG 3.31Å; S162-Q166 WeakPolarHBondContact O-CG 3.27Å; S162-Q166 PolarHBondContact O-N 3.38Å |
| 167 | G | 48.3 | Very low | 59.3 | Low | 20 Ų | 20 | 110.2 Ų | 110.2 | 21% | 0.206 | 62% | 0.622 | C | S | . | * | G | 310 helix | trans | 78.8 | -174.2 | 135.1 | 0 | 0 | 0 | 0 | 0 | 118.7 | V163 I164 N169 V170 | V163-G167 VanDerWaalsContact O-CA 3.28Å; V163-G167 WeakPolarHBondContact O-CA 3.48Å; V163-G167 PolarHBondContact O-N 3.35Å; I164-G167 WeakPolarHBondContact O-CA 3.32Å; G167-N169 PolarHBondContact O-N 2.58Å; G167-V170 PolarHBondContact O-N 2.73Å |
| 168 | G | 51.9 | Low | 56.9 | Low | 69 Ų | 69 | 114 Ų | 114 | 71% | 0.711 | 64% | 0.642 | S | S | * | * | G | 310 helix | trans | -65.4 | 9.4 | 176 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||
| 169 | N | 52.4 | Low | 54.7 | Low | 118 Ų | 118 | 112.1 Ų | 112.1 | 63% | 0.631 | 65% | 0.65 | S | S | * | * | G | 310 helix | trans | -97.1 | -13.5 | -179.9 | -70.9 | -20.2 | 0 | 0 | 0 | 113.4 | G167 L171 T172 S173 | G167-N169 PolarHBondContact O-N 2.58Å; N169-L171 VanDerWaalsContact C-N 3.28Å; N169-L171 PolarHBondContact O-N 2.76Å; N169-T172 PolarHBondContact O-N 2.93Å; N169-S173 PolarHBondContact O-OG 2.9Å |
| 170 | V | 50.6 | Low | 52.8 | Low | 98 Ų | 98 | 114 Ų | 114 | 59% | 0.594 | 67% | 0.669 | S | S | * | * | H | α-helix | trans | -62.8 | -35.9 | 178.7 | -176.3 | 0 | 0 | 0 | 0 | 111.7 | G167 T172 | G167-V170 PolarHBondContact O-N 2.73Å; V170-T172 PolarHBondContact O-N 2.75Å |
| 171 | L | 49.8 | Very low | 50.8 | Low | 164 Ų | 164 | 120.2 Ų | 120.2 | 86% | 0.859 | 69% | 0.692 | S | S | * | * | H | α-helix | trans | -66.6 | -19.2 | -179.8 | -64.1 | 178 | 0 | 0 | 0 | 114.2 | N169 | N169-L171 VanDerWaalsContact C-N 3.28Å; N169-L171 PolarHBondContact O-N 2.76Å |
| 172 | T | 45 | Very low | 48.7 | Very low | 105 Ų | 105 | 119.3 Ų | 119.3 | 64% | 0.644 | 70% | 0.7 | S | S | * | * | H | α-helix | trans | -93.5 | -30.5 | -176.2 | -44.1 | 0 | 0 | 0 | 0 | 112.2 | N169 V170 | N169-T172 PolarHBondContact O-N 2.93Å; V170-T172 PolarHBondContact O-N 2.75Å |
| 173 | S | 41 | Very low | 46.9 | Very low | 95 Ų | 95 | 122.7 Ų | 122.7 | 66% | 0.664 | 72% | 0.724 | S | S | * | * | H | α-helix | trans | -85.6 | -22.8 | -168.1 | -57.7 | 0 | 0 | 0 | 0 | 114.4 | N169 R175 | N169-S173 PolarHBondContact O-OG 2.9Å; S173-R175 PolarHBondContact O-N 2.83Å |
| 174 | A | 43.9 | Very low | 45 | Very low | 94 Ų | 94 | 129.9 Ų | 129.9 | 78% | 0.777 | 74% | 0.74 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.5 | 4 | -176.4 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||
| 175 | R | 43.2 | Very low | 43.2 | Very low | 230 Ų | 230 | 127.5 Ų | 127.5 | 87% | 0.868 | 74% | 0.741 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -95.7 | 7.8 | -169.1 | -132.2 | 176.9 | -167.9 | 161.6 | 7 | 115.9 | S173 | S173-R175 PolarHBondContact O-N 2.83Š|
| 176 | L | 41.1 | Very low | 41.7 | Very low | 161 Ų | 161 | 125.1 Ų | 125.1 | 84% | 0.843 | 74% | 0.736 | S | S | * | * | trans | -138.9 | 67.8 | -172.4 | -68.5 | 176.1 | 0 | 0 | 0 | 114.1 | ||||
| 177 | S | 33.6 | Very low | 40.2 | Very low | 111 Ų | 111 | 127.5 Ų | 127.5 | 78% | 0.776 | 74% | 0.744 | S | S | * | * | trans | -168.8 | 96.7 | 150.2 | 17.7 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 178 | L | 31.6 | Very low | 40.1 | Very low | 168 Ų | 168 | 130.8 Ų | 130.8 | 88% | 0.88 | 76% | 0.761 | S | S | * | * | trans | 65 | 165.5 | 152.4 | -53.5 | 174 | 0 | 0 | 0 | 118.4 | ||||
| 179 | P | 38 | Very low | 39.7 | Very low | 119 Ų | 119 | 136.3 Ų | 136.3 | 77% | 0.773 | 77% | 0.769 | S | S | * | * | cis | -118.7 | 178.1 | -45.3 | 36.8 | -24.8 | 0 | 0 | 0 | 112 | ||||
| 180 | S | 38 | Very low | 39.5 | Very low | 117 Ų | 117 | 136.3 Ų | 136.3 | 82% | 0.818 | 77% | 0.773 | S | S | * | * | trans | -70.3 | 129.3 | -179.8 | -178.6 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 181 | M | 32.6 | Very low | 39.4 | Very low | 184 Ų | 184 | 135.4 Ų | 135.4 | 91% | 0.906 | 77% | 0.768 | S | S | * | * | trans | -148.4 | 151.1 | 146.1 | -82.9 | -130.6 | 74.9 | 0 | 0 | 109.7 | ||||
| 182 | A | 32.3 | Very low | 39.4 | Very low | 86 Ų | 86 | 132.4 Ų | 132.4 | 71% | 0.711 | 75% | 0.753 | S | S | * | * | trans | -107.6 | 126.8 | -168.2 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 183 | S | 35.4 | Very low | 39.6 | Very low | 113 Ų | 113 | 132.7 Ų | 132.7 | 79% | 0.79 | 75% | 0.754 | S | S | * | * | trans | 45.2 | 102.2 | 139.3 | -54.3 | 0 | 0 | 0 | 0 | 120.2 | ||||
| 184 | R | 36.2 | Very low | 40 | Very low | 251 Ų | 251 | 132 Ų | 132 | 95% | 0.947 | 75% | 0.746 | S | S | * | * | -176.5 | 164 | 117 | -102.2 | 161 | 171.5 | 150.6 | -2.4 | 113.2 | |||||
| 185 | A | 30.1 | Very low | 40.3 | Very low | 89 Ų | 89 | 131 Ų | 131 | 74% | 0.736 | 73% | 0.728 | S | S | * | * | trans | 71.6 | 92.7 | 171.8 | 0 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 186 | S | 37 | Very low | 40.7 | Very low | 91 Ų | 91 | 128.4 Ų | 128.4 | 64% | 0.636 | 72% | 0.719 | S | S | * | * | 28.9 | 145.6 | 128.3 | 57.2 | 0 | 0 | 0 | 0 | 123 | |||||
| 187 | F | 32.6 | Very low | 41.1 | Very low | 195 Ų | 195 | 126.6 Ų | 126.6 | 86% | 0.855 | 71% | 0.709 | S | S | * | * | trans | 99.9 | 151.5 | 166.3 | -58.1 | -64.4 | 0 | 0 | 0 | 115.7 | ||||
| 188 | P | 45.3 | Very low | 41.9 | Very low | 88 Ų | 88 | 129.7 Ų | 129.7 | 57% | 0.571 | 70% | 0.704 | S | S | * | * | -95.2 | 130.3 | -125.6 | 33.4 | -37.7 | 0 | 0 | 0 | 116.7 | V190 | P188-V190 PolarHBondContact O-N 3.23Š| |||
| 189 | E | 43.9 | Very low | 42.6 | Very low | 186 Ų | 186 | 129.3 Ų | 129.3 | 87% | 0.869 | 70% | 0.698 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.2 | 52.4 | 179.2 | -158.5 | 177 | 170 | 0 | 0 | 113.1 | ||
| 190 | V | 48.2 | Very low | 43 | Very low | 117 Ų | 117 | 129.8 Ų | 129.8 | 71% | 0.709 | 69% | 0.694 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -127.7 | -27.8 | 178.5 | -173 | 0 | 0 | 0 | 0 | 112.4 | P188 N192 | P188-V190 PolarHBondContact O-N 3.23Å; V190-N192 PolarHBondContact O-N 2.84Å |
| 191 | T | 48.8 | Very low | 43.3 | Very low | 79 Ų | 79 | 127.6 Ų | 127.6 | 49% | 0.485 | 69% | 0.689 | S | S | . | * | H | α-helix | trans | -79.9 | -15.5 | -173.8 | 44.9 | 0 | 0 | 0 | 0 | 115.3 | N195 | T191-N195 PolarHBondContact O-N 3.39Å; T191-N195 PolarHBondContact O-ND2 3.4Å |
| 192 | N | 49.1 | Very low | 43.8 | Very low | 102 Ų | 102 | 122.9 Ų | 122.9 | 55% | 0.545 | 67% | 0.674 | S | S | . | * | H | α-helix | trans | -76.8 | -37.1 | -166.9 | -65 | -10.8 | 0 | 0 | 0 | 112.9 | V190 T194 N195 Y196 | V190-N192 PolarHBondContact O-N 2.84Å; N192-T194 VanDerWaalsContact C-N 3.32Å; N192-T194 PolarHBondContact O-N 3.1Å; N192-N195 PolarHBondContact O-N 3.46Å; N192-Y196 PolarHBondContact O-N 2.75Å |
| 193 | V | 50.2 | Low | 44.5 | Very low | 110 Ų | 110 | 122.8 Ų | 122.8 | 67% | 0.667 | 68% | 0.682 | S | S | * | * | H | α-helix | trans | -64.8 | -39 | 176 | -175.7 | 0 | 0 | 0 | 0 | 110.9 | N195 Y196 L197 | V193-N195 VanDerWaalsContact C-N 3.32Å; V193-N195 PolarHBondContact O-N 2.86Å; V193-Y196 PolarHBondContact O-N 2.96Å; V193-L197 PolarHBondContact O-N 3.33Å |
| 194 | T | 49.9 | Very low | 45 | Very low | 82 Ų | 82 | 122 Ų | 122 | 50% | 0.503 | 67% | 0.673 | S | S | . | * | H | α-helix | trans | -68.7 | -29.2 | -179.7 | -26.2 | 0 | 0 | 0 | 0 | 112.9 | N192 | N192-T194 VanDerWaalsContact C-N 3.32Å; N192-T194 PolarHBondContact O-N 3.1Å |
| 195 | N | 49.9 | Very low | 45.3 | Very low | 73 Ų | 73 | 116.5 Ų | 116.5 | 39% | 0.39 | 67% | 0.671 | S | S | . | * | H | α-helix | trans | -79.6 | -38.1 | 176.2 | -76.1 | -27.9 | 0 | 0 | 0 | 112.4 | T191 N192 V193 L197 R198 E199 | T191-N195 PolarHBondContact O-N 3.39Å; T191-N195 PolarHBondContact O-ND2 3.4Å; N192-N195 PolarHBondContact O-N 3.46Å; V193-N195 VanDerWaalsContact C-N 3.32Å; V193-N195 PolarHBondContact O-N 2.86Å; N195-L197 VanDerWaalsContact C-N 3.29Å; N195-L197 PolarHBondContact O-N 3.07Å; N195-R198 WeakPolarHBondContact O-CA 3.23Å; N195-R198 WeakPolarHBondContact O-CB 3.37Å; N195-R198 PolarHBondContact O-N 2.91Å; N195-R198 PolarHBondContact OD1-NH1 2.88Å; N195-E199 PolarHBondContact O-N 3.25Å; N195-E199 VanDerWaalsContact O-N 3.13Å |
| 196 | Y | 50.6 | Low | 45.9 | Very low | 174 Ų | 174 | 119.4 Ų | 119.4 | 68% | 0.682 | 67% | 0.673 | S | S | * | * | H | α-helix | trans | -60.8 | -36.5 | 175.9 | -109.5 | -80.5 | 0 | 0 | 0 | 113.2 | N192 V193 R198 | N192-Y196 PolarHBondContact O-N 2.75Å; V193-Y196 PolarHBondContact O-N 2.96Å; Y196-R198 VanDerWaalsContact C-N 3.29Å; Y196-R198 PolarHBondContact O-N 3.26Å |
| 197 | L | 49.5 | Very low | 46.2 | Very low | 123 Ų | 123 | 120.9 Ų | 120.9 | 64% | 0.644 | 67% | 0.674 | S | S | * | * | H | α-helix | trans | -74.3 | -18.4 | 173.8 | -67.6 | 173.6 | 0 | 0 | 0 | 113.4 | V193 N195 | V193-L197 PolarHBondContact O-N 3.33Å; N195-L197 VanDerWaalsContact C-N 3.29Å; N195-L197 PolarHBondContact O-N 3.07Å |
| 198 | R | 50.3 | Low | 47 | Very low | 176 Ų | 176 | 117.7 Ų | 117.7 | 66% | 0.664 | 67% | 0.665 | S | S | * | * | H | α-helix | trans | -83.4 | -35.4 | 179.3 | 179.6 | 178.5 | -73.7 | 149.2 | -7.1 | 112.7 | N195 Y196 | N195-R198 WeakPolarHBondContact O-CA 3.23Å; N195-R198 WeakPolarHBondContact O-CB 3.37Å; N195-R198 PolarHBondContact O-N 2.91Å; N195-R198 PolarHBondContact OD1-NH1 2.88Å; Y196-R198 VanDerWaalsContact C-N 3.29Å; Y196-R198 PolarHBondContact O-N 3.26Å |
| 199 | E | 46.9 | Very low | 47 | Very low | 161 Ų | 161 | 121.4 Ų | 121.4 | 75% | 0.752 | 68% | 0.675 | S | S | * | * | H | α-helix | trans | -70.1 | -33.1 | 175.7 | -74.9 | -166.3 | 122.2 | 0 | 0 | 112.7 | N195 G201 | N195-E199 PolarHBondContact O-N 3.25Å; N195-E199 VanDerWaalsContact O-N 3.13Å; E199-G201 PolarHBondContact O-N 3.01Å |
| 200 | N | 45.9 | Very low | 47 | Very low | 129 Ų | 129 | 118.6 Ų | 118.6 | 69% | 0.69 | 67% | 0.67 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.7 | 20.1 | -178.2 | -75.2 | 1.8 | 0 | 0 | 0 | 115 | S202 | N200-S202 PolarHBondContact O-N 2.79Š|
| 201 | G | 43.8 | Very low | 46.8 | Very low | 70 Ų | 70 | 118.2 Ų | 118.2 | 72% | 0.722 | 66% | 0.663 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 69.8 | 2.1 | 164 | 0 | 0 | 0 | 0 | 0 | 117.6 | E199 G203 | E199-G201 PolarHBondContact O-N 3.01Å; G201-G203 PolarHBondContact O-N 2.89Å |
| 202 | S | 44 | Very low | 46.3 | Very low | 85 Ų | 85 | 121.3 Ų | 121.3 | 59% | 0.594 | 68% | 0.677 | S | S | * | * | trans | -83.4 | 99.7 | 179.6 | -168.4 | 0 | 0 | 0 | 0 | 111.4 | N200 V204 | N200-S202 PolarHBondContact O-N 2.79Å; S202-V204 PolarHBondContact O-N 2.84Å | ||
| 203 | G | 47.5 | Very low | 46.1 | Very low | 84 Ų | 84 | 122.2 Ų | 122.2 | 87% | 0.866 | 68% | 0.681 | S | S | * | * | trans | -72.2 | 44.5 | -179 | 0 | 0 | 0 | 0 | 0 | 115.4 | G201 | G201-G203 PolarHBondContact O-N 2.89Š| ||
| 204 | V | 44.7 | Very low | 45.7 | Very low | 98 Ų | 98 | 122.6 Ų | 122.6 | 59% | 0.594 | 68% | 0.684 | S | S | * | * | trans | -115.6 | 97.9 | -175.1 | -178.4 | 0 | 0 | 0 | 0 | 110.5 | S202 L206 | S202-V204 PolarHBondContact O-N 2.84Å; V204-L206 VanDerWaalsContact C-N 3.29Å; V204-L206 HydrophobicContact CG1-CD1 4.21Å; V204-L206 HydrophobicContact CG1-CG 3.99Å; V204-L206 PolarHBondContact O-N 3.46Å | ||
| 205 | C | 42.4 | Very low | 45.7 | Very low | 135 Ų | 135 | 124.9 Ų | 124.9 | 91% | 0.912 | 70% | 0.7 | S | S | * | * | trans | -76 | 79.2 | 169.8 | -64.8 | 0 | 0 | 0 | 0 | 110.8 | D207 | C205-D207 PolarHBondContact O-N 3.35Š| ||
| 206 | L | 43.2 | Very low | 45.2 | Very low | 150 Ų | 150 | 123.1 Ų | 123.1 | 79% | 0.785 | 70% | 0.699 | S | S | * | * | trans | -76.1 | 104.3 | 161.1 | -86.6 | 165.8 | 0 | 0 | 0 | 108.7 | V204 L208 | V204-L206 VanDerWaalsContact C-N 3.29Å; V204-L206 HydrophobicContact CG1-CD1 4.21Å; V204-L206 HydrophobicContact CG1-CG 3.99Å; V204-L206 PolarHBondContact O-N 3.46Å; L206-L208 PolarHBondContact O-N 3.24Å | ||
| 207 | D | 44.1 | Very low | 45.3 | Very low | 121 Ų | 121 | 119.7 Ų | 119.7 | 65% | 0.647 | 70% | 0.701 | S | S | * | * | trans | -70.1 | 107.6 | 174.7 | -177.8 | 6 | 0 | 0 | 0 | 110.2 | C205 Q209 | C205-D207 PolarHBondContact O-N 3.35Å; D207-Q209 WeakPolarHBondContact OD1-CB 3.44Å; D207-Q209 PolarHBondContact OD1-N 2.9Å | ||
| 208 | L | 49.7 | Very low | 45.4 | Very low | 129 Ų | 129 | 120.7 Ų | 120.7 | 68% | 0.675 | 70% | 0.7 | S | S | * | * | trans | -105.9 | 13.3 | -179.5 | -159.7 | 60.2 | 0 | 0 | 0 | 112.5 | L206 V210 I211 | L206-L208 PolarHBondContact O-N 3.24Å; L208-V210 PolarHBondContact O-N 3.49Å; L208-I211 HydrophobicContact CD1-CD1 3.64Å; L208-I211 HydrophobicContact CD1-CG1 4.04Å; L208-I211 HydrophobicContact CG-CD1 4.45Å; L208-I211 PolarHBondContact O-N 2.85Å | ||
| 209 | Q | 45.5 | Very low | 45.6 | Very low | 165 Ų | 165 | 116 Ų | 116 | 77% | 0.771 | 69% | 0.691 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.2 | 16.8 | 178.8 | -60.1 | -163 | -54.7 | 0 | 0 | 114.2 | D207 | D207-Q209 WeakPolarHBondContact OD1-CB 3.44Å; D207-Q209 PolarHBondContact OD1-N 2.9Å |
| 210 | V | 42.3 | Very low | 46 | Very low | 128 Ų | 128 | 114.1 Ų | 114.1 | 78% | 0.776 | 68% | 0.682 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -111.2 | 8.8 | -179.9 | -168.1 | 0 | 0 | 0 | 0 | 111.8 | L208 | L208-V210 PolarHBondContact O-N 3.49Š|
| 211 | I | 44.3 | Very low | 46.6 | Very low | 109 Ų | 109 | 113.5 Ų | 113.5 | 56% | 0.559 | 68% | 0.675 | S | S | * | * | trans | -120.8 | 36.8 | 172.5 | -33.7 | -175.6 | 0 | 0 | 0 | 112.2 | L208 N213 | L208-I211 HydrophobicContact CD1-CD1 3.64Å; L208-I211 HydrophobicContact CD1-CG1 4.04Å; L208-I211 HydrophobicContact CG-CD1 4.45Å; L208-I211 PolarHBondContact O-N 2.85Å; I211-N213 PolarHBondContact O-N 3.19Å | ||
| 212 | D | 39 | Very low | 47.1 | Very low | 144 Ų | 144 | 114.8 Ų | 114.8 | 77% | 0.77 | 67% | 0.665 | S | S | * | * | trans | -73.6 | 59.7 | 158.8 | -82.3 | -30.6 | 0 | 0 | 0 | 110.4 | V214 | D212-V214 VanDerWaalsContact C-N 3.28Å; D212-V214 PolarHBondContact O-N 3.19Å | ||
| 213 | N | 44.1 | Very low | 48 | Very low | 120 Ų | 120 | 116.2 Ų | 116.2 | 64% | 0.642 | 66% | 0.664 | S | S | * | * | trans | -71.9 | 85.2 | 170 | -86.8 | -13.2 | 0 | 0 | 0 | 109 | I211 P215 | I211-N213 PolarHBondContact O-N 3.19Å; N213-P215 WeakPolarHBondContact O-CD 3.35Å | ||
| 214 | V | 43.2 | Very low | 48.6 | Very low | 118 Ų | 118 | 118.2 Ų | 118.2 | 72% | 0.715 | 65% | 0.651 | S | S | * | * | trans | -52.2 | 122.6 | 163.6 | 178.6 | 0 | 0 | 0 | 0 | 107.8 | D212 G216 | D212-V214 VanDerWaalsContact C-N 3.28Å; D212-V214 PolarHBondContact O-N 3.19Å; V214-G216 PolarHBondContact O-N 2.97Å | ||
| 215 | P | 48.2 | Very low | 49.3 | Very low | 130 Ų | 130 | 116.8 Ų | 116.8 | 84% | 0.844 | 64% | 0.642 | S | S | * | * | trans | -76.4 | 70.7 | -174.6 | 31.1 | -35.9 | 0 | 0 | 0 | 111.2 | N213 | N213-P215 WeakPolarHBondContact O-CD 3.35Š| ||
| 216 | G | 41.3 | Very low | 50.1 | Low | 36 Ų | 36 | 116.7 Ų | 116.7 | 37% | 0.371 | 63% | 0.628 | S | S | . | * | trans | -86.7 | 146.7 | 170.6 | 0 | 0 | 0 | 0 | 0 | 111.4 | V214 K218 V219 | V214-G216 PolarHBondContact O-N 2.97Å; G216-K218 PolarHBondContact O-N 3.07Å; G216-V219 PolarHBondContact O-N 2.88Å | ||
| 217 | S | 51.2 | Low | 51 | Low | 103 Ų | 103 | 116.4 Ų | 116.4 | 72% | 0.72 | 62% | 0.622 | S | S | * | * | H | α-helix | trans | -51.6 | -21.3 | 176.8 | 54.8 | 0 | 0 | 0 | 0 | 114.4 | V219 E220 E221 | S217-V219 VanDerWaalsContact C-N 3.25Å; S217-V219 PolarHBondContact O-N 2.76Å; S217-E220 VanDerWaalsContact O-CB 3.31Å; S217-E220 WeakPolarHBondContact O-CB 3.23Å; S217-E220 PolarHBondContact O-N 2.97Å; S217-E220 VanDerWaalsContact O-N 3.16Å; S217-E221 PolarHBondContact O-N 3.44Å |
| 218 | K | 52.9 | Low | 52.1 | Low | 143 Ų | 143 | 114.6 Ų | 114.6 | 62% | 0.622 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -62.3 | -26.9 | 176.7 | -157.6 | 165.1 | -171 | 169.1 | 0 | 114 | G216 D222 | G216-K218 PolarHBondContact O-N 3.07Å; K218-D222 WeakPolarHBondContact O-CB 3.37Å; K218-D222 PolarHBondContact O-N 2.93Å |
| 219 | V | 53.9 | Low | 52.3 | Low | 79 Ų | 79 | 113.3 Ų | 113.3 | 48% | 0.479 | 61% | 0.609 | S | S | . | * | H | α-helix | trans | -76.7 | -33.1 | 175 | -177.5 | 0 | 0 | 0 | 0 | 111.2 | G216 S217 M223 | G216-V219 PolarHBondContact O-N 2.88Å; S217-V219 VanDerWaalsContact C-N 3.25Å; S217-V219 PolarHBondContact O-N 2.76Å; V219-M223 VanDerWaalsContact O-CB 3.23Å; V219-M223 WeakPolarHBondContact O-CB 3.32Å; V219-M223 PolarHBondContact O-N 3.23Å |
| 220 | E | 54.7 | Low | 52.9 | Low | 121 Ų | 121 | 109.4 Ų | 109.4 | 57% | 0.565 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -64 | -46.9 | 169.5 | -158 | 91.9 | -144.4 | 0 | 0 | 109.6 | S217 M223 E224 | S217-E220 VanDerWaalsContact O-CB 3.31Å; S217-E220 WeakPolarHBondContact O-CB 3.23Å; S217-E220 PolarHBondContact O-N 2.97Å; S217-E220 VanDerWaalsContact O-N 3.16Å; E220-M223 PolarHBondContact O-N 3.47Å; E220-E224 WeakPolarHBondContact O-CB 3.31Å; E220-E224 WeakPolarHBondContact O-CG 3.21Å; E220-E224 PolarHBondContact O-N 3.06Å |
| 221 | E | 58.3 | Low | 53.7 | Low | 115 Ų | 115 | 105.6 Ų | 105.6 | 54% | 0.537 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -63.9 | -44.4 | 178.9 | -169 | 174.1 | -160.7 | 0 | 0 | 113 | S217 M223 E224 T225 | S217-E221 PolarHBondContact O-N 3.44Å; E221-M223 VanDerWaalsContact C-N 3.32Å; E221-M223 PolarHBondContact O-N 3.01Å; E221-E224 PolarHBondContact O-N 3.02Å; E221-T225 WeakPolarHBondContact O-CB 3.31Å; E221-T225 VanDerWaalsContact O-CG2 3.31Å; E221-T225 WeakPolarHBondContact O-CG2 3.38Å; E221-T225 PolarHBondContact O-N 3.34Å; E221-T225 PolarHBondContact O-OG1 2.87Å |
| 222 | D | 54.3 | Low | 54.3 | Low | 97 Ų | 97 | 106.9 Ų | 106.9 | 52% | 0.519 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -64.5 | -35.3 | 173.4 | -79.8 | -15.9 | 0 | 0 | 0 | 111.6 | K218 T225 H226 | K218-D222 WeakPolarHBondContact O-CB 3.37Å; K218-D222 PolarHBondContact O-N 2.93Å; D222-T225 WeakPolarHBondContact CA-OG1 3.31Å; D222-T225 PolarHBondContact O-OG1 2.91Å; D222-T225 VanDerWaalsContact O-OG1 3.06Å; D222-H226 WeakPolarHBondContact O-CB 3.36Å; D222-H226 PolarHBondContact O-N 3.02Å |
| 223 | M | 62.8 | Low | 55.5 | Low | 116 Ų | 116 | 105.7 Ų | 105.7 | 57% | 0.571 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -72.9 | -41.9 | 175.8 | -176.9 | 169.7 | 61.6 | 0 | 0 | 112.5 | V219 E220 E221 H226 H227 | V219-M223 VanDerWaalsContact O-CB 3.23Å; V219-M223 WeakPolarHBondContact O-CB 3.32Å; V219-M223 PolarHBondContact O-N 3.23Å; E220-M223 PolarHBondContact O-N 3.47Å; E221-M223 VanDerWaalsContact C-N 3.32Å; E221-M223 PolarHBondContact O-N 3.01Å; M223-H226 PolarHBondContact O-N 3.19Å; M223-H227 WeakPolarHBondContact O-CB 3.42Å; M223-H227 PolarHBondContact O-N 3.01Å |
| 224 | E | 60.1 | Low | 55.9 | Low | 126 Ų | 126 | 109.4 Ų | 109.4 | 59% | 0.589 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -64.9 | -43.4 | 175.7 | -76.3 | -160.9 | 142.9 | 0 | 0 | 111.4 | E220 E221 H227 V228 | E220-E224 WeakPolarHBondContact O-CB 3.31Å; E220-E224 WeakPolarHBondContact O-CG 3.21Å; E220-E224 PolarHBondContact O-N 3.06Å; E221-E224 PolarHBondContact O-N 3.02Å; E224-H227 PolarHBondContact O-N 2.84Å; E224-V228 WeakPolarHBondContact O-CB 3.46Å; E224-V228 VanDerWaalsContact O-CG2 3.31Å; E224-V228 WeakPolarHBondContact O-CG2 3.36Å; E224-V228 PolarHBondContact O-N 2.66Å |
| 225 | T | 60.8 | Low | 56.3 | Low | 67 Ų | 67 | 110.8 Ų | 110.8 | 41% | 0.411 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -64.6 | -42.2 | 174.8 | 53 | 0 | 0 | 0 | 0 | 111.8 | E221 D222 H227 V228 L229 | E221-T225 WeakPolarHBondContact O-CB 3.31Å; E221-T225 VanDerWaalsContact O-CG2 3.31Å; E221-T225 WeakPolarHBondContact O-CG2 3.38Å; E221-T225 PolarHBondContact O-N 3.34Å; E221-T225 PolarHBondContact O-OG1 2.87Å; D222-T225 WeakPolarHBondContact CA-OG1 3.31Å; D222-T225 PolarHBondContact O-OG1 2.91Å; D222-T225 VanDerWaalsContact O-OG1 3.06Å; T225-H227 VanDerWaalsContact C-N 3.3Å; T225-H227 PolarHBondContact O-N 2.9Å; T225-V228 PolarHBondContact O-N 2.75Å; T225-L229 WeakPolarHBondContact O-CB 3.47Å; T225-L229 VanDerWaalsContact O-CG 3.28Å; T225-L229 WeakPolarHBondContact O-CG 3.24Å; T225-L229 PolarHBondContact O-N 2.73Å |
| 226 | H | 57.7 | Low | 55.9 | Low | 134 Ų | 134 | 110 Ų | 110 | 62% | 0.62 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -58 | -42.3 | 171.2 | -115.1 | -84.2 | 0 | 0 | 0 | 112.1 | D222 M223 T230 | D222-H226 WeakPolarHBondContact O-CB 3.36Å; D222-H226 PolarHBondContact O-N 3.02Å; M223-H226 PolarHBondContact O-N 3.19Å; H226-T230 WeakPolarHBondContact O-CB 3.4Å; H226-T230 PolarHBondContact O-N 2.91Å; H226-T230 PolarHBondContact O-OG1 2.9Å |
| 227 | H | 61.9 | Low | 56.1 | Low | 144 Ų | 144 | 117.5 Ų | 117.5 | 67% | 0.667 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -68.1 | -41.6 | 178.9 | -177.3 | -98 | 0 | 0 | 0 | 112.3 | M223 E224 T225 T230 G231 | M223-H227 WeakPolarHBondContact O-CB 3.42Å; M223-H227 PolarHBondContact O-N 3.01Å; E224-H227 PolarHBondContact O-N 2.84Å; T225-H227 VanDerWaalsContact C-N 3.3Å; T225-H227 PolarHBondContact O-N 2.9Å; H227-T230 PolarHBondContact O-N 3.44Å; H227-G231 PolarHBondContact O-N 3.34Å |
| 228 | V | 67.3 | Low | 55.8 | Low | 83 Ų | 83 | 124.2 Ų | 124.2 | 50% | 0.503 | 61% | 0.608 | S | S | . | * | H | α-helix | trans | -64.1 | -44.6 | 175.6 | 168.6 | 0 | 0 | 0 | 0 | 111.2 | E224 T225 G231 N232 | E224-V228 WeakPolarHBondContact O-CB 3.46Å; E224-V228 VanDerWaalsContact O-CG2 3.31Å; E224-V228 WeakPolarHBondContact O-CG2 3.36Å; E224-V228 PolarHBondContact O-N 2.66Å; T225-V228 PolarHBondContact O-N 2.75Å; V228-G231 PolarHBondContact O-N 2.82Å; V228-N232 PolarHBondContact O-N 3.46Å; V228-N232 VanDerWaalsContact O-N 3.11Å; V228-N232 PolarHBondContact O-ND2 2.91Å |
| 229 | L | 54.2 | Low | 55.2 | Low | 101 Ų | 101 | 126.5 Ų | 126.5 | 53% | 0.529 | 61% | 0.613 | S | S | . | * | H | α-helix | trans | -65.1 | -45.3 | 176.2 | -68.6 | 169.8 | 0 | 0 | 0 | 111.4 | T225 G231 N232 L233 | T225-L229 WeakPolarHBondContact O-CB 3.47Å; T225-L229 VanDerWaalsContact O-CG 3.28Å; T225-L229 WeakPolarHBondContact O-CG 3.24Å; T225-L229 PolarHBondContact O-N 2.73Å; L229-G231 PolarHBondContact O-N 2.79Å; L229-N232 PolarHBondContact O-N 3.39Å; L229-L233 HydrophobicContact CB-CD1 4.34Å; L229-L233 WeakPolarHBondContact O-CB 3.46Å; L229-L233 VanDerWaalsContact O-CG 3.3Å; L229-L233 WeakPolarHBondContact O-CG 3.43Å; L229-L233 PolarHBondContact O-N 3.21Å |
| 230 | T | 58.7 | Low | 54.6 | Low | 84 Ų | 84 | 131.7 Ų | 131.7 | 52% | 0.515 | 63% | 0.625 | S | S | . | * | H | α-helix | trans | -65 | -23.4 | 176 | -54.5 | 0 | 0 | 0 | 0 | 113 | H226 H227 K235 | H226-T230 WeakPolarHBondContact O-CB 3.4Å; H226-T230 PolarHBondContact O-N 2.91Å; H226-T230 PolarHBondContact O-OG1 2.9Å; H227-T230 PolarHBondContact O-N 3.44Å; T230-K235 WeakPolarHBondContact O-CE 3.45Å |
| 231 | G | 59 | Low | 53.9 | Low | 47 Ų | 47 | 133 Ų | 133 | 49% | 0.485 | 63% | 0.631 | S | S | . | * | H | α-helix | trans | -79.2 | -34.4 | 174.9 | 0 | 0 | 0 | 0 | 0 | 114.3 | H227 V228 L229 | H227-G231 PolarHBondContact O-N 3.34Å; V228-G231 PolarHBondContact O-N 2.82Å; L229-G231 PolarHBondContact O-N 2.79Å |
| 232 | N | 56.7 | Low | 52.9 | Low | 137 Ų | 137 | 131.6 Ų | 131.6 | 73% | 0.733 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -105.6 | -20.3 | -171.7 | -69.3 | -81.6 | 0 | 0 | 0 | 114.6 | V228 L229 | V228-N232 PolarHBondContact O-N 3.46Å; V228-N232 VanDerWaalsContact O-N 3.11Å; V228-N232 PolarHBondContact O-ND2 2.91Å; L229-N232 PolarHBondContact O-N 3.39Å |
| 233 | L | 64.4 | Low | 52.3 | Low | 118 Ų | 118 | 136 Ų | 136 | 62% | 0.618 | 65% | 0.651 | S | S | * | * | S | Bend | trans | -70.4 | 144.4 | 172.2 | -72.1 | 167.9 | 0 | 0 | 0 | 111.3 | L229 K235 | L229-L233 HydrophobicContact CB-CD1 4.34Å; L229-L233 WeakPolarHBondContact O-CB 3.46Å; L229-L233 VanDerWaalsContact O-CG 3.3Å; L229-L233 WeakPolarHBondContact O-CG 3.43Å; L229-L233 PolarHBondContact O-N 3.21Å; L233-K235 PolarHBondContact O-N 3.46Å |
| 234 | Y | 52.3 | Low | 51.5 | Low | 198 Ų | 198 | 137.4 Ų | 137.4 | 78% | 0.776 | 65% | 0.651 | S | S | * | * | trans | -62.1 | 112.5 | 175.6 | -175.2 | -88.8 | 0 | 0 | 0 | 109.9 | P236 | Y234-P236 VanDerWaalsContact O-CD 3.32Å; Y234-P236 WeakPolarHBondContact O-CD 3.49Å | ||
| 235 | K | 51.7 | Low | 50.8 | Low | 147 Ų | 147 | 135.1 Ų | 135.1 | 64% | 0.639 | 65% | 0.649 | S | S | * | * | trans | -65.8 | 120.2 | -176.7 | -66 | -178.4 | -179.3 | 179.3 | 0 | 109.4 | T230 L233 R237 | T230-K235 WeakPolarHBondContact O-CE 3.45Å; L233-K235 PolarHBondContact O-N 3.46Å; K235-R237 PolarHBondContact O-N 3.06Å | ||
| 236 | P | 40.6 | Very low | 50.5 | Low | 114 Ų | 114 | 141.5 Ų | 141.5 | 74% | 0.74 | 67% | 0.666 | S | S | * | * | trans | -51.5 | 127.1 | 175.7 | -27.8 | 35.7 | 0 | 0 | 0 | 109.9 | Y234 R238 | Y234-P236 VanDerWaalsContact O-CD 3.32Å; Y234-P236 WeakPolarHBondContact O-CD 3.49Å; P236-R238 VanDerWaalsContact C-N 3.32Å; P236-R238 PolarHBondContact O-N 2.88Å | ||
| 237 | R | 44.9 | Very low | 49.9 | Very low | 193 Ų | 193 | 143.3 Ų | 143.3 | 73% | 0.728 | 67% | 0.674 | S | S | * | * | trans | -69.2 | 87.7 | -167.7 | -174.1 | 176.3 | -179.6 | 145.4 | 0.4 | 110.4 | K235 R239 | K235-R237 PolarHBondContact O-N 3.06Å; R237-R239 HydrophobicContact CG-CG 4.35Å; R237-R239 PolarHBondContact O-N 3.25Å | ||
| 238 | R | 44 | Very low | 49.1 | Very low | 245 Ų | 245 | 144.4 Ų | 144.4 | 93% | 0.925 | 68% | 0.677 | S | S | * | * | trans | -59.6 | 82.8 | 169.3 | -72.1 | -170.5 | 177 | -165.4 | -0.1 | 109.6 | P236 Y240 | P236-R238 VanDerWaalsContact C-N 3.32Å; P236-R238 PolarHBondContact O-N 2.88Å; R238-Y240 PolarHBondContact O-N 2.92Å | ||
| 239 | R | 42.3 | Very low | 48.3 | Very low | 191 Ų | 191 | 143.5 Ų | 143.5 | 72% | 0.721 | 67% | 0.668 | S | S | * | * | trans | -65.2 | 105.1 | 164.4 | -65.5 | -165.7 | -168.5 | -149.3 | 8.7 | 106.4 | R237 Q241 | R237-R239 HydrophobicContact CG-CG 4.35Å; R237-R239 PolarHBondContact O-N 3.25Å; R239-Q241 VanDerWaalsContact C-N 3.34Å; R239-Q241 PolarHBondContact O-N 3.27Å | ||
| 240 | Y | 40.7 | Very low | 48.4 | Very low | 188 Ų | 188 | 142 Ų | 142 | 74% | 0.737 | 66% | 0.664 | S | S | * | * | trans | -66.1 | 98.9 | 168.9 | -154.3 | -86.4 | 0 | 0 | 0 | 106.5 | R238 S242 | R238-Y240 PolarHBondContact O-N 2.92Å; Y240-S242 PolarHBondContact O-N 2.81Å | ||
| 241 | Q | 38.6 | Very low | 48.3 | Very low | 149 Ų | 149 | 146.9 Ų | 146.9 | 70% | 0.696 | 69% | 0.686 | S | S | * | * | trans | -73.5 | 73 | 178.5 | -73.2 | -77.4 | 26 | 0 | 0 | 109.3 | R239 H243 | R239-Q241 VanDerWaalsContact C-N 3.34Å; R239-Q241 PolarHBondContact O-N 3.27Å; Q241-H243 PolarHBondContact O-N 3.23Å | ||
| 242 | S | 39 | Very low | 48.3 | Very low | 84 Ų | 84 | 146.8 Ų | 146.8 | 59% | 0.587 | 69% | 0.686 | S | S | * | * | trans | -63.8 | 119.3 | 156.7 | 50.1 | 0 | 0 | 0 | 0 | 107.4 | Y240 Y244 | Y240-S242 PolarHBondContact O-N 2.81Å; S242-Y244 PolarHBondContact O-N 3.11Å | ||
| 243 | H | 40.7 | Very low | 48.3 | Very low | 189 Ų | 189 | 145.2 Ų | 145.2 | 88% | 0.875 | 67% | 0.674 | S | S | * | * | trans | -70 | 72.8 | 178.8 | -75.9 | -97.7 | 0 | 0 | 0 | 111.1 | Q241 S245 | Q241-H243 PolarHBondContact O-N 3.23Å; H243-S245 PolarHBondContact O-N 3.13Å | ||
| 244 | Y | 45.4 | Very low | 48 | Very low | 146 Ų | 146 | 143.8 Ų | 143.8 | 57% | 0.573 | 66% | 0.664 | S | S | * | * | trans | -76.3 | 90.8 | 178.4 | -172.3 | -103.8 | 0 | 0 | 0 | 110 | S242 R246 M249 | S242-Y244 PolarHBondContact O-N 3.11Å; Y244-R246 HydrophobicContact CD1-CG 4.27Å; Y244-R246 HydrophobicContact CE1-CG 3.91Å; Y244-R246 PolarHBondContact O-N 3.42Å; Y244-M249 HydrophobicContact CE2-SD 4.39Å | ||
| 245 | S | 47.2 | Very low | 48.8 | Very low | 79 Ų | 79 | 141.3 Ų | 141.3 | 55% | 0.552 | 66% | 0.66 | S | S | * | * | trans | -66.8 | 111.4 | 170.5 | -174.4 | 0 | 0 | 0 | 0 | 109.2 | H243 H247 | H243-S245 PolarHBondContact O-N 3.13Å; S245-H247 PolarHBondContact O-N 2.91Å | ||
| 246 | R | 52.5 | Low | 49.4 | Very low | 201 Ų | 201 | 143.1 Ų | 143.1 | 76% | 0.758 | 66% | 0.662 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.6 | -0.9 | -164.2 | -142.8 | -173.3 | -172.4 | -175.6 | 0.6 | 115.5 | Y244 | Y244-R246 HydrophobicContact CD1-CG 4.27Å; Y244-R246 HydrophobicContact CE1-CG 3.91Å; Y244-R246 PolarHBondContact O-N 3.42Å |
| 247 | H | 46.2 | Very low | 50.6 | Low | 172 Ų | 172 | 141.2 Ų | 141.2 | 80% | 0.796 | 64% | 0.643 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -136 | -1.9 | -167 | -66.4 | -66.6 | 0 | 0 | 0 | 116.2 | S245 | S245-H247 PolarHBondContact O-N 2.91Š|
| 248 | F | 45.8 | Very low | 51.9 | Low | 167 Ų | 167 | 135.9 Ų | 135.9 | 73% | 0.732 | 63% | 0.63 | S | S | * | * | trans | -159.3 | 128.4 | 168.9 | -146.1 | -102.9 | 0 | 0 | 0 | 111.4 | ||||
| 249 | M | 50.3 | Low | 53.4 | Low | 63 Ų | 63 | 133.4 Ų | 133.4 | 31% | 0.31 | 62% | 0.62 | S | S | . | * | trans | -121.8 | 126.8 | 164.1 | -75.6 | -163.8 | 74.6 | 0 | 0 | 109.2 | Y244 E253 Q257 | Y244-M249 HydrophobicContact CE2-SD 4.39Å; M249-E253 HydrophobicContact CE-CB 3.85Å; M249-Q257 VanDerWaalsContact CE-OE1 3.3Å; M249-Q257 PolarHBondContact SD-OE1 3.2Å; M249-Q257 VanDerWaalsContact SD-OE1 3.33Å | ||
| 250 | P | 55.5 | Low | 54.9 | Low | 69 Ų | 69 | 129.5 Ų | 129.5 | 45% | 0.448 | 61% | 0.61 | S | S | . | * | trans | -64.2 | 144.9 | 173.5 | -21.3 | 33.8 | 0 | 0 | 0 | 112 | G252 E253 | P250-G252 PolarHBondContact O-N 3.02Å; P250-E253 PolarHBondContact O-N 3.5Å | ||
| 251 | L | 55.7 | Low | 56.6 | Low | 187 Ų | 187 | 124.1 Ų | 124.1 | 98% | 0.979 | 60% | 0.597 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.3 | 6.5 | -172.8 | -82.7 | 165 | 0 | 0 | 0 | 116.9 | ||
| 252 | G | 60.7 | Low | 58.6 | Low | 46 Ų | 46 | 123.9 Ų | 123.9 | 47% | 0.474 | 59% | 0.594 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -116.2 | -7.1 | 171.9 | 0 | 0 | 0 | 0 | 0 | 115 | P250 | P250-G252 PolarHBondContact O-N 3.02Š|
| 253 | E | 56.8 | Low | 60.3 | Low | 104 Ų | 104 | 126.6 Ų | 126.6 | 49% | 0.486 | 60% | 0.597 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -92.4 | -25.2 | 179.3 | -62.8 | -160.2 | 133.7 | 0 | 0 | 112.7 | M249 P250 R256 Q257 | M249-E253 HydrophobicContact CE-CB 3.85Å; P250-E253 PolarHBondContact O-N 3.5Å; E253-R256 PolarHBondContact O-N 2.96Å; E253-Q257 PolarHBondContact O-N 3.5Å |
| 254 | Q | 58.2 | Low | 61.7 | Low | 88 Ų | 88 | 123.5 Ų | 123.5 | 41% | 0.411 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -54.7 | -54.4 | 175.2 | -176.5 | 61.3 | 46.7 | 0 | 0 | 111.7 | R256 Q257 D258 | Q254-R256 PolarHBondContact O-N 3.34Å; Q254-Q257 PolarHBondContact O-N 3.45Å; Q254-D258 VanDerWaalsContact NE2-CG 3.26Å; Q254-D258 PolarHBondContact NE2-OD1 3.33Å; Q254-D258 VanDerWaalsContact NE2-OD1 3.14Å; Q254-D258 PolarHBondContact NE2-OD2 3.43Å; Q254-D258 PolarHBondContact O-N 3.49Å |
| 255 | E | 67.4 | Low | 63.3 | Low | 146 Ų | 146 | 120.8 Ų | 120.8 | 68% | 0.682 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -60 | -34.3 | -179.8 | -166.3 | -166.1 | 171 | 0 | 0 | 112.3 | R259 | E255-R259 VanDerWaalsContact O-CB 3.23Å; E255-R259 WeakPolarHBondContact O-CB 3.24Å; E255-R259 PolarHBondContact O-N 3.37Å |
| 256 | R | 64.3 | Low | 64.5 | Low | 184 Ų | 184 | 120.7 Ų | 120.7 | 69% | 0.694 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -69.2 | -44.1 | 174.8 | -68.3 | -176.8 | 171.6 | -166.2 | -2.2 | 111.6 | E253 Q254 R259 E260 | E253-R256 PolarHBondContact O-N 2.96Å; Q254-R256 PolarHBondContact O-N 3.34Å; R256-R259 PolarHBondContact O-N 3.35Å; R256-E260 PolarHBondContact O-N 2.78Å |
| 257 | Q | 67.5 | Low | 65.5 | Low | 74 Ų | 74 | 118.6 Ų | 118.6 | 35% | 0.346 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -64.1 | -44.4 | 176.8 | -171 | 176.3 | 10.3 | 0 | 0 | 111.1 | M249 E253 Q254 R259 E260 V261 | M249-Q257 VanDerWaalsContact CE-OE1 3.3Å; M249-Q257 PolarHBondContact SD-OE1 3.2Å; M249-Q257 VanDerWaalsContact SD-OE1 3.33Å; E253-Q257 PolarHBondContact O-N 3.5Å; Q254-Q257 PolarHBondContact O-N 3.45Å; Q257-R259 VanDerWaalsContact C-N 3.33Å; Q257-R259 PolarHBondContact O-N 3.48Å; Q257-E260 PolarHBondContact O-N 2.9Å; Q257-V261 HydrophobicContact CG-CG2 4.25Å; Q257-V261 WeakPolarHBondContact O-CB 3.39Å; Q257-V261 VanDerWaalsContact O-CG2 3.27Å; Q257-V261 WeakPolarHBondContact O-CG2 3.28Å; Q257-V261 PolarHBondContact O-N 3.34Å |
| 258 | D | 71.9 | Confident | 66.6 | Low | 82 Ų | 82 | 113.6 Ų | 113.6 | 44% | 0.439 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -63 | -39.5 | 177.5 | -69.5 | -34.4 | 0 | 0 | 0 | 111.7 | Q254 V261 F262 | Q254-D258 VanDerWaalsContact NE2-CG 3.26Å; Q254-D258 PolarHBondContact NE2-OD1 3.33Å; Q254-D258 VanDerWaalsContact NE2-OD1 3.14Å; Q254-D258 PolarHBondContact NE2-OD2 3.43Å; Q254-D258 PolarHBondContact O-N 3.49Å; D258-V261 PolarHBondContact O-N 2.8Å; D258-F262 WeakPolarHBondContact O-CB 3.48Å; D258-F262 PolarHBondContact O-N 2.82Å |
| 259 | R | 74 | Confident | 67.9 | Low | 193 Ų | 193 | 112.6 Ų | 112.6 | 73% | 0.728 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -64.6 | -40.3 | 173.4 | -170.1 | 171.8 | -178.2 | 167.4 | 0.2 | 112.5 | E255 R256 Q257 Q263 | E255-R259 VanDerWaalsContact O-CB 3.23Å; E255-R259 WeakPolarHBondContact O-CB 3.24Å; E255-R259 PolarHBondContact O-N 3.37Å; R256-R259 PolarHBondContact O-N 3.35Å; Q257-R259 VanDerWaalsContact C-N 3.33Å; Q257-R259 PolarHBondContact O-N 3.48Å; R259-Q263 VanDerWaalsContact O-CB 3.28Å; R259-Q263 WeakPolarHBondContact O-CB 3.33Å; R259-Q263 PolarHBondContact O-N 3.27Å |
| 260 | E | 73.9 | Confident | 68.6 | Low | 108 Ų | 108 | 114.6 Ų | 114.6 | 51% | 0.505 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -67.8 | -40.6 | 173.2 | -86.9 | -160.6 | -141.2 | 0 | 0 | 113.1 | R256 Q257 Q263 R264 | R256-E260 PolarHBondContact O-N 2.78Å; Q257-E260 PolarHBondContact O-N 2.9Å; E260-Q263 PolarHBondContact O-N 3.45Å; E260-R264 WeakPolarHBondContact O-CB 3.47Å; E260-R264 PolarHBondContact O-N 3.13Å; E260-R264 IonicContact OE2-NH1 3.3Å; E260-R264 PolarHBondContact OE2-NH1 3.08Å |
| 261 | V | 77.4 | Confident | 68.9 | Low | 76 Ų | 76 | 115.7 Ų | 115.7 | 46% | 0.461 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -67 | -45.7 | 178.2 | 167.4 | 0 | 0 | 0 | 0 | 110 | Q257 D258 Q263 R264 N265 | Q257-V261 HydrophobicContact CG-CG2 4.25Å; Q257-V261 WeakPolarHBondContact O-CB 3.39Å; Q257-V261 VanDerWaalsContact O-CG2 3.27Å; Q257-V261 WeakPolarHBondContact O-CG2 3.28Å; Q257-V261 PolarHBondContact O-N 3.34Å; D258-V261 PolarHBondContact O-N 2.8Å; V261-Q263 PolarHBondContact O-N 3.02Å; V261-R264 PolarHBondContact O-N 2.98Å; V261-N265 VanDerWaalsContact O-CB 3.3Å; V261-N265 WeakPolarHBondContact O-CB 3.31Å; V261-N265 PolarHBondContact O-N 2.84Å |
| 262 | F | 79.7 | Confident | 69.2 | Low | 144 Ų | 144 | 110.6 Ų | 110.6 | 63% | 0.632 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -58 | -47.5 | 172.6 | -179.8 | -98.2 | 0 | 0 | 0 | 111.1 | D258 R264 N265 M266 | D258-F262 WeakPolarHBondContact O-CB 3.48Å; D258-F262 PolarHBondContact O-N 2.82Å; F262-R264 PolarHBondContact O-N 3.3Å; F262-N265 PolarHBondContact O-N 3.35Å; F262-M266 HydrophobicContact CD1-CG 4.45Å; F262-M266 HydrophobicContact CE1-CG 3.94Å; F262-M266 HydrophobicContact CE2-CG 4.38Å; F262-M266 HydrophobicContact CZ-CG 3.9Å; F262-M266 WeakPolarHBondContact O-CB 3.44Å; F262-M266 PolarHBondContact O-N 3.03Å |
| 263 | Q | 75.9 | Confident | 69.2 | Low | 141 Ų | 141 | 114.8 Ų | 114.8 | 66% | 0.659 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -64.7 | -40.8 | 179.1 | -166.8 | 179.7 | 57.1 | 0 | 0 | 112.4 | R259 E260 V261 R267 | R259-Q263 VanDerWaalsContact O-CB 3.28Å; R259-Q263 WeakPolarHBondContact O-CB 3.33Å; R259-Q263 PolarHBondContact O-N 3.27Å; E260-Q263 PolarHBondContact O-N 3.45Å; V261-Q263 PolarHBondContact O-N 3.02Å; Q263-R267 VanDerWaalsContact O-CB 3.28Å; Q263-R267 WeakPolarHBondContact O-CB 3.44Å; Q263-R267 PolarHBondContact O-N 2.92Å |
| 264 | R | 69.1 | Low | 69.1 | Low | 123 Ų | 123 | 116.8 Ų | 116.8 | 46% | 0.464 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -61.5 | -45.4 | 172.5 | -87.4 | -174.3 | 170.5 | 87.5 | -4.3 | 112 | E260 V261 F262 R267 S268 | E260-R264 WeakPolarHBondContact O-CB 3.47Å; E260-R264 PolarHBondContact O-N 3.13Å; E260-R264 IonicContact OE2-NH1 3.3Å; E260-R264 PolarHBondContact OE2-NH1 3.08Å; V261-R264 PolarHBondContact O-N 2.98Å; F262-R264 PolarHBondContact O-N 3.3Å; R264-R267 PolarHBondContact O-N 3.16Å; R264-S268 WeakPolarHBondContact O-CB 3.28Å; R264-S268 PolarHBondContact O-N 2.86Å |
| 265 | N | 78.8 | Confident | 68.8 | Low | 90 Ų | 90 | 116 Ų | 116 | 48% | 0.481 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -65.9 | -46.8 | -179.3 | -163 | -35.6 | 0 | 0 | 0 | 110.7 | V261 F262 R267 S268 R269 | V261-N265 VanDerWaalsContact O-CB 3.3Å; V261-N265 WeakPolarHBondContact O-CB 3.31Å; V261-N265 PolarHBondContact O-N 2.84Å; F262-N265 PolarHBondContact O-N 3.35Å; N265-R267 PolarHBondContact O-N 2.91Å; N265-S268 PolarHBondContact O-N 3.41Å; N265-R269 WeakPolarHBondContact O-CG 3.33Å; N265-R269 PolarHBondContact O-N 2.77Å; N265-R269 WeakPolarHBondContact OD1-CD 3.43Å |
| 266 | M | 73.4 | Confident | 68.1 | Low | 77 Ų | 77 | 113 Ų | 113 | 38% | 0.379 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -55 | -46.7 | 171.2 | -94.7 | -61.8 | -61.8 | 0 | 0 | 112.7 | F262 S268 R269 M270 | F262-M266 HydrophobicContact CD1-CG 4.45Å; F262-M266 HydrophobicContact CE1-CG 3.94Å; F262-M266 HydrophobicContact CE2-CG 4.38Å; F262-M266 HydrophobicContact CZ-CG 3.9Å; F262-M266 WeakPolarHBondContact O-CB 3.44Å; F262-M266 PolarHBondContact O-N 3.03Å; M266-S268 PolarHBondContact O-N 2.9Å; M266-R269 PolarHBondContact O-N 3.21Å; M266-M270 HydrophobicContact CE-CG 4.01Å; M266-M270 HydrophobicContact CE-SD 3.87Å; M266-M270 WeakPolarHBondContact O-CG 3.11Å; M266-M270 PolarHBondContact O-N 3.06Å |
| 267 | R | 74.1 | Confident | 67.4 | Low | 156 Ų | 156 | 114 Ų | 114 | 59% | 0.589 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -60.5 | -46.2 | 178.2 | -167.3 | 178 | -173.2 | -67.8 | -7.8 | 111.5 | Q263 R264 N265 R269 M270 E271 | Q263-R267 VanDerWaalsContact O-CB 3.28Å; Q263-R267 WeakPolarHBondContact O-CB 3.44Å; Q263-R267 PolarHBondContact O-N 2.92Å; R264-R267 PolarHBondContact O-N 3.16Å; N265-R267 PolarHBondContact O-N 2.91Å; R267-R269 PolarHBondContact O-N 3.35Å; R267-M270 PolarHBondContact O-N 2.91Å; R267-E271 IonicContact CZ-OE1 3.18Å; R267-E271 VanDerWaalsContact NH1-CD 3.31Å; R267-E271 IonicContact NH1-OE1 3.59Å; R267-E271 PolarHBondContact NH1-OE1 3.27Å; R267-E271 IonicContact NH1-OE2 2.66Å; R267-E271 PolarHBondContact NH1-OE2 3.37Å; R267-E271 IonicContact NH2-OE1 2.73Å; R267-E271 PolarHBondContact NH2-OE1 3.4Å; R267-E271 WeakPolarHBondContact O-CG 3.23Å; R267-E271 PolarHBondContact O-N 3.1Å |
| 268 | S | 68 | Low | 66.5 | Low | 68 Ų | 68 | 118.1 Ų | 118.1 | 48% | 0.476 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -61.5 | -40.9 | 176.2 | -172.4 | 0 | 0 | 0 | 0 | 112.8 | R264 N265 M266 E271 T272 | R264-S268 WeakPolarHBondContact O-CB 3.28Å; R264-S268 PolarHBondContact O-N 2.86Å; N265-S268 PolarHBondContact O-N 3.41Å; M266-S268 PolarHBondContact O-N 2.9Å; S268-E271 PolarHBondContact O-N 3.03Å; S268-T272 PolarHBondContact O-N 3.34Å; S268-T272 PolarHBondContact O-OG1 2.8Å |
| 269 | R | 72.9 | Confident | 65.3 | Low | 145 Ų | 145 | 122.6 Ų | 122.6 | 55% | 0.547 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -66 | -43.6 | 174.2 | -68.4 | 178.5 | 78.1 | 177.5 | 4.2 | 111.7 | N265 M266 R267 E271 T272 F273 | N265-R269 WeakPolarHBondContact O-CG 3.33Å; N265-R269 PolarHBondContact O-N 2.77Å; N265-R269 WeakPolarHBondContact OD1-CD 3.43Å; M266-R269 PolarHBondContact O-N 3.21Å; R267-R269 PolarHBondContact O-N 3.35Å; R269-E271 PolarHBondContact O-N 3.08Å; R269-T272 WeakPolarHBondContact CA-OG1 3.28Å; R269-T272 PolarHBondContact O-N 2.98Å; R269-T272 PolarHBondContact O-OG1 2.86Å; R269-F273 HydrophobicContact CB-CE2 4.41Å; R269-F273 WeakPolarHBondContact O-CD2 3.27Å; R269-F273 WeakPolarHBondContact O-CG 3.41Å; R269-F273 PolarHBondContact O-N 2.91Å |
| 270 | M | 64.6 | Low | 64 | Low | 105 Ų | 105 | 122 Ų | 122 | 52% | 0.517 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -64.9 | -36.2 | 176.5 | -69.6 | -174.4 | 90 | 0 | 0 | 113 | M266 R267 K274 | M266-M270 HydrophobicContact CE-CG 4.01Å; M266-M270 HydrophobicContact CE-SD 3.87Å; M266-M270 WeakPolarHBondContact O-CG 3.11Å; M266-M270 PolarHBondContact O-N 3.06Å; R267-M270 PolarHBondContact O-N 2.91Å; M270-K274 VanDerWaalsContact O-CG 3.32Å; M270-K274 WeakPolarHBondContact O-CG 3.28Å; M270-K274 PolarHBondContact O-N 3.23Å; M270-K274 VanDerWaalsContact O-N 3.09Å |
| 271 | E | 61.8 | Low | 62.8 | Low | 93 Ų | 93 | 123.9 Ų | 123.9 | 44% | 0.435 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -69.8 | -43 | 177.2 | -74.8 | 175.7 | 163.7 | 0 | 0 | 112 | R267 S268 R269 K274 S275 | R267-E271 IonicContact CZ-OE1 3.18Å; R267-E271 VanDerWaalsContact NH1-CD 3.31Å; R267-E271 IonicContact NH1-OE1 3.59Å; R267-E271 PolarHBondContact NH1-OE1 3.27Å; R267-E271 IonicContact NH1-OE2 2.66Å; R267-E271 PolarHBondContact NH1-OE2 3.37Å; R267-E271 IonicContact NH2-OE1 2.73Å; R267-E271 PolarHBondContact NH2-OE1 3.4Å; R267-E271 WeakPolarHBondContact O-CG 3.23Å; R267-E271 PolarHBondContact O-N 3.1Å; S268-E271 PolarHBondContact O-N 3.03Å; R269-E271 PolarHBondContact O-N 3.08Å; E271-K274 PolarHBondContact O-N 3.33Å; E271-S275 PolarHBondContact O-N 3.24Å |
| 272 | T | 63.7 | Low | 61.2 | Low | 80 Ų | 80 | 128.6 Ų | 128.6 | 49% | 0.491 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -62.8 | -43.7 | 174 | 45 | 0 | 0 | 0 | 0 | 111.9 | S268 R269 K274 S275 T276 | S268-T272 PolarHBondContact O-N 3.34Å; S268-T272 PolarHBondContact O-OG1 2.8Å; R269-T272 WeakPolarHBondContact CA-OG1 3.28Å; R269-T272 PolarHBondContact O-N 2.98Å; R269-T272 PolarHBondContact O-OG1 2.86Å; T272-K274 VanDerWaalsContact C-N 3.33Å; T272-K274 PolarHBondContact O-N 3.43Å; T272-S275 PolarHBondContact O-N 3.3Å; T272-S275 PolarHBondContact O-OG 2.66Å; T272-T276 PolarHBondContact O-N 2.84Å |
| 273 | F | 59.4 | Low | 59.6 | Low | 134 Ų | 134 | 128.7 Ų | 128.7 | 59% | 0.588 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -63.3 | -30.6 | 174.6 | -75 | -55.2 | 0 | 0 | 0 | 114.4 | R269 T276 | R269-F273 HydrophobicContact CB-CE2 4.41Å; R269-F273 WeakPolarHBondContact O-CD2 3.27Å; R269-F273 WeakPolarHBondContact O-CG 3.41Å; R269-F273 PolarHBondContact O-N 2.91Å; F273-T276 VanDerWaalsContact O-CG2 3.25Å; F273-T276 WeakPolarHBondContact O-CG2 3.38Å |
| 274 | K | 55.6 | Low | 58.2 | Low | 145 Ų | 145 | 127.3 Ų | 127.3 | 63% | 0.63 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -67.4 | -40.5 | 173.7 | -77.6 | 172.8 | -178.8 | -178 | 0 | 112.2 | M270 E271 T272 T276 | M270-K274 VanDerWaalsContact O-CG 3.32Å; M270-K274 WeakPolarHBondContact O-CG 3.28Å; M270-K274 PolarHBondContact O-N 3.23Å; M270-K274 VanDerWaalsContact O-N 3.09Å; E271-K274 PolarHBondContact O-N 3.33Å; T272-K274 VanDerWaalsContact C-N 3.33Å; T272-K274 PolarHBondContact O-N 3.43Å; K274-T276 PolarHBondContact O-N 3.05Å |
| 275 | S | 51.2 | Low | 57 | Low | 72 Ų | 72 | 132 Ų | 132 | 50% | 0.503 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -66.3 | -36 | -176.8 | 74.6 | 0 | 0 | 0 | 0 | 114.2 | E271 T272 | E271-S275 PolarHBondContact O-N 3.24Å; T272-S275 PolarHBondContact O-N 3.3Å; T272-S275 PolarHBondContact O-OG 2.66Å |
| 276 | T | 53.4 | Low | 55.5 | Low | 84 Ų | 84 | 131.4 Ų | 131.4 | 52% | 0.515 | 60% | 0.6 | S | S | . | * | H | α-helix | trans | -69.7 | -42.3 | -178.3 | 176.9 | 0 | 0 | 0 | 0 | 112.7 | T272 F273 K274 H278 K279 R280 | T272-T276 PolarHBondContact O-N 2.84Å; F273-T276 VanDerWaalsContact O-CG2 3.25Å; F273-T276 WeakPolarHBondContact O-CG2 3.38Å; K274-T276 PolarHBondContact O-N 3.05Å; T276-H278 VanDerWaalsContact C-N 3.29Å; T276-H278 PolarHBondContact O-N 3.4Å; T276-K279 PolarHBondContact O-N 3Å; T276-R280 PolarHBondContact O-N 3.44Å |
| 277 | R | 50.1 | Low | 54.4 | Low | 204 Ų | 204 | 133.6 Ų | 133.6 | 77% | 0.77 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -59.2 | -38.3 | 176.9 | -80.2 | -169.7 | 172 | -166.1 | -1.4 | 112.4 | K279 R280 | R277-K279 PolarHBondContact O-N 2.95Å; R277-R280 PolarHBondContact O-N 3.2Å |
| 278 | H | 47.8 | Very low | 53 | Low | 161 Ų | 161 | 135.4 Ų | 135.4 | 75% | 0.745 | 63% | 0.625 | S | S | * | * | H | α-helix | trans | -66.8 | -34.3 | 179.5 | -113.3 | 70.9 | 0 | 0 | 0 | 113.6 | T276 | T276-H278 VanDerWaalsContact C-N 3.29Å; T276-H278 PolarHBondContact O-N 3.4Å |
| 279 | K | 46.5 | Very low | 51.9 | Low | 175 Ų | 175 | 141.4 Ų | 141.4 | 76% | 0.761 | 64% | 0.643 | S | S | * | * | H | α-helix | trans | -73.5 | -32.8 | 176.8 | -73.7 | -170.7 | 176.7 | -178.8 | 0 | 113.2 | T276 R277 | T276-K279 PolarHBondContact O-N 3Å; R277-K279 PolarHBondContact O-N 2.95Å |
| 280 | R | 47.8 | Very low | 50.6 | Low | 181 Ų | 181 | 145.4 Ų | 145.4 | 68% | 0.683 | 66% | 0.658 | S | S | * | * | H | α-helix | trans | -66.8 | -47.9 | -178.9 | -164.4 | 170.7 | -179.3 | 162.3 | 1.6 | 112.3 | T276 R277 K282 K283 E284 | T276-R280 PolarHBondContact O-N 3.44Å; R277-R280 PolarHBondContact O-N 3.2Å; R280-K282 VanDerWaalsContact C-N 3.29Å; R280-K282 PolarHBondContact O-N 2.84Å; R280-K283 PolarHBondContact O-N 3.06Å; R280-E284 IonicContact NE-OE1 2.9Å; R280-E284 PolarHBondContact O-N 3.5Å |
| 281 | H | 47.6 | Very low | 49.6 | Very low | 147 Ų | 147 | 152.1 Ų | 152.1 | 68% | 0.681 | 68% | 0.677 | S | S | * | * | H | α-helix | trans | -60.2 | -32.5 | -179.3 | -104.1 | -74.3 | 0 | 0 | 0 | 114.3 | ||
| 282 | K | 44.9 | Very low | 48.5 | Very low | 175 Ų | 175 | 151.6 Ų | 151.6 | 76% | 0.761 | 70% | 0.697 | S | S | * | * | H | α-helix | trans | -74 | -28.6 | 179.9 | -162.8 | 169 | -176.8 | 175.1 | 0 | 112.8 | R280 | R280-K282 VanDerWaalsContact C-N 3.29Å; R280-K282 PolarHBondContact O-N 2.84Å |
| 283 | K | 45.6 | Very low | 47.2 | Very low | 147 Ų | 147 | 152.8 Ų | 152.8 | 64% | 0.639 | 71% | 0.709 | S | S | * | * | H | α-helix | trans | -79.7 | -36 | -179 | -171.3 | 172.5 | 179.7 | 179.2 | 0 | 113.2 | R280 S286 L287 | R280-K283 PolarHBondContact O-N 3.06Å; K283-S286 PolarHBondContact O-OG 2.98Å; K283-L287 HydrophobicContact CG-CD1 4.41Å; K283-L287 PolarHBondContact O-N 3.22Å |
| 284 | E | 45.9 | Very low | 46.1 | Very low | 112 Ų | 112 | 153 Ų | 153 | 52% | 0.523 | 72% | 0.716 | S | S | . | * | H | α-helix | trans | -71 | -36.3 | 177.9 | -71.2 | 173.5 | -170.8 | 0 | 0 | 111.8 | R280 S286 L287 | R280-E284 IonicContact NE-OE1 2.9Å; R280-E284 PolarHBondContact O-N 3.5Å; E284-S286 VanDerWaalsContact C-N 3.32Å; E284-S286 PolarHBondContact O-N 2.86Å; E284-L287 PolarHBondContact O-N 3.36Å |
| 285 | R | 44.9 | Very low | 45.1 | Very low | 221 Ų | 221 | 152.4 Ų | 152.4 | 83% | 0.834 | 73% | 0.725 | S | S | * | * | H | α-helix | trans | -68.8 | -25.4 | 179.4 | -155.3 | 176.7 | -168.8 | -170.8 | 3.8 | 113.8 | ||
| 286 | S | 47 | Very low | 44.3 | Very low | 77 Ų | 77 | 157.4 Ų | 157.4 | 54% | 0.538 | 74% | 0.737 | S | S | . | * | H | α-helix | trans | -82.5 | -35 | 176.9 | 55.9 | 0 | 0 | 0 | 0 | 113.4 | K283 E284 K288 K289 | K283-S286 PolarHBondContact O-OG 2.98Å; E284-S286 VanDerWaalsContact C-N 3.32Å; E284-S286 PolarHBondContact O-N 2.86Å; S286-K288 VanDerWaalsContact C-N 3.35Å; S286-K288 PolarHBondContact O-N 2.92Å; S286-K289 PolarHBondContact O-N 3.42Å |
| 287 | L | 49.5 | Very low | 43.3 | Very low | 123 Ų | 123 | 158.8 Ų | 158.8 | 64% | 0.644 | 74% | 0.741 | S | S | * | * | H | α-helix | trans | -66.2 | -34.9 | 179.4 | -77.9 | 163 | 0 | 0 | 0 | 112.8 | K283 E284 K289 | K283-L287 HydrophobicContact CG-CD1 4.41Å; K283-L287 PolarHBondContact O-N 3.22Å; E284-L287 PolarHBondContact O-N 3.36Å; L287-K289 PolarHBondContact O-N 3.49Å |
| 288 | K | 45.1 | Very low | 42.6 | Very low | 194 Ų | 194 | 157.4 Ų | 157.4 | 84% | 0.843 | 74% | 0.744 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.3 | 3.1 | -178.2 | -151.4 | 162.8 | -174.5 | 173.1 | 0 | 114.8 | S286 | S286-K288 VanDerWaalsContact C-N 3.35Å; S286-K288 PolarHBondContact O-N 2.92Å |
| 289 | K | 45.6 | Very low | 41.8 | Very low | 194 Ų | 194 | 153 Ų | 153 | 84% | 0.843 | 74% | 0.743 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -110.6 | 11.3 | 176.9 | -150.6 | -177.7 | 177.1 | -176.7 | 0 | 114 | S286 L287 | S286-K289 PolarHBondContact O-N 3.42Å; L287-K289 PolarHBondContact O-N 3.49Å |
| 290 | R | 44.1 | Very low | 41 | Very low | 230 Ų | 230 | 148.4 Ų | 148.4 | 87% | 0.868 | 75% | 0.745 | S | S | * | * | S | Bend | trans | -122.1 | 20.4 | -178.6 | -144.4 | -179.3 | -169.6 | -100.3 | 3.1 | 115.5 | ||
| 291 | R | 43.7 | Very low | 40.3 | Very low | 245 Ų | 245 | 145.9 Ų | 145.9 | 93% | 0.925 | 75% | 0.745 | S | S | * | * | trans | -135.5 | 111 | 160.6 | -87.6 | -175.1 | 171 | -104.5 | 3.1 | 106.8 | ||||
| 292 | G | 38.6 | Very low | 40.2 | Very low | 83 Ų | 83 | 147.7 Ų | 147.7 | 86% | 0.856 | 75% | 0.751 | S | S | * | * | trans | 179.9 | 20.5 | -170.4 | 0 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 293 | S | 37.3 | Very low | 40.8 | Very low | 104 Ų | 104 | 144.4 Ų | 144.4 | 73% | 0.727 | 75% | 0.747 | S | S | * | * | trans | -167.7 | 124.3 | 167.2 | 55.3 | 0 | 0 | 0 | 0 | 105 | ||||
| 294 | D | 35.2 | Very low | 40.2 | Very low | 140 Ų | 140 | 148.6 Ų | 148.6 | 75% | 0.749 | 76% | 0.759 | S | S | * | * | -159.7 | 165.1 | 53.1 | -104.1 | -64.5 | 0 | 0 | 0 | 114 | |||||
| 295 | T | 34.3 | Very low | 39.5 | Very low | 132 Ų | 132 | 153.6 Ų | 153.6 | 81% | 0.81 | 77% | 0.773 | S | S | * | * | trans | 53.3 | 140 | 158.1 | 49.8 | 0 | 0 | 0 | 0 | 123.6 | ||||
| 296 | K | 35.9 | Very low | 38.8 | Very low | 177 Ų | 177 | 150 Ų | 150 | 77% | 0.77 | 77% | 0.77 | S | S | * | * | trans | -48.8 | 168 | 158.3 | -96.9 | 174.9 | 144.1 | -110.5 | 0 | 113.6 | ||||
| 297 | D | 32.8 | Very low | 38.1 | Very low | 112 Ų | 112 | 152.3 Ų | 152.3 | 60% | 0.599 | 78% | 0.781 | S | S | * | * | cis | -157.4 | 168.9 | 29.2 | -143.3 | 8.6 | 0 | 0 | 0 | 114.9 | ||||
| 298 | E | 33.8 | Very low | 37.1 | Very low | 175 Ų | 175 | 151.1 Ų | 151.1 | 82% | 0.818 | 78% | 0.783 | S | S | * | * | trans | 59.2 | 159 | 160.1 | -85.4 | -57.3 | 149.7 | 0 | 0 | 122.5 | ||||
| 299 | G | 31.3 | Very low | 36.2 | Very low | 70 Ų | 70 | 153.7 Ų | 153.7 | 72% | 0.722 | 79% | 0.787 | S | S | * | * | trans | 99 | 131.2 | 173.1 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 300 | G | 30.1 | Very low | 35.4 | Very low | 78 Ų | 78 | 153.4 Ų | 153.4 | 80% | 0.804 | 79% | 0.789 | S | S | * | * | trans | -114.5 | -173 | -168.3 | 0 | 0 | 0 | 0 | 0 | 118 | ||||
| 301 | D | 32.2 | Very low | 34.7 | Very low | 128 Ų | 128 | 148.6 Ų | 148.6 | 68% | 0.684 | 78% | 0.781 | S | S | * | * | trans | 76 | 84.7 | 166.1 | -84.3 | -47.5 | 0 | 0 | 0 | 122.8 | ||||
| 302 | K | 45.4 | Very low | 34.1 | Very low | 185 Ų | 185 | 143.5 Ų | 143.5 | 80% | 0.804 | 77% | 0.765 | S | S | * | * | 78.5 | 158.9 | 117.4 | -78.1 | -171.5 | -166.9 | 89.4 | 0 | 120.1 | |||||
| 303 | P | 57.5 | Low | 33.6 | Very low | 106 Ų | 106 | 145.3 Ų | 145.3 | 69% | 0.688 | 76% | 0.755 | S | S | * | * | trans | -131.4 | -179.6 | -139.8 | 45.3 | -32.1 | 0 | 0 | 0 | 115.3 | ||||
| 304 | R | 33.2 | Very low | 34.3 | Very low | 235 Ų | 235 | 146 Ų | 146 | 89% | 0.887 | 76% | 0.757 | S | S | * | * | trans | 171.8 | 157.4 | 143.9 | -93.2 | 148.8 | -169.3 | -141.3 | 1.6 | 108.9 | ||||
| 305 | R | 31.8 | Very low | 33.8 | Very low | 217 Ų | 217 | 145.5 Ų | 145.5 | 82% | 0.819 | 76% | 0.759 | S | S | * | * | cis | -162.4 | 151.5 | -6.8 | 152.4 | 168.6 | 172.7 | 137.7 | -6.4 | 109.3 | ||||
| 306 | N | 29.6 | Very low | 33.4 | Very low | 145 Ų | 145 | 143.8 Ų | 143.8 | 78% | 0.775 | 76% | 0.758 | S | S | * | * | trans | -72.5 | 170.7 | 175.9 | -53.8 | -21.3 | 0 | 0 | 0 | 111.2 | ||||
| 307 | V | 32.5 | Very low | 33.3 | Very low | 126 Ų | 126 | 141.3 Ų | 141.3 | 76% | 0.764 | 76% | 0.758 | S | S | * | * | -171.2 | 158.8 | 89.1 | 151.5 | 0 | 0 | 0 | 0 | 110.3 | |||||
| 308 | S | 28.5 | Very low | 33.3 | Very low | 98 Ų | 98 | 141.9 Ų | 141.9 | 69% | 0.685 | 77% | 0.767 | S | S | * | * | trans | -75.4 | 157.8 | 179.5 | 49.8 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 309 | W | 27.7 | Very low | 33.2 | Very low | 248 Ų | 248 | 139.6 Ų | 139.6 | 94% | 0.939 | 77% | 0.765 | S | S | * | * | trans | -83.6 | 148.6 | 162.2 | -65.6 | 92.3 | 0 | 0 | 0 | 111.6 | ||||
| 310 | Q | 28.6 | Very low | 33.1 | Very low | 188 Ų | 188 | 144.4 Ų | 144.4 | 88% | 0.879 | 77% | 0.769 | S | S | * | * | trans | -130 | 166.9 | 164.9 | -78.2 | -95.3 | 44.3 | 0 | 0 | 107.9 | ||||
| 311 | D | 28.3 | Very low | 33.7 | Very low | 129 Ų | 129 | 145.6 Ų | 145.6 | 69% | 0.69 | 76% | 0.762 | S | S | * | * | trans | -120.9 | 171.5 | -160.9 | -171.6 | 17.3 | 0 | 0 | 0 | 112.9 | ||||
| 312 | K | 31.2 | Very low | 33.5 | Very low | 138 Ų | 138 | 147.1 Ų | 147.1 | 60% | 0.6 | 77% | 0.765 | S | S | * | * | trans | 85.5 | 105.6 | 173.1 | -55.5 | -62.6 | 91.4 | -156 | 0 | 118.7 | ||||
| 313 | D | 27.5 | Very low | 32.7 | Very low | 120 Ų | 120 | 146.2 Ų | 146.2 | 64% | 0.642 | 76% | 0.764 | S | S | * | * | 36.8 | 156.7 | 105.9 | -45.5 | -25.4 | 0 | 0 | 0 | 120.8 | |||||
| 314 | P | 52.1 | Low | 31.3 | Very low | 118 Ų | 118 | 146.9 Ų | 146.9 | 77% | 0.766 | 76% | 0.761 | S | S | * | * | cis | -135.2 | -164 | -23.1 | 32.8 | -10.8 | 0 | 0 | 0 | 113.1 | ||||
| 315 | V | 26.4 | Very low | 31 | Very low | 131 Ų | 131 | 144 Ų | 144 | 79% | 0.794 | 76% | 0.755 | S | S | * | * | trans | 149.4 | 128.4 | 132.5 | 165 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 316 | A | 25.8 | Very low | 30.8 | Very low | 96 Ų | 96 | 137.7 Ų | 137.7 | 79% | 0.793 | 75% | 0.75 | S | S | * | * | trans | 63 | 162.6 | 150.8 | 0 | 0 | 0 | 0 | 0 | 124.5 | ||||
| 317 | V | 33 | Very low | 30.7 | Very low | 125 Ų | 125 | 138 Ų | 138 | 76% | 0.758 | 75% | 0.751 | S | S | * | * | trans | -129.1 | 149.2 | -172.3 | -177 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 318 | P | 32.7 | Very low | 30.3 | Very low | 123 Ų | 123 | 140.6 Ų | 140.6 | 80% | 0.799 | 76% | 0.755 | S | S | * | * | -130.5 | 132.6 | 123.2 | 7.4 | 14.5 | 0 | 0 | 0 | 111 | |||||
| 319 | V | 31.1 | Very low | 30.2 | Very low | 128 Ų | 128 | 141.3 Ų | 141.3 | 78% | 0.776 | 76% | 0.76 | S | S | * | * | 93 | 125 | 63.8 | 168.2 | 0 | 0 | 0 | 0 | 113.3 | |||||
| 320 | E | 29.2 | Very low | 30.4 | Very low | 171 Ų | 171 | 136.8 Ų | 136.8 | 80% | 0.799 | 75% | 0.754 | S | S | * | * | trans | -46.7 | 179.2 | 172.4 | -56.1 | -60.8 | 134.8 | 0 | 0 | 115.4 | ||||
| 321 | P | 42.4 | Very low | 30.9 | Very low | 102 Ų | 102 | 132.9 Ų | 132.9 | 66% | 0.662 | 75% | 0.746 | S | S | * | * | cis | -156.9 | -166.1 | 26.1 | 46.1 | -22.3 | 0 | 0 | 0 | 120.7 | ||||
| 322 | E | 28.1 | Very low | 31.3 | Very low | 160 Ų | 160 | 135.9 Ų | 135.9 | 75% | 0.748 | 76% | 0.756 | S | S | * | * | trans | 80.9 | 119.2 | 157.4 | -65.7 | -175.7 | 179.7 | 0 | 0 | 120.3 | ||||
| 323 | E | 29.1 | Very low | 31.7 | Very low | 167 Ų | 167 | 137.9 Ų | 137.9 | 78% | 0.78 | 76% | 0.764 | S | S | * | * | 82.4 | 145.6 | 97.5 | -66.5 | -161.2 | 163.9 | 0 | 0 | 114.3 | |||||
| 324 | D | 27.6 | Very low | 32.2 | Very low | 119 Ų | 119 | 141.8 Ų | 141.8 | 64% | 0.636 | 78% | 0.778 | S | S | * | * | cis | -154.4 | 165.9 | 7 | -156.6 | 0.6 | 0 | 0 | 0 | 113 | ||||
| 325 | K | 27.5 | Very low | 31.6 | Very low | 175 Ų | 175 | 144.9 Ų | 144.9 | 76% | 0.761 | 78% | 0.783 | S | S | * | * | trans | 54.6 | 136.2 | 158.6 | -46.5 | -144.3 | 179.6 | -165.3 | 0 | 127.1 | ||||
| 326 | A | 27.6 | Very low | 32.5 | Very low | 85 Ų | 85 | 146.7 Ų | 146.7 | 70% | 0.702 | 79% | 0.788 | S | S | * | * | trans | 90.1 | 117 | 130.7 | 0 | 0 | 0 | 0 | 0 | 123 | ||||
| 327 | D | 26.8 | Very low | 33.3 | Very low | 151 Ų | 151 | 149 Ų | 149 | 81% | 0.807 | 79% | 0.792 | S | S | * | * | trans | 51.2 | 113.4 | 138.5 | -56 | -12.2 | 0 | 0 | 0 | 122.4 | ||||
| 328 | Q | 25.5 | Very low | 33.7 | Very low | 180 Ų | 180 | 145.5 Ų | 145.5 | 84% | 0.841 | 78% | 0.781 | S | S | * | * | 148.9 | 151 | 100 | -165.6 | 158.7 | 89.1 | 0 | 0 | 114.6 | |||||
| 329 | S | 26.6 | Very low | 34.6 | Very low | 114 Ų | 114 | 146.5 Ų | 146.5 | 80% | 0.797 | 78% | 0.778 | S | S | * | * | trans | 78.3 | 155.1 | 168.5 | 72.7 | 0 | 0 | 0 | 0 | 120 | ||||
| 330 | D | 31.6 | Very low | 35.2 | Very low | 152 Ų | 152 | 147.5 Ų | 147.5 | 81% | 0.813 | 78% | 0.777 | S | S | * | * | trans | -80 | 151.4 | -163.2 | -61.4 | -91.4 | 0 | 0 | 0 | 116 | ||||
| 331 | P | 38.3 | Very low | 35.9 | Very low | 107 Ų | 107 | 148.3 Ų | 148.3 | 70% | 0.695 | 78% | 0.779 | S | S | * | * | trans | -92.1 | 97.9 | 164 | 34.8 | -29.4 | 0 | 0 | 0 | 111.7 | K333 | P331-K333 PolarHBondContact O-N 2.81Š| ||
| 332 | E | 37.8 | Very low | 36.1 | Very low | 192 Ų | 192 | 149.4 Ų | 149.4 | 90% | 0.897 | 78% | 0.783 | S | S | * | * | trans | -55.9 | 129.7 | 158.8 | -66.8 | -175 | 132.9 | 0 | 0 | 109.7 | ||||
| 333 | K | 37.9 | Very low | 37 | Very low | 179 Ų | 179 | 146.4 Ų | 146.4 | 78% | 0.778 | 79% | 0.786 | S | S | * | * | trans | -141.2 | 97.4 | 170.8 | -74.1 | -164.7 | 175.1 | 178.5 | 0 | 112.3 | P331 E335 | P331-K333 PolarHBondContact O-N 2.81Å; K333-E335 PolarHBondContact O-N 3.39Å | ||
| 334 | E | 39.9 | Very low | 37.5 | Very low | 202 Ų | 202 | 150.1 Ų | 150.1 | 94% | 0.944 | 79% | 0.793 | S | S | * | * | trans | 12.8 | 100.8 | 150.2 | -61 | 178.8 | 112.6 | 0 | 0 | 116.1 | ||||
| 335 | E | 38.8 | Very low | 37.9 | Very low | 184 Ų | 184 | 153.6 Ų | 153.6 | 86% | 0.86 | 80% | 0.802 | S | S | * | * | trans | -69.9 | 159 | 169.5 | -62.9 | -175.4 | 177.6 | 0 | 0 | 112.2 | K333 V337 | K333-E335 PolarHBondContact O-N 3.39Å; E335-V337 PolarHBondContact O-N 2.79Å; E335-V337 VanDerWaalsContact O-N 3.13Å | ||
| 336 | D | 44.4 | Very low | 38.2 | Very low | 168 Ų | 168 | 151.8 Ų | 151.8 | 90% | 0.898 | 81% | 0.805 | S | S | * | * | trans | -51.9 | 111.9 | -172.2 | -82.6 | -61.8 | 0 | 0 | 0 | 114.7 | G338 | D336-G338 PolarHBondContact O-N 3.14Š| ||
| 337 | V | 43 | Very low | 38.4 | Very low | 145 Ų | 145 | 156.1 Ų | 156.1 | 88% | 0.879 | 81% | 0.811 | S | S | * | * | trans | -74.1 | 76.6 | 165.4 | -174 | 0 | 0 | 0 | 0 | 109.9 | E335 | E335-V337 PolarHBondContact O-N 2.79Å; E335-V337 VanDerWaalsContact O-N 3.13Å | ||
| 338 | G | 42.3 | Very low | 38.9 | Very low | 51 Ų | 51 | 155.1 Ų | 155.1 | 53% | 0.526 | 81% | 0.811 | S | S | . | * | trans | -62.6 | 139.3 | 173.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | D336 I340 | D336-G338 PolarHBondContact O-N 3.14Å; G338-I340 PolarHBondContact O-N 2.79Å; G338-I340 VanDerWaalsContact O-N 3.08Å | ||
| 339 | I | 51.3 | Low | 39.3 | Very low | 145 Ų | 145 | 152.6 Ų | 152.6 | 74% | 0.744 | 81% | 0.81 | S | S | * | * | trans | -77 | 98.7 | -179.5 | -57.8 | 172.9 | 0 | 0 | 0 | 110 | F341 | I339-F341 HydrophobicContact CG2-CD2 4.16Å; I339-F341 HydrophobicContact CG2-CE2 3.59Å; I339-F341 HydrophobicContact CG2-CZ 3.96Å | ||
| 340 | I | 44.2 | Very low | 39.4 | Very low | 148 Ų | 148 | 156.5 Ų | 156.5 | 76% | 0.759 | 81% | 0.813 | S | S | * | * | trans | -82.7 | 123.8 | 176.2 | -54.2 | 176.8 | 0 | 0 | 0 | 110.4 | G338 V342 | G338-I340 PolarHBondContact O-N 2.79Å; G338-I340 VanDerWaalsContact O-N 3.08Å; I340-V342 HydrophobicContact CG2-CG2 4.06Å | ||
| 341 | F | 43.8 | Very low | 39.2 | Very low | 189 Ų | 189 | 158.4 Ų | 158.4 | 83% | 0.829 | 82% | 0.817 | S | S | * | * | trans | -98.9 | 107.8 | 170.3 | -74.1 | -86 | 0 | 0 | 0 | 111 | I339 | I339-F341 HydrophobicContact CG2-CD2 4.16Å; I339-F341 HydrophobicContact CG2-CE2 3.59Å; I339-F341 HydrophobicContact CG2-CZ 3.96Å | ||
| 342 | V | 45.6 | Very low | 38.6 | Very low | 125 Ų | 125 | 164.4 Ų | 164.4 | 76% | 0.758 | 83% | 0.825 | S | S | * | * | trans | -90.4 | 112.2 | 176.7 | -178.9 | 0 | 0 | 0 | 0 | 110.5 | I340 | I340-V342 HydrophobicContact CG2-CG2 4.06Š| ||
| 343 | A | 46.8 | Very low | 38.7 | Very low | 97 Ų | 97 | 159.9 Ų | 159.9 | 80% | 0.802 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -79.2 | 117.8 | 172.9 | 0 | 0 | 0 | 0 | 0 | 110.9 | K345 | A343-K345 PolarHBondContact O-N 2.95Š|
| 344 | R | 40 | Very low | 38.2 | Very low | 245 Ų | 245 | 161 Ų | 161 | 93% | 0.925 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -76.1 | 118 | 170.6 | -73.5 | -172.2 | 179.8 | -176.2 | 0.6 | 110.4 | ||
| 345 | K | 35.3 | Very low | 37.6 | Very low | 192 Ų | 192 | 157.1 Ų | 157.1 | 84% | 0.835 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -97.1 | 125.5 | 162.5 | -173.9 | 179.2 | -178.9 | -177.7 | 0 | 108.4 | A343 | A343-K345 PolarHBondContact O-N 2.95Š|
| 346 | V | 35.3 | Very low | 37.1 | Very low | 136 Ų | 136 | 155 Ų | 155 | 82% | 0.824 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -86.1 | 140.8 | 168.7 | 173.4 | 0 | 0 | 0 | 0 | 108.5 | ||
| 347 | E | 31.3 | Very low | 36.8 | Very low | 176 Ų | 176 | 152.6 Ų | 152.6 | 82% | 0.822 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -93.1 | 150.8 | -167.3 | -59.3 | -167.5 | 123.4 | 0 | 0 | 114.1 | ||
| 348 | T | 36.2 | Very low | 35.9 | Very low | 130 Ų | 130 | 150.1 Ų | 150.1 | 80% | 0.798 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -101.4 | 130.6 | 169.7 | 52 | 0 | 0 | 0 | 0 | 110.4 | ||
| 349 | P | 33.8 | Very low | 35.1 | Very low | 128 Ų | 128 | 151.9 Ų | 151.9 | 83% | 0.831 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -65 | 141.1 | 170.4 | -22.1 | 34.3 | 0 | 0 | 0 | 113.2 | ||
| 350 | K | 30.3 | Very low | 34 | Very low | 195 Ų | 195 | 152.6 Ų | 152.6 | 85% | 0.848 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -72 | 165.7 | 165.8 | -76.5 | 173.7 | 169.3 | 170.6 | 0 | 109.7 | ||
| 351 | Q | 27.3 | Very low | 33.2 | Very low | 192 Ų | 192 | 152.5 Ų | 152.5 | 90% | 0.897 | 82% | 0.816 | S | S | * | * | cis | -156.6 | -178.9 | 48.3 | -71.5 | -179.7 | -5.1 | 0 | 0 | 114.6 | ||||
| 352 | R | 24.8 | Very low | 32.3 | Very low | 233 Ų | 233 | 149.4 Ų | 149.4 | 88% | 0.879 | 81% | 0.812 | S | S | * | * | trans | -141.6 | 170.9 | 175.3 | -137.2 | -168.6 | 171.3 | -171.9 | -0.8 | 105.3 | ||||
| 353 | P | 40.3 | Very low | 31.3 | Very low | 97 Ų | 97 | 148.3 Ų | 148.3 | 63% | 0.63 | 81% | 0.809 | S | S | * | * | cis | -149.3 | -172.3 | 7.2 | 45.9 | -25.7 | 0 | 0 | 0 | 118.5 | ||||
| 354 | K | 27.3 | Very low | 30.3 | Very low | 202 Ų | 202 | 152.7 Ų | 152.7 | 88% | 0.878 | 81% | 0.812 | S | S | * | * | trans | 65.9 | 112.7 | 148.5 | -79.7 | 176.2 | 176 | -176.9 | 0 | 121.1 | ||||
| 355 | S | 26.9 | Very low | 29.8 | Very low | 121 Ų | 121 | 146.2 Ų | 146.2 | 85% | 0.846 | 81% | 0.805 | S | S | * | * | -167.8 | 164.5 | 121 | 56.9 | 0 | 0 | 0 | 0 | 111.8 | |||||
| 356 | V | 29 | Very low | 30.1 | Very low | 140 Ų | 140 | 143.1 Ų | 143.1 | 85% | 0.848 | 80% | 0.804 | S | S | * | * | trans | -152.8 | 129.4 | 178.2 | 169.5 | 0 | 0 | 0 | 0 | 104.4 | ||||
| 357 | P | 37.7 | Very low | 29.9 | Very low | 118 Ų | 118 | 141.8 Ų | 141.8 | 77% | 0.766 | 80% | 0.801 | S | S | * | * | -159.4 | 179.6 | 85.9 | 43.6 | -22.9 | 0 | 0 | 0 | 118.8 | |||||
| 358 | A | 25.4 | Very low | 30.2 | Very low | 93 Ų | 93 | 139.2 Ų | 139.2 | 77% | 0.769 | 80% | 0.8 | S | S | * | * | trans | 74.4 | 114.9 | 143.5 | 0 | 0 | 0 | 0 | 0 | 123.3 | ||||
| 359 | A | 24.8 | Very low | 29.8 | Very low | 88 Ų | 88 | 140.6 Ų | 140.6 | 73% | 0.727 | 80% | 0.801 | S | S | * | * | 74.3 | 128.6 | 121.7 | 0 | 0 | 0 | 0 | 0 | 124.4 | |||||
| 360 | L | 27.2 | Very low | 30.6 | Very low | 160 Ų | 160 | 139.9 Ų | 139.9 | 84% | 0.838 | 80% | 0.797 | S | S | * | * | trans | 76.9 | 154.5 | 144.5 | -73 | 167.1 | 0 | 0 | 0 | 122.1 | ||||
| 361 | D | 27.7 | Very low | 31.2 | Very low | 146 Ų | 146 | 136.2 Ų | 136.2 | 78% | 0.781 | 79% | 0.793 | S | S | * | * | trans | 62.3 | 150.7 | 168.8 | -68.4 | -28.1 | 0 | 0 | 0 | 120.3 | ||||
| 362 | V | 25.1 | Very low | 31.5 | Very low | 123 Ų | 123 | 132.7 Ų | 132.7 | 75% | 0.745 | 79% | 0.789 | S | S | * | * | cis | -156.6 | 166.2 | -37.5 | 105.2 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 363 | C | 24.1 | Very low | 32.7 | Very low | 103 Ų | 103 | 127.4 Ų | 127.4 | 70% | 0.696 | 79% | 0.785 | S | S | * | * | trans | -21 | 145.2 | 177.3 | -52.9 | 0 | 0 | 0 | 0 | 121.2 | ||||
| 364 | Q | 26.6 | Very low | 32.8 | Very low | 188 Ų | 188 | 128.7 Ų | 128.7 | 88% | 0.879 | 79% | 0.794 | S | S | * | * | -176.8 | 167.3 | 114 | -98.6 | 165.4 | 65.6 | 0 | 0 | 115.5 | |||||
| 365 | S | 28.5 | Very low | 33 | Very low | 110 Ų | 110 | 123.3 Ų | 123.3 | 77% | 0.769 | 78% | 0.781 | S | S | * | * | trans | -134.3 | -175.1 | 175.5 | -52.3 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 366 | P | 42.1 | Very low | 33.3 | Very low | 126 Ų | 126 | 126 Ų | 126 | 82% | 0.818 | 78% | 0.781 | S | S | * | * | cis | -142 | -153 | 9.8 | 43.5 | -20.7 | 0 | 0 | 0 | 115.2 | ||||
| 367 | S | 30.9 | Very low | 33.4 | Very low | 108 Ų | 108 | 125.9 Ų | 125.9 | 76% | 0.755 | 78% | 0.775 | S | S | * | * | trans | -86.6 | -175.4 | 174.9 | -29.6 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 368 | P | 38 | Very low | 33.1 | Very low | 122 Ų | 122 | 124 Ų | 124 | 79% | 0.792 | 77% | 0.765 | S | S | * | * | cis | -149 | -157.4 | 36.6 | 44.3 | -20.2 | 0 | 0 | 0 | 118.1 | ||||
| 369 | L | 27.5 | Very low | 33.3 | Very low | 160 Ų | 160 | 127.9 Ų | 127.9 | 84% | 0.838 | 77% | 0.767 | S | S | * | * | trans | -31.7 | 173.7 | 171.9 | -93.3 | 71.1 | 0 | 0 | 0 | 119.6 | ||||
| 370 | P | 51.2 | Low | 34 | Very low | 113 Ų | 113 | 131.3 Ų | 131.3 | 73% | 0.734 | 77% | 0.772 | S | S | * | * | cis | -127.8 | -136.7 | 8.3 | 40.7 | -19.9 | 0 | 0 | 0 | 111.1 | ||||
| 371 | P | 43.5 | Very low | 34.3 | Very low | 118 Ų | 118 | 127.5 Ų | 127.5 | 77% | 0.766 | 76% | 0.757 | S | S | * | * | cis | -128.4 | -174.7 | -28.1 | 40.5 | -23.5 | 0 | 0 | 0 | 114.6 | ||||
| 372 | S | 33.8 | Very low | 34.4 | Very low | 117 Ų | 117 | 131.8 Ų | 131.8 | 82% | 0.818 | 76% | 0.762 | S | S | * | * | trans | -163.8 | 120.9 | 172.5 | 59.2 | 0 | 0 | 0 | 0 | 118 | ||||
| 373 | P | 50.2 | Low | 34.8 | Very low | 123 Ų | 123 | 136 Ų | 136 | 80% | 0.799 | 77% | 0.771 | S | S | * | * | trans | -120 | -171.3 | 158.1 | 41.1 | -29.1 | 0 | 0 | 0 | 111.4 | ||||
| 374 | P | 42.1 | Very low | 35.1 | Very low | 124 Ų | 124 | 134.9 Ų | 134.9 | 81% | 0.805 | 78% | 0.776 | S | S | * | * | cis | -128.3 | -149.4 | -3 | 45 | -27.7 | 0 | 0 | 0 | 113.8 | ||||
| 375 | S | 30.8 | Very low | 35.2 | Very low | 88 Ų | 88 | 129.2 Ų | 129.2 | 62% | 0.615 | 77% | 0.768 | S | S | * | * | trans | -121 | -162.6 | -176.5 | -47 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 376 | E | 33.2 | Very low | 35.5 | Very low | 179 Ų | 179 | 131.4 Ų | 131.4 | 84% | 0.836 | 78% | 0.777 | S | S | * | * | cis | -161 | 173 | 10.1 | -127.1 | 110.8 | -124.2 | 0 | 0 | 105.5 | ||||
| 377 | D | 30.5 | Very low | 35.2 | Very low | 136 Ų | 136 | 129.2 Ų | 129.2 | 73% | 0.727 | 78% | 0.777 | S | S | * | * | cis | -166.6 | -179 | -4.6 | 175.2 | 47.8 | 0 | 0 | 0 | 109.3 | ||||
| 378 | S | 32.2 | Very low | 35.5 | Very low | 79 Ų | 79 | 129.4 Ų | 129.4 | 55% | 0.552 | 78% | 0.778 | S | S | * | * | trans | 75.1 | 133 | 156.3 | -81.2 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 379 | H | 28.6 | Very low | 35.6 | Very low | 175 Ų | 175 | 128.7 Ų | 128.7 | 81% | 0.81 | 77% | 0.774 | S | S | * | * | cis | -146.5 | 147.8 | 0.6 | -116.6 | -73.9 | 0 | 0 | 0 | 109.5 | ||||
| 380 | L | 40.7 | Very low | 36.2 | Very low | 159 Ų | 159 | 126.5 Ų | 126.5 | 83% | 0.832 | 77% | 0.769 | S | S | * | * | trans | -115.4 | 157 | 172.4 | -71 | 175.6 | 0 | 0 | 0 | 111.8 | ||||
| 381 | P | 34.2 | Very low | 35.5 | Very low | 81 Ų | 81 | 126.8 Ų | 126.8 | 53% | 0.526 | 77% | 0.771 | S | S | . | * | -143.6 | -179.1 | 124.4 | 22.1 | 1.2 | 0 | 0 | 0 | 115.4 | |||||
| 382 | W | 29.8 | Very low | 35 | Very low | 236 Ų | 236 | 127.2 Ų | 127.2 | 89% | 0.894 | 78% | 0.775 | S | S | * | * | trans | 50.1 | 61.3 | 170.1 | 43.2 | 71.9 | 0 | 0 | 0 | 118.8 | ||||
| 383 | K | 33.2 | Very low | 35.1 | Very low | 212 Ų | 212 | 127.8 Ų | 127.8 | 92% | 0.922 | 77% | 0.774 | S | S | * | * | trans | -46.7 | 129.1 | 144 | 166.9 | 178.3 | 177.8 | -77.5 | 0 | 113.4 | ||||
| 384 | G | 29.8 | Very low | 34.1 | Very low | 78 Ų | 78 | 127.5 Ų | 127.5 | 80% | 0.804 | 77% | 0.774 | S | S | * | * | trans | 166.4 | 121.9 | 161.7 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 385 | G | 28.2 | Very low | 34.5 | Very low | 70 Ų | 70 | 128 Ų | 128 | 72% | 0.722 | 78% | 0.775 | S | S | * | * | cis | -176.8 | 158.7 | -9.4 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 386 | V | 35.2 | Very low | 35 | Very low | 156 Ų | 156 | 132.6 Ų | 132.6 | 95% | 0.945 | 79% | 0.787 | S | S | * | * | trans | 56.3 | 109.7 | 163.8 | -171.4 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 387 | G | 35.4 | Very low | 35.1 | Very low | 79 Ų | 79 | 128.5 Ų | 128.5 | 81% | 0.814 | 78% | 0.783 | S | S | * | * | 101.7 | 86.1 | 126.5 | 0 | 0 | 0 | 0 | 0 | 119.7 | |||||
| 388 | S | 36.7 | Very low | 35.7 | Very low | 113 Ų | 113 | 129 Ų | 129 | 79% | 0.79 | 79% | 0.792 | S | S | * | * | trans | -156.7 | 142.1 | 150.6 | -171.9 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 389 | P | 41.4 | Very low | 36.1 | Very low | 107 Ų | 107 | 134.3 Ų | 134.3 | 70% | 0.695 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -69 | 161.5 | 171.5 | 29.9 | -35.5 | 0 | 0 | 0 | 112.5 | ||
| 390 | P | 40.7 | Very low | 37.1 | Very low | 113 Ų | 113 | 133.6 Ų | 133.6 | 73% | 0.734 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -73.8 | 144.8 | -175.2 | 30.1 | -35.8 | 0 | 0 | 0 | 112.9 | ||
| 391 | P | 36.5 | Very low | 37.2 | Very low | 119 Ų | 119 | 131 Ų | 131 | 77% | 0.773 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -73.7 | 130.7 | 171.4 | 30.5 | -33.3 | 0 | 0 | 0 | 111.1 | V393 | P391-V393 PolarHBondContact O-N 3.29Š|
| 392 | C | 31.2 | Very low | 38 | Very low | 128 Ų | 128 | 131 Ų | 131 | 87% | 0.865 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -68.2 | 128.2 | 172.1 | -59.1 | 0 | 0 | 0 | 0 | 110.4 | S394 | C392-S394 PolarHBondContact O-N 3.49Š|
| 393 | V | 36.3 | Very low | 39.4 | Very low | 129 Ų | 129 | 124.5 Ų | 124.5 | 78% | 0.782 | 78% | 0.777 | S | S | * | * | trans | -82.4 | 111 | 178.2 | 179.7 | 0 | 0 | 0 | 0 | 110.2 | P391 V395 | P391-V393 PolarHBondContact O-N 3.29Å; V393-V395 HydrophobicContact CG1-CG2 4.09Å | ||
| 394 | S | 29.9 | Very low | 40.7 | Very low | 117 Ų | 117 | 120.3 Ų | 120.3 | 82% | 0.818 | 77% | 0.765 | S | S | * | * | trans | -95.5 | 123.1 | 154.3 | -69.8 | 0 | 0 | 0 | 0 | 108.7 | C392 E396 | C392-S394 PolarHBondContact O-N 3.49Å; S394-E396 PolarHBondContact O-N 3.48Å | ||
| 395 | V | 50.1 | Low | 42 | Very low | 135 Ų | 135 | 121.9 Ų | 121.9 | 82% | 0.818 | 75% | 0.754 | S | S | * | * | trans | -82.9 | 110.3 | 172.7 | 177.3 | 0 | 0 | 0 | 0 | 108.4 | V393 | V393-V395 HydrophobicContact CG1-CG2 4.09Š| ||
| 396 | E | 40.5 | Very low | 43.5 | Very low | 184 Ų | 184 | 122.3 Ų | 122.3 | 86% | 0.86 | 74% | 0.737 | S | S | * | * | trans | 175.2 | 163.8 | 139.5 | -169.4 | 140.5 | -141 | 0 | 0 | 109.6 | S394 | S394-E396 PolarHBondContact O-N 3.48Š| ||
| 397 | A | 35.5 | Very low | 44.9 | Very low | 92 Ų | 92 | 119.8 Ų | 119.8 | 76% | 0.76 | 72% | 0.715 | S | S | * | * | trans | 62.8 | 80.7 | 176.4 | 0 | 0 | 0 | 0 | 0 | 117.4 | K399 | A397-K399 PolarHBondContact O-N 3.25Š| ||
| 398 | T | 43.3 | Very low | 46.4 | Very low | 148 Ų | 148 | 118.5 Ų | 118.5 | 91% | 0.908 | 70% | 0.697 | S | S | * | * | trans | -65.8 | 97 | 170.7 | -47.6 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 399 | K | 40.1 | Very low | 47.5 | Very low | 189 Ų | 189 | 120.8 Ų | 120.8 | 82% | 0.822 | 69% | 0.688 | S | S | * | * | trans | -148.7 | 108.8 | 159 | -150.4 | 170.3 | -171.7 | 177.3 | 0 | 112.1 | A397 I401 | A397-K399 PolarHBondContact O-N 3.25Å; K399-I401 PolarHBondContact O-N 2.96Å | ||
| 400 | I | 49.6 | Very low | 48.8 | Very low | 161 Ų | 161 | 120 Ų | 120 | 83% | 0.826 | 68% | 0.678 | S | S | * | * | trans | -68.2 | 115.3 | 175.8 | -60.1 | 167.4 | 0 | 0 | 0 | 108.2 | ||||
| 401 | I | 44.5 | Very low | 50.1 | Low | 105 Ų | 105 | 121.1 Ų | 121.1 | 54% | 0.538 | 67% | 0.674 | S | S | . | * | trans | -87.2 | 125.9 | 172.2 | -58 | 177.2 | 0 | 0 | 0 | 107.6 | K399 L405 | K399-I401 PolarHBondContact O-N 2.96Å; I401-L405 HydrophobicContact CG2-CB 3.78Å; I401-L405 HydrophobicContact CG2-CD1 4.37Å | ||
| 402 | P | 50.7 | Low | 51.5 | Low | 79 Ų | 79 | 118.5 Ų | 118.5 | 51% | 0.513 | 66% | 0.658 | S | S | . | * | trans | -57.8 | 138.5 | 172.5 | -25 | 34.6 | 0 | 0 | 0 | 111.7 | D404 L405 | P402-D404 PolarHBondContact O-N 3.4Å; P402-D404 VanDerWaalsContact O-N 3.12Å; P402-L405 PolarHBondContact O-N 3.34Å | ||
| 403 | V | 59.3 | Low | 52.6 | Low | 101 Ų | 101 | 116.1 Ų | 116.1 | 61% | 0.612 | 64% | 0.636 | S | S | * | * | H | α-helix | trans | -56.6 | -34 | -172.9 | 178.1 | 0 | 0 | 0 | 0 | 112.5 | L405 Q406 Q407 | V403-L405 VanDerWaalsContact C-N 3.26Å; V403-L405 PolarHBondContact O-N 3.29Å; V403-Q406 PolarHBondContact O-N 2.86Å; V403-Q406 VanDerWaalsContact O-N 3.1Å; V403-Q407 HydrophobicContact CG1-CG 4.3Å; V403-Q407 PolarHBondContact O-N 2.84Å |
| 404 | D | 60.8 | Low | 53.5 | Low | 124 Ų | 124 | 113 Ų | 113 | 66% | 0.663 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -55.2 | -37 | 175.5 | -63.6 | -37.4 | 0 | 0 | 0 | 113.3 | P402 Q407 A408 | P402-D404 PolarHBondContact O-N 3.4Å; P402-D404 VanDerWaalsContact O-N 3.12Å; D404-Q407 PolarHBondContact O-N 2.9Å; D404-A408 VanDerWaalsContact O-CB 3.26Å; D404-A408 WeakPolarHBondContact O-CB 3.21Å; D404-A408 PolarHBondContact O-N 2.88Å |
| 405 | L | 56.3 | Low | 54.6 | Low | 111 Ų | 111 | 110.7 Ų | 110.7 | 58% | 0.581 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -70.4 | -34.4 | 179.3 | -91.6 | 164.8 | 0 | 0 | 0 | 112 | I401 P402 V403 W409 | I401-L405 HydrophobicContact CG2-CB 3.78Å; I401-L405 HydrophobicContact CG2-CD1 4.37Å; P402-L405 PolarHBondContact O-N 3.34Å; V403-L405 VanDerWaalsContact C-N 3.26Å; V403-L405 PolarHBondContact O-N 3.29Å; L405-W409 WeakPolarHBondContact O-CB 3.38Å; L405-W409 PolarHBondContact O-N 3.26Å |
| 406 | Q | 60.4 | Low | 54.3 | Low | 78 Ų | 78 | 109.9 Ų | 109.9 | 36% | 0.364 | 59% | 0.594 | S | S | . | * | H | α-helix | trans | -72.5 | -37.4 | 174 | -168.5 | 61.9 | 59.7 | 0 | 0 | 111.3 | V403 W409 N410 | V403-Q406 PolarHBondContact O-N 2.86Å; V403-Q406 VanDerWaalsContact O-N 3.1Å; Q406-W409 PolarHBondContact O-N 3.36Å; Q406-N410 PolarHBondContact NE2-OD1 3.04Å; Q406-N410 WeakPolarHBondContact O-CB 3.34Å; Q406-N410 PolarHBondContact O-N 2.99Å; Q406-N410 PolarHBondContact O-OD1 3.46Å |
| 407 | Q | 64.6 | Low | 54.8 | Low | 104 Ų | 104 | 107.6 Ų | 107.6 | 49% | 0.486 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -67.2 | -42.9 | 174.7 | -70.4 | -172.1 | -7.6 | 0 | 0 | 112 | V403 D404 W409 N410 Q411 | V403-Q407 HydrophobicContact CG1-CG 4.3Å; V403-Q407 PolarHBondContact O-N 2.84Å; D404-Q407 PolarHBondContact O-N 2.9Å; Q407-W409 VanDerWaalsContact C-N 3.34Å; Q407-W409 PolarHBondContact O-N 3.09Å; Q407-N410 PolarHBondContact O-N 3.29Å; Q407-Q411 WeakPolarHBondContact O-CB 3.37Å; Q407-Q411 WeakPolarHBondContact O-CG 3.46Å; Q407-Q411 PolarHBondContact O-N 3.45Å |
| 408 | A | 65.4 | Low | 55.3 | Low | 52 Ų | 52 | 108 Ų | 108 | 43% | 0.43 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -62.5 | -39.1 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | D404 S412 | D404-A408 VanDerWaalsContact O-CB 3.26Å; D404-A408 WeakPolarHBondContact O-CB 3.21Å; D404-A408 PolarHBondContact O-N 2.88Å; A408-S412 WeakPolarHBondContact O-CB 3.3Å; A408-S412 PolarHBondContact O-N 3.29Å |
| 409 | W | 59.5 | Low | 55.3 | Low | 161 Ų | 161 | 106.6 Ų | 106.6 | 61% | 0.61 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -63.6 | -48.2 | 173.5 | -171.9 | 4.3 | 0 | 0 | 0 | 111.2 | L405 Q406 Q407 Q411 S412 I413 | L405-W409 WeakPolarHBondContact O-CB 3.38Å; L405-W409 PolarHBondContact O-N 3.26Å; Q406-W409 PolarHBondContact O-N 3.36Å; Q407-W409 VanDerWaalsContact C-N 3.34Å; Q407-W409 PolarHBondContact O-N 3.09Å; W409-Q411 PolarHBondContact O-N 3.23Å; W409-S412 WeakPolarHBondContact O-CB 3.36Å; W409-S412 PolarHBondContact O-N 3.47Å; W409-S412 VanDerWaalsContact O-N 3.15Å; W409-I413 PolarHBondContact O-N 2.78Å |
| 410 | N | 69.4 | Low | 55.4 | Low | 89 Ų | 89 | 102.2 Ų | 102.2 | 48% | 0.476 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -61.9 | -42.5 | 178.8 | -67 | -0.8 | 0 | 0 | 0 | 112 | Q406 Q407 S412 I413 S414 | Q406-N410 PolarHBondContact NE2-OD1 3.04Å; Q406-N410 WeakPolarHBondContact O-CB 3.34Å; Q406-N410 PolarHBondContact O-N 2.99Å; Q406-N410 PolarHBondContact O-OD1 3.46Å; Q407-N410 PolarHBondContact O-N 3.29Å; N410-S412 VanDerWaalsContact C-N 3.33Å; N410-S412 PolarHBondContact O-N 2.96Å; N410-I413 PolarHBondContact O-N 2.86Å; N410-S414 PolarHBondContact O-N 3.22Å; N410-S414 PolarHBondContact O-OG 3.33Å |
| 411 | Q | 67.4 | Low | 54.8 | Low | 138 Ų | 138 | 99.5 Ų | 99.5 | 65% | 0.645 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -60.6 | -41 | 173.7 | -73.1 | 176.1 | 16.7 | 0 | 0 | 112.1 | Q407 W409 I413 S414 S415 | Q407-Q411 WeakPolarHBondContact O-CB 3.37Å; Q407-Q411 WeakPolarHBondContact O-CG 3.46Å; Q407-Q411 PolarHBondContact O-N 3.45Å; W409-Q411 PolarHBondContact O-N 3.23Å; Q411-I413 PolarHBondContact O-N 3.47Å; Q411-S414 PolarHBondContact O-N 3.24Å; Q411-S415 WeakPolarHBondContact O-CB 3.32Å; Q411-S415 PolarHBondContact O-N 3.21Å |
| 412 | S | 67.1 | Low | 54.8 | Low | 63 Ų | 63 | 100.2 Ų | 100.2 | 44% | 0.441 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -61.5 | -41.6 | 175.6 | -169.2 | 0 | 0 | 0 | 0 | 112.2 | A408 W409 N410 S415 L416 | A408-S412 WeakPolarHBondContact O-CB 3.3Å; A408-S412 PolarHBondContact O-N 3.29Å; W409-S412 WeakPolarHBondContact O-CB 3.36Å; W409-S412 PolarHBondContact O-N 3.47Å; W409-S412 VanDerWaalsContact O-N 3.15Å; N410-S412 VanDerWaalsContact C-N 3.33Å; N410-S412 PolarHBondContact O-N 2.96Å; S412-S415 PolarHBondContact O-N 3.46Å; S412-S415 PolarHBondContact O-OG 3.45Å; S412-L416 PolarHBondContact O-N 3.38Å |
| 413 | I | 53 | Low | 54.4 | Low | 79 Ų | 79 | 102.2 Ų | 102.2 | 41% | 0.405 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -66.1 | -49.2 | 174.9 | -62.4 | -60.2 | 0 | 0 | 0 | 111.7 | W409 N410 Q411 S415 L416 E417 | W409-I413 PolarHBondContact O-N 2.78Å; N410-I413 PolarHBondContact O-N 2.86Å; Q411-I413 PolarHBondContact O-N 3.47Å; I413-S415 PolarHBondContact O-N 3.13Å; I413-L416 WeakPolarHBondContact O-CA 3.41Å; I413-L416 WeakPolarHBondContact O-CB 3.02Å; I413-L416 PolarHBondContact O-N 3.01Å; I413-E417 PolarHBondContact O-N 3.18Å; I413-E417 VanDerWaalsContact O-N 3.12Å |
| 414 | S | 56.6 | Low | 53.4 | Low | 63 Ų | 63 | 102.1 Ų | 102.1 | 44% | 0.441 | 59% | 0.594 | S | S | . | * | H | α-helix | trans | -63.6 | -26.4 | 178.8 | -60.6 | 0 | 0 | 0 | 0 | 113 | N410 Q411 L416 E417 S418 | N410-S414 PolarHBondContact O-N 3.22Å; N410-S414 PolarHBondContact O-OG 3.33Å; Q411-S414 PolarHBondContact O-N 3.24Å; S414-L416 VanDerWaalsContact C-N 3.28Å; S414-L416 PolarHBondContact O-N 3.49Å; S414-E417 PolarHBondContact O-N 3.42Å; S414-S418 WeakPolarHBondContact O-CB 3.5Å; S414-S418 PolarHBondContact O-N 3.45Å; S414-S418 PolarHBondContact O-OG 3.42Å |
| 415 | S | 52.9 | Low | 52.3 | Low | 69 Ų | 69 | 102.1 Ų | 102.1 | 48% | 0.483 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -66.3 | -28.1 | 171.1 | 81.8 | 0 | 0 | 0 | 0 | 113.4 | Q411 S412 I413 | Q411-S415 WeakPolarHBondContact O-CB 3.32Å; Q411-S415 PolarHBondContact O-N 3.21Å; S412-S415 PolarHBondContact O-N 3.46Å; S412-S415 PolarHBondContact O-OG 3.45Å; I413-S415 PolarHBondContact O-N 3.13Å |
| 416 | L | 42.9 | Very low | 51.5 | Low | 118 Ų | 118 | 101.7 Ų | 101.7 | 62% | 0.618 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -86.6 | -23.6 | 177.7 | -67.9 | 170.3 | 0 | 0 | 0 | 112.8 | S412 I413 S414 V419 | S412-L416 PolarHBondContact O-N 3.38Å; I413-L416 WeakPolarHBondContact O-CA 3.41Å; I413-L416 WeakPolarHBondContact O-CB 3.02Å; I413-L416 PolarHBondContact O-N 3.01Å; S414-L416 VanDerWaalsContact C-N 3.28Å; S414-L416 PolarHBondContact O-N 3.49Å; L416-V419 WeakPolarHBondContact O-CG2 3.41Å |
| 417 | E | 50.9 | Low | 50.2 | Low | 135 Ų | 135 | 106.6 Ų | 106.6 | 63% | 0.631 | 64% | 0.637 | S | S | * | * | H | α-helix | trans | -74.7 | -32.1 | 167.1 | -64.8 | 178.9 | 123.7 | 0 | 0 | 111.1 | I413 S414 V419 S420 | I413-E417 PolarHBondContact O-N 3.18Å; I413-E417 VanDerWaalsContact O-N 3.12Å; S414-E417 PolarHBondContact O-N 3.42Å; E417-V419 PolarHBondContact O-N 3.49Å; E417-V419 VanDerWaalsContact O-N 3.13Å; E417-S420 WeakPolarHBondContact O-CB 3.25Å; E417-S420 PolarHBondContact O-N 3.37Å; E417-S420 VanDerWaalsContact O-N 3.17Å |
| 418 | S | 46 | Very low | 48.8 | Very low | 102 Ų | 102 | 107.5 Ų | 107.5 | 71% | 0.713 | 65% | 0.652 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.6 | -5.1 | -178.7 | -59.6 | 0 | 0 | 0 | 0 | 115.7 | S414 | S414-S418 WeakPolarHBondContact O-CB 3.5Å; S414-S418 PolarHBondContact O-N 3.45Å; S414-S418 PolarHBondContact O-OG 3.42Å |
| 419 | V | 44 | Very low | 47.5 | Very low | 117 Ų | 117 | 111.6 Ų | 111.6 | 71% | 0.709 | 67% | 0.671 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90 | 1 | 172.3 | -106.9 | 0 | 0 | 0 | 0 | 113.5 | L416 E417 S421 | L416-V419 WeakPolarHBondContact O-CG2 3.41Å; E417-V419 PolarHBondContact O-N 3.49Å; E417-V419 VanDerWaalsContact O-N 3.13Å; V419-S421 PolarHBondContact O-N 3.48Å; V419-S421 VanDerWaalsContact O-N 3.1Å |
| 420 | S | 42.3 | Very low | 46.1 | Very low | 97 Ų | 97 | 112.5 Ų | 112.5 | 68% | 0.678 | 68% | 0.682 | S | S | * | * | S | Bend | trans | -84.1 | 74.4 | 177.7 | -177.8 | 0 | 0 | 0 | 0 | 113.8 | E417 | E417-S420 WeakPolarHBondContact O-CB 3.25Å; E417-S420 PolarHBondContact O-N 3.37Å; E417-S420 VanDerWaalsContact O-N 3.17Å |
| 421 | S | 37.3 | Very low | 44.8 | Very low | 104 Ų | 104 | 113 Ų | 113 | 73% | 0.727 | 69% | 0.69 | S | S | * | * | trans | 60.8 | 114.5 | 160.6 | -51.7 | 0 | 0 | 0 | 0 | 118.9 | V419 | V419-S421 PolarHBondContact O-N 3.48Å; V419-S421 VanDerWaalsContact O-N 3.1Å | ||
| 422 | P | 44.5 | Very low | 43.2 | Very low | 120 Ų | 120 | 118.2 Ų | 118.2 | 78% | 0.779 | 70% | 0.703 | S | S | * | * | P | Polyproline II helix | trans | -72.6 | 152.2 | 158.5 | 32.5 | -33.8 | 0 | 0 | 0 | 111.1 | ||
| 423 | P | 42.2 | Very low | 41.4 | Very low | 122 Ų | 122 | 121.3 Ų | 121.3 | 79% | 0.792 | 72% | 0.719 | S | S | * | * | P | Polyproline II helix | trans | -68.1 | 153.2 | 171.5 | 30 | -34.9 | 0 | 0 | 0 | 111.5 | ||
| 424 | A | 37 | Very low | 40.2 | Very low | 98 Ų | 98 | 123.7 Ų | 123.7 | 81% | 0.81 | 74% | 0.743 | S | S | * | * | P | Polyproline II helix | trans | -66 | 134.4 | -174.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||
| 425 | P | 38.8 | Very low | 39 | Very low | 125 Ų | 125 | 124.5 Ų | 124.5 | 81% | 0.812 | 75% | 0.753 | S | S | * | * | P | Polyproline II helix | trans | -71.6 | 148.7 | 168.2 | 31.5 | -34.1 | 0 | 0 | 0 | 110.6 | ||
| 426 | A | 39.8 | Very low | 37.9 | Very low | 102 Ų | 102 | 128.3 Ų | 128.3 | 84% | 0.843 | 77% | 0.768 | S | S | * | * | P | Polyproline II helix | trans | -70.2 | 138.6 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||
| 427 | E | 32.1 | Very low | 37.2 | Very low | 181 Ų | 181 | 131.9 Ų | 131.9 | 85% | 0.846 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -79.1 | 130.6 | -177.4 | -168.4 | 171.7 | -150.5 | 0 | 0 | 111.7 | V429 | E427-V429 PolarHBondContact O-N 3.43Š|
| 428 | P | 34.9 | Very low | 36.5 | Very low | 123 Ų | 123 | 136.8 Ų | 136.8 | 80% | 0.799 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -79.5 | 116.1 | -175.8 | 30.2 | -34 | 0 | 0 | 0 | 112.6 | H430 | P428-H430 PolarHBondContact O-N 3.18Š|
| 429 | V | 38 | Very low | 36.3 | Very low | 137 Ų | 137 | 137.4 Ų | 137.4 | 83% | 0.83 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -78.9 | 118.3 | 178 | 179.1 | 0 | 0 | 0 | 0 | 111.6 | E427 | E427-V429 PolarHBondContact O-N 3.43Š|
| 430 | H | 30.6 | Very low | 35.6 | Very low | 181 Ų | 181 | 136 Ų | 136 | 84% | 0.838 | 80% | 0.802 | S | S | * | * | trans | -152.6 | 162 | 162.9 | -107.4 | -38.6 | 0 | 0 | 0 | 111.4 | P428 | P428-H430 PolarHBondContact O-N 3.18Š| ||
| 431 | P | 42.8 | Very low | 34.8 | Very low | 99 Ų | 99 | 135.3 Ų | 135.3 | 64% | 0.643 | 81% | 0.811 | S | S | * | * | -129.3 | 126.4 | -119 | 36 | -18.4 | 0 | 0 | 0 | 116.1 | |||||
| 432 | R | 32.6 | Very low | 34.4 | Very low | 247 Ų | 247 | 136.2 Ų | 136.2 | 93% | 0.932 | 82% | 0.817 | S | S | * | * | trans | 178.4 | 133.5 | 154.7 | -97.4 | 143.7 | 179.3 | 166 | -0.7 | 106.2 | ||||
| 433 | V | 30.1 | Very low | 33.8 | Very low | 128 Ų | 128 | 141.6 Ų | 141.6 | 78% | 0.776 | 82% | 0.822 | S | S | * | * | cis | -134.7 | 146.1 | 12.7 | 176.3 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 434 | S | 28 | Very low | 33.8 | Very low | 129 Ų | 129 | 141.2 Ų | 141.2 | 90% | 0.902 | 82% | 0.819 | S | S | * | * | trans | -120.5 | 102.3 | 174 | -60.5 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 435 | A | 31 | Very low | 33.7 | Very low | 80 Ų | 80 | 140.9 Ų | 140.9 | 66% | 0.661 | 82% | 0.816 | S | S | * | * | trans | -168.1 | 132.2 | 170.3 | 0 | 0 | 0 | 0 | 0 | 107.2 | ||||
| 436 | L | 30.7 | Very low | 33.2 | Very low | 150 Ų | 150 | 139.9 Ų | 139.9 | 79% | 0.785 | 81% | 0.812 | S | S | * | * | cis | -151.2 | -176.5 | 4.3 | -99.8 | 158.3 | 0 | 0 | 0 | 109.5 | ||||
| 437 | F | 28.6 | Very low | 32.8 | Very low | 193 Ų | 193 | 145.7 Ų | 145.7 | 85% | 0.846 | 81% | 0.814 | S | S | * | * | trans | 83 | 99.1 | 165.7 | -63.1 | -74.9 | 0 | 0 | 0 | 120.9 | ||||
| 438 | R | 34.4 | Very low | 32.8 | Very low | 237 Ų | 237 | 142.9 Ų | 142.9 | 89% | 0.894 | 81% | 0.809 | S | S | * | * | trans | -105.7 | -179.8 | 135.8 | -120.1 | -172.9 | 177.4 | 176.1 | 0.4 | 106.7 | ||||
| 439 | P | 43.3 | Very low | 32.6 | Very low | 116 Ų | 116 | 140.1 Ų | 140.1 | 75% | 0.753 | 80% | 0.804 | S | S | * | * | cis | -138.5 | 170.1 | -1.1 | 40 | -22.1 | 0 | 0 | 0 | 117.4 | ||||
| 440 | G | 28 | Very low | 33 | Very low | 86 Ų | 86 | 139.1 Ų | 139.1 | 89% | 0.887 | 80% | 0.8 | S | S | * | * | trans | 88.2 | 148.3 | 134.1 | 0 | 0 | 0 | 0 | 0 | 120.2 | ||||
| 441 | G | 26.5 | Very low | 33.2 | Very low | 84 Ų | 84 | 138.9 Ų | 138.9 | 87% | 0.866 | 80% | 0.803 | S | S | * | * | trans | 163.1 | 129.4 | 172.4 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 442 | S | 29 | Very low | 32.5 | Very low | 123 Ų | 123 | 137.5 Ų | 137.5 | 86% | 0.86 | 81% | 0.807 | S | S | * | * | trans | -103.9 | 164 | -166.8 | 52 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 443 | R | 30.6 | Very low | 32.3 | Very low | 233 Ų | 233 | 130.7 Ų | 130.7 | 88% | 0.879 | 80% | 0.803 | S | S | * | * | trans | -59.5 | 168.8 | 161.4 | -112.3 | -176.9 | -177.7 | -177.4 | 1.6 | 111.7 | ||||
| 444 | P | 43.1 | Very low | 32.4 | Very low | 113 Ų | 113 | 129 Ų | 129 | 73% | 0.734 | 80% | 0.803 | S | S | * | * | cis | -152.2 | -179 | 48.9 | 43.3 | -22.6 | 0 | 0 | 0 | 119 | ||||
| 445 | A | 33.9 | Very low | 33 | Very low | 91 Ų | 91 | 128.6 Ų | 128.6 | 75% | 0.752 | 80% | 0.797 | S | S | * | * | trans | 59 | 155.3 | 147.4 | 0 | 0 | 0 | 0 | 0 | 121 | ||||
| 446 | S | 29.8 | Very low | 33 | Very low | 104 Ų | 104 | 129 Ų | 129 | 73% | 0.727 | 80% | 0.801 | S | S | * | * | cis | -175.5 | 142.7 | -21 | 51.3 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 447 | Y | 30 | Very low | 33 | Very low | 224 Ų | 224 | 131.5 Ų | 131.5 | 88% | 0.878 | 81% | 0.808 | S | S | * | * | trans | -164 | 171.1 | 139.9 | -133.4 | -101.2 | 0 | 0 | 0 | 112.6 | ||||
| 448 | T | 32.2 | Very low | 33.3 | Very low | 122 Ų | 122 | 126.6 Ų | 126.6 | 75% | 0.748 | 80% | 0.803 | S | S | * | * | trans | -109.2 | 162.1 | -162.9 | 51.8 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 449 | G | 30.7 | Very low | 33.5 | Very low | 66 Ų | 66 | 121.5 Ų | 121.5 | 68% | 0.68 | 80% | 0.801 | S | S | * | * | trans | -77.7 | -169.7 | 170.2 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 450 | P | 47.8 | Very low | 33 | Very low | 115 Ų | 115 | 120.1 Ų | 120.1 | 75% | 0.747 | 80% | 0.799 | S | S | * | * | -139.6 | 139.4 | 90.2 | 37.7 | -23.2 | 0 | 0 | 0 | 115.1 | |||||
| 451 | I | 33.4 | Very low | 34.1 | Very low | 176 Ų | 176 | 122 Ų | 122 | 90% | 0.903 | 80% | 0.796 | S | S | * | * | 71.7 | 124.8 | 102.7 | -56.8 | 169.1 | 0 | 0 | 0 | 115.4 | |||||
| 452 | G | 28.5 | Very low | 34.2 | Very low | 71 Ų | 71 | 123 Ų | 123 | 73% | 0.732 | 80% | 0.796 | S | S | * | * | trans | -169.7 | 28.1 | -178 | 0 | 0 | 0 | 0 | 0 | 119 | ||||
| 453 | A | 29.7 | Very low | 34.3 | Very low | 104 Ų | 104 | 121.6 Ų | 121.6 | 86% | 0.86 | 79% | 0.792 | S | S | * | * | trans | 62.6 | 145 | 168.6 | 0 | 0 | 0 | 0 | 0 | 121.1 | ||||
| 454 | A | 30.7 | Very low | 34.2 | Very low | 93 Ų | 93 | 120.4 Ų | 120.4 | 77% | 0.769 | 79% | 0.793 | S | S | * | * | trans | -115.4 | -168.4 | 164.4 | 0 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 455 | P | 42.3 | Very low | 33.4 | Very low | 120 Ų | 120 | 120.5 Ų | 120.5 | 78% | 0.779 | 80% | 0.796 | S | S | * | * | cis | -114.1 | 153.3 | 13.2 | 31.7 | -12.7 | 0 | 0 | 0 | 113.7 | ||||
| 456 | A | 30.5 | Very low | 33.3 | Very low | 89 Ų | 89 | 125.2 Ų | 125.2 | 74% | 0.736 | 80% | 0.8 | S | S | * | * | 70.8 | 103.7 | 59.2 | 0 | 0 | 0 | 0 | 0 | 115.9 | |||||
| 457 | Q | 30.1 | Very low | 33.5 | Very low | 202 Ų | 202 | 125.6 Ų | 125.6 | 94% | 0.944 | 80% | 0.799 | S | S | * | * | trans | -170.6 | 153.8 | 132.7 | -106.5 | 173.2 | 13.8 | 0 | 0 | 112 | ||||
| 458 | A | 34.2 | Very low | 33.5 | Very low | 90 Ų | 90 | 123.9 Ų | 123.9 | 74% | 0.744 | 80% | 0.799 | S | S | * | * | trans | -117.8 | 154.4 | 163.1 | 0 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 459 | P | 39.1 | Very low | 33.5 | Very low | 129 Ų | 129 | 129.8 Ų | 129.8 | 84% | 0.838 | 81% | 0.808 | S | S | * | * | -145.9 | -176.5 | 89.5 | 39.5 | -23 | 0 | 0 | 0 | 114.6 | |||||
| 460 | A | 33.3 | Very low | 33.4 | Very low | 87 Ų | 87 | 136.5 Ų | 136.5 | 72% | 0.719 | 82% | 0.818 | S | S | * | * | trans | -99 | -160.6 | 167.9 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 461 | P | 50.6 | Low | 32.5 | Very low | 126 Ų | 126 | 139.9 Ų | 139.9 | 82% | 0.818 | 82% | 0.821 | S | S | * | * | -118.3 | 159.7 | -57 | 33 | -20.7 | 0 | 0 | 0 | 111.9 | |||||
| 462 | A | 29.7 | Very low | 32.3 | Very low | 105 Ų | 105 | 141.4 Ų | 141.4 | 87% | 0.868 | 82% | 0.821 | S | S | * | * | trans | -148.5 | 137.7 | 171.9 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 463 | A | 31 | Very low | 32.3 | Very low | 94 Ų | 94 | 145.8 Ų | 145.8 | 78% | 0.777 | 82% | 0.823 | S | S | * | * | trans | -4.3 | 128.4 | 164.1 | 0 | 0 | 0 | 0 | 0 | 120.9 | ||||
| 464 | F | 27.8 | Very low | 32.3 | Very low | 207 Ų | 207 | 147.8 Ų | 147.8 | 91% | 0.908 | 82% | 0.818 | S | S | * | * | trans | -63.8 | 137.8 | 147.1 | -104.4 | -106 | 0 | 0 | 0 | 110 | ||||
| 465 | C | 26.9 | Very low | 32.2 | Very low | 116 Ų | 116 | 151 Ų | 151 | 78% | 0.784 | 82% | 0.82 | S | S | * | * | trans | -125.5 | 127.3 | 171.3 | -167.5 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 466 | F | 30.2 | Very low | 31.8 | Very low | 190 Ų | 190 | 154 Ų | 154 | 83% | 0.833 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -84.8 | 129.1 | 177.4 | -97.5 | -91.1 | 0 | 0 | 0 | 111.1 | ||
| 467 | P | 34.2 | Very low | 31.8 | Very low | 111 Ų | 111 | 159.2 Ų | 159.2 | 72% | 0.721 | 83% | 0.832 | S | S | * | * | P | Polyproline II helix | trans | -87.2 | 130.1 | 163.5 | 32.6 | -29.9 | 0 | 0 | 0 | 110.9 | ||
| 468 | E | 31.1 | Very low | 32 | Very low | 188 Ų | 188 | 158.8 Ų | 158.8 | 88% | 0.879 | 83% | 0.83 | S | S | * | * | P | Polyproline II helix | trans | -60.8 | 154.2 | 168.1 | -66.5 | -178.6 | 92.4 | 0 | 0 | 112 | ||
| 469 | R | 31.5 | Very low | 31.9 | Very low | 247 Ų | 247 | 164.1 Ų | 164.1 | 93% | 0.932 | 84% | 0.84 | S | S | * | * | trans | -128.3 | 133.9 | 158.5 | -80 | -169.4 | 168.7 | -173.5 | -2.4 | 111.5 | ||||
| 470 | K | 29.1 | Very low | 31.6 | Very low | 206 Ų | 206 | 166.7 Ų | 166.7 | 90% | 0.896 | 84% | 0.84 | S | S | * | * | trans | -77.1 | 156.3 | -172.8 | -66.4 | 175.3 | 177 | 176.4 | 0 | 112.3 | ||||
| 471 | K | 29.5 | Very low | 31.4 | Very low | 187 Ų | 187 | 171.7 Ų | 171.7 | 81% | 0.813 | 85% | 0.849 | S | S | * | * | trans | -56.5 | 146.8 | 167 | -66.6 | 179.7 | 175.7 | -178.7 | 0 | 112.3 | ||||
| 472 | K | 28.6 | Very low | 30.6 | Very low | 208 Ų | 208 | 173.7 Ų | 173.7 | 90% | 0.904 | 85% | 0.847 | S | S | * | * | trans | -136.8 | 157 | 139.8 | -94.1 | -167.4 | 170.7 | -170.5 | 0 | 108.8 | ||||
| 473 | Q | 27.7 | Very low | 31.2 | Very low | 162 Ų | 162 | 174.4 Ų | 174.4 | 76% | 0.757 | 84% | 0.843 | S | S | * | * | trans | -135.3 | 175.6 | 177.3 | -72.3 | 178.9 | -86.5 | 0 | 0 | 108.7 | ||||
| 474 | L | 30.2 | Very low | 31 | Very low | 147 Ų | 147 | 173 Ų | 173 | 77% | 0.77 | 84% | 0.838 | S | S | * | * | trans | 70.4 | 150.2 | -179.9 | -89.6 | 51.3 | 0 | 0 | 0 | 114.3 | ||||
| 475 | M | 28 | Very low | 31.2 | Very low | 161 Ų | 161 | 167.6 Ų | 167.6 | 79% | 0.793 | 83% | 0.832 | S | S | * | * | cis | -140.4 | 165.4 | 8.5 | -150.6 | 128.3 | -179 | 0 | 0 | 112.3 | ||||
| 476 | E | 34.1 | Very low | 31.4 | Very low | 183 Ų | 183 | 168 Ų | 168 | 86% | 0.855 | 84% | 0.835 | S | S | * | * | trans | -98.2 | 141.2 | 170.2 | -59.6 | 154.7 | 131.9 | 0 | 0 | 109.2 | ||||
| 477 | E | 31.1 | Very low | 31.5 | Very low | 198 Ų | 198 | 167.2 Ų | 167.2 | 93% | 0.925 | 83% | 0.834 | S | S | * | * | trans | -144.6 | 134.8 | 158.8 | -68.5 | -171 | 151.5 | 0 | 0 | 109.3 | ||||
| 478 | E | 34 | Very low | 31.5 | Very low | 192 Ų | 192 | 169.3 Ų | 169.3 | 90% | 0.897 | 83% | 0.834 | S | S | * | * | trans | -118.3 | 141.6 | 167.1 | -65 | -178.9 | 129.3 | 0 | 0 | 107.4 | ||||
| 479 | E | 31.3 | Very low | 31.7 | Very low | 202 Ų | 202 | 169.4 Ų | 169.4 | 94% | 0.944 | 84% | 0.837 | S | S | * | * | trans | -161.3 | 157.3 | 154.6 | -125 | 167.8 | -158.1 | 0 | 0 | 112.1 | ||||
| 480 | E | 33 | Very low | 32 | Very low | 183 Ų | 183 | 165.2 Ų | 165.2 | 86% | 0.855 | 83% | 0.828 | S | S | * | * | trans | -102.7 | 150.6 | 178 | -61 | -176.9 | 110.9 | 0 | 0 | 111.2 | ||||
| 481 | E | 29.8 | Very low | 33.1 | Very low | 193 Ų | 193 | 161.3 Ų | 161.3 | 90% | 0.902 | 82% | 0.824 | S | S | * | * | 168.4 | 148.2 | 120.4 | -90.1 | -160.1 | 135.7 | 0 | 0 | 113.6 | |||||
| 482 | E | 32.9 | Very low | 33.9 | Very low | 168 Ų | 168 | 158.5 Ų | 158.5 | 79% | 0.785 | 82% | 0.817 | S | S | * | * | trans | -102.1 | 177.7 | 163.6 | -100.1 | -95.5 | 146.9 | 0 | 0 | 107.8 | ||||
| 483 | P | 42.5 | Very low | 34.8 | Very low | 120 Ų | 120 | 161 Ų | 161 | 78% | 0.779 | 84% | 0.835 | S | S | * | * | cis | -136.9 | 176.5 | 13.6 | 37.3 | -16.7 | 0 | 0 | 0 | 117.3 | ||||
| 484 | G | 28.1 | Very low | 35.1 | Very low | 65 Ų | 65 | 160.9 Ų | 160.9 | 67% | 0.67 | 84% | 0.839 | S | S | * | * | trans | -147.7 | 43.8 | -172.3 | 0 | 0 | 0 | 0 | 0 | 120 | ||||
| 485 | A | 31.4 | Very low | 35.4 | Very low | 93 Ų | 93 | 161.6 Ų | 161.6 | 77% | 0.769 | 84% | 0.842 | S | S | * | * | trans | 34.1 | 122 | 155.7 | 0 | 0 | 0 | 0 | 0 | 123.5 | ||||
| 486 | S | 31.8 | Very low | 35.8 | Very low | 123 Ų | 123 | 161.7 Ų | 161.7 | 86% | 0.86 | 85% | 0.845 | S | S | * | * | trans | 65.7 | 125.3 | 134 | -57.4 | 0 | 0 | 0 | 0 | 123.4 | ||||
| 487 | Q | 31.8 | Very low | 35.9 | Very low | 175 Ų | 175 | 160.4 Ų | 160.4 | 82% | 0.818 | 85% | 0.845 | S | S | * | * | -152.7 | 164.2 | 113.1 | -163 | 153.4 | 12.3 | 0 | 0 | 112.6 | |||||
| 488 | E | 33.6 | Very low | 36.2 | Very low | 154 Ų | 154 | 158.1 Ų | 158.1 | 72% | 0.72 | 84% | 0.84 | S | S | * | * | trans | -66.7 | 155.5 | -167.8 | -51.1 | 144 | 86.1 | 0 | 0 | 116.7 | ||||
| 489 | M | 35 | Very low | 36.3 | Very low | 191 Ų | 191 | 155.8 Ų | 155.8 | 94% | 0.941 | 84% | 0.836 | S | S | * | * | -165.2 | 147.6 | 106.8 | -108.9 | -173 | 173.9 | 0 | 0 | 113.6 | |||||
| 490 | Q | 38 | Very low | 36.7 | Very low | 159 Ų | 159 | 152.5 Ų | 152.5 | 74% | 0.743 | 83% | 0.828 | S | S | * | * | trans | -140.6 | 156.5 | 169.4 | -142.4 | -173 | 65.4 | 0 | 0 | 107.1 | L492 | Q490-L492 HydrophobicContact CG-CD1 4.13Å; Q490-L492 VanDerWaalsContact OE1-CD1 3.3Å | ||
| 491 | P | 52.9 | Low | 37 | Very low | 123 Ų | 123 | 150.2 Ų | 150.2 | 80% | 0.799 | 83% | 0.826 | S | S | * | * | -145.9 | 169.4 | 88.8 | 37.7 | -21.1 | 0 | 0 | 0 | 114.9 | |||||
| 492 | L | 46.3 | Very low | 37.5 | Very low | 129 Ų | 129 | 146.6 Ų | 146.6 | 68% | 0.675 | 82% | 0.82 | S | S | * | * | trans | -85.8 | 154.7 | 168.7 | -83.7 | 72.7 | 0 | 0 | 0 | 112 | Q490 | Q490-L492 HydrophobicContact CG-CD1 4.13Å; Q490-L492 VanDerWaalsContact OE1-CD1 3.3Å | ||
| 493 | M | 46.2 | Very low | 38 | Very low | 259 Ų | 259 | 144.6 Ų | 144.6 | 100% | 1.276 | 82% | 0.823 | S | S | * | * | -132.9 | 0 | 109.8 | -85.3 | -160.2 | 163.8 | 0 | 0 | 109.5 |
Retrieved 493 of 493 residues in 196.9 ms
(Link to these results)