| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 48.2 | Very low | 71.7 | Confident | 242 Ų | 242 | 101.4 Ų | 101.4 | 100% | 1.192 | 50% | 0.499 | S | S | * | . | 0 | 112.6 | 0 | -73.8 | 175.5 | -164.2 | 0 | 0 | 106.7 | R3 | M1-R3 PolarHBondContact O-N 3.12Š| |||
| 2 | E | 55.6 | Low | 73.3 | Confident | 147 Ų | 147 | 93.1 Ų | 93.1 | 69% | 0.687 | 46% | 0.459 | S | S | * | . | trans | -58.5 | 131.6 | 173.5 | -73.6 | 166.2 | 151.8 | 0 | 0 | 109.1 | C4 R25 | E2-C4 PolarHBondContact O-N 3.09Å; E2-C4 VanDerWaalsContact O-N 3.14Å; E2-R25 IonicContact OE2-CZ 3.99Å; E2-R25 IonicContact OE2-NH2 3.89Å; E2-R25 PolarHBondContact OE2-NH2 3.27Å | ||
| 3 | R | 60.4 | Low | 74.5 | Confident | 235 Ų | 235 | 95.7 Ų | 95.7 | 89% | 0.887 | 47% | 0.466 | S | S | * | . | trans | -65.6 | 113.5 | 177.5 | -67.8 | -178.7 | -171 | 171.2 | 2.2 | 107.9 | M1 Q5 | M1-R3 PolarHBondContact O-N 3.12Å; R3-Q5 PolarHBondContact O-N 3.41Å | ||
| 4 | C | 65.7 | Low | 75.7 | Confident | 63 Ų | 63 | 91.8 Ų | 91.8 | 43% | 0.426 | 45% | 0.452 | S | S | . | . | trans | -70.6 | 122.1 | 172.5 | -61.2 | 0 | 0 | 0 | 0 | 108.3 | E2 H19 C22 | E2-C4 PolarHBondContact O-N 3.09Å; E2-C4 VanDerWaalsContact O-N 3.14Å; C4-H19 HydrophobicContact CB-CB 4.24Å; C4-H19 VanDerWaalsContact CB-CE1 3.43Å; C4-H19 WeakPolarHBondContact CB-CE1 3.3Å; C4-H19 WeakPolarHBondContact CB-ND1 3.24Å; C4-C22 PolarHBondContact SG-SG 3.48Å | ||
| 5 | Q | 68.4 | Low | 76.7 | Confident | 135 Ų | 135 | 89.5 Ų | 89.5 | 63% | 0.631 | 46% | 0.461 | S | S | * | . | trans | -89.3 | 142.2 | 178 | -62.4 | -177.7 | 8.4 | 0 | 0 | 109.5 | R3 N7 D8 | R3-Q5 PolarHBondContact O-N 3.41Å; Q5-N7 PolarHBondContact O-N 3.04Å; Q5-N7 VanDerWaalsContact O-N 3.09Å; Q5-D8 PolarHBondContact O-N 3.34Å | ||
| 6 | V | 70.7 | Confident | 77.7 | Confident | 86 Ų | 86 | 87.8 Ų | 87.8 | 52% | 0.521 | 45% | 0.45 | S | S | . | . | G | 310 helix | trans | -57.5 | -25 | 177 | -179.7 | 0 | 0 | 0 | 0 | 111.8 | D8 L9 | V6-D8 PolarHBondContact O-N 2.78Å; V6-L9 HydrophobicContact CG1-CD1 4.45Å; V6-L9 WeakPolarHBondContact O-CG 3.47Å |
| 7 | N | 70.2 | Confident | 78.5 | Confident | 100 Ų | 100 | 87.2 Ų | 87.2 | 54% | 0.535 | 45% | 0.452 | S | S | . | . | G | 310 helix | trans | -76.8 | -2.6 | -179.5 | -59.9 | -8.5 | 0 | 0 | 0 | 113.9 | Q5 | Q5-N7 PolarHBondContact O-N 3.04Å; Q5-N7 VanDerWaalsContact O-N 3.09Å |
| 8 | D | 83 | Confident | 79.2 | Confident | 55 Ų | 55 | 84.6 Ų | 84.6 | 29% | 0.294 | 44% | 0.437 | S | S | . | . | G | 310 helix | trans | -114.7 | 43.2 | 179.5 | -166 | 38.9 | 0 | 0 | 0 | 112.2 | Q5 V6 H19 A20 | Q5-D8 PolarHBondContact O-N 3.34Å; V6-D8 PolarHBondContact O-N 2.78Å; D8-H19 CarbonylContact O-C 3.49Å; D8-H19 VanDerWaalsContact O-CA 3.27Å; D8-H19 WeakPolarHBondContact O-CA 3.36Å; D8-A20 PolarHBondContact O-N 3.28Å; D8-A20 WeakPolarHBondContact OD1-CB 3.26Å |
| 9 | L | 87.7 | Confident | 79.7 | Confident | 34 Ų | 34 | 83.3 Ų | 83.3 | 18% | 0.178 | 43% | 0.428 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -83.9 | 141.6 | 175.1 | -69.9 | 173.5 | 0 | 0 | 0 | 111.7 | V6 F18 L49 L51 | V6-L9 HydrophobicContact CG1-CD1 4.45Å; V6-L9 WeakPolarHBondContact O-CG 3.47Å; L9-F18 CarbonylContact C-O 3.59Å; L9-F18 WeakPolarHBondContact CA-O 3.5Å; L9-L49 HydrophobicContact CB-CB 4.41Å; L9-L49 HydrophobicContact CB-CD1 4.28Å; L9-L49 PolarHBondContact O-N 2.92Å; L9-L51 HydrophobicContact CD1-CD1 3.74Å |
| 10 | S | 88.8 | Confident | 80.1 | Confident | 5 Ų | 5 | 79.9 Ų | 79.9 | 4% | 0.035 | 41% | 0.413 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -134 | 135.6 | 173.5 | -69.8 | 0 | 0 | 0 | 0 | 110.5 | T17 F18 A20 Y47 | S10-T17 WeakPolarHBondContact O-CA 3.44Å; S10-F18 PolarHBondContact N-O 3.29Å; S10-F18 PolarHBondContact O-N 2.89Å; S10-F18 VanDerWaalsContact O-O 3.11Å; S10-A20 VanDerWaalsContact OG-CB 3.25Å; S10-A20 WeakPolarHBondContact OG-CB 3.35Å; S10-Y47 CarbonylContact C-O 3.47Å; S10-Y47 WeakPolarHBondContact CA-O 3.33Å |
| 11 | A | 90.1 | Very high | 80.4 | Confident | 13 Ų | 13 | 78.8 Ų | 78.8 | 11% | 0.107 | 41% | 0.406 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -91.2 | 137.4 | 173.2 | 0 | 0 | 0 | 0 | 0 | 110.6 | T17 M46 Y47 L49 | A11-T17 HydrophobicContact CB-CG2 4Å; A11-M46 CarbonylContact O-C 3.6Å; A11-M46 WeakPolarHBondContact O-CA 3.47Å; A11-Y47 PolarHBondContact N-O 2.86Å; A11-Y47 PolarHBondContact O-N 3.17Å; A11-L49 HydrophobicContact CB-CD1 4.34Å; A11-L49 HydrophobicContact CB-CD2 4.3Å; A11-L49 HydrophobicContact CB-CG 4.44Å |
| 12 | L | 90.8 | Very high | 82.3 | Confident | 2 Ų | 2 | 69.6 Ų | 69.6 | 1% | 0.01 | 37% | 0.365 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -77.8 | 162.5 | 165.6 | -64.6 | -177.8 | 0 | 0 | 0 | 110.8 | C14 G15 H16 F18 V23 L27 C33 C40 C45 M46 | L12-C14 PolarHBondContact O-N 3.35Å; L12-G15 PolarHBondContact O-N 3.17Å; L12-H16 PolarHBondContact N-O 2.9Å; L12-F18 HydrophobicContact CD1-CD2 4Å; L12-F18 HydrophobicContact CD1-CE2 3.57Å; L12-F18 HydrophobicContact CG-CD2 4.02Å; L12-F18 HydrophobicContact CG-CE2 3.96Å; L12-V23 HydrophobicContact CD1-CG2 3.93Å; L12-V23 HydrophobicContact CD2-CG2 3.9Å; L12-V23 HydrophobicContact CG-CG2 4.15Å; L12-L27 HydrophobicContact CD2-CD1 3.9Å; L12-C33 HydrophobicContact CD1-CB 3.91Å; L12-C40 HydrophobicContact CD1-CB 4.3Å; L12-C40 HydrophobicContact CD2-CB 4.42Å; L12-C45 CarbonylContact C-O 3.59Å; L12-C45 WeakPolarHBondContact CA-O 3.4Å; L12-M46 HydrophobicContact CD2-CG 3.91Å |
| 13 | K | 88.6 | Confident | 84 | Confident | 127 Ų | 127 | 62.7 Ų | 62.7 | 55% | 0.552 | 33% | 0.333 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -54.9 | -24.1 | 173 | -73.3 | -169.3 | -177.7 | 179.1 | 0 | 114.5 | G15 S44 C45 Y47 | K13-G15 PolarHBondContact O-N 2.87Å; K13-S44 WeakPolarHBondContact CE-O 3.44Å; K13-S44 PolarHBondContact NZ-O 3.44Å; K13-C45 HydrophobicContact CB-CB 4.5Å; K13-C45 HydrophobicContact CD-CB 4.19Å; K13-C45 VanDerWaalsContact CD-SG 3.54Å; K13-C45 HydrophobicContact CG-CB 3.9Å; K13-C45 PolarHBondContact N-O 3.47Å; K13-C45 VanDerWaalsContact N-O 3.13Å; K13-Y47 HydrophobicContact CG-CE2 3.93Å |
| 14 | C | 91.5 | Very high | 85.3 | Confident | 41 Ų | 41 | 56 Ų | 56 | 28% | 0.277 | 31% | 0.308 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -80.4 | 1.6 | 174.7 | 60.2 | 0 | 0 | 0 | 0 | 113.9 | L12 H16 C36 C38 | L12-C14 PolarHBondContact O-N 3.35Å; C14-H16 VanDerWaalsContact C-N 3.33Å; C14-H16 PolarHBondContact O-N 3.15Å; C14-H16 PolarHBondContact SG-ND1 3.26Å; C14-C36 VanDerWaalsContact SG-SG 3.66Å; C14-C38 HydrophobicContact CB-CB 3.98Å |
| 15 | G | 90.1 | Very high | 86.4 | Confident | 57 Ų | 57 | 58.2 Ų | 58.2 | 59% | 0.588 | 31% | 0.307 | S | S | * | . | S | Bend | trans | 88.2 | -14.4 | 179 | 0 | 0 | 0 | 0 | 0 | 115.2 | L12 K13 | L12-G15 PolarHBondContact O-N 3.17Å; K13-G15 PolarHBondContact O-N 2.87Å |
| 16 | H | 92.9 | Very high | 87.5 | Confident | 62 Ų | 62 | 57 Ų | 57 | 29% | 0.287 | 30% | 0.297 | S | S | . | . | trans | -71.7 | 134.2 | 177.9 | -63 | 98.7 | 0 | 0 | 0 | 111.8 | L12 C14 F18 T35 C36 | L12-H16 PolarHBondContact N-O 2.9Å; C14-H16 VanDerWaalsContact C-N 3.33Å; C14-H16 PolarHBondContact O-N 3.15Å; C14-H16 PolarHBondContact SG-ND1 3.26Å; H16-F18 HydrophobicContact CB-CE2 3.51Å; H16-F18 HydrophobicContact CB-CZ 3.73Å; H16-T35 WeakPolarHBondContact NE2-CG2 3.49Å; H16-C36 VanDerWaalsContact CE1-CB 3.48Å; H16-C36 WeakPolarHBondContact CE1-CB 3.3Å; H16-C36 PolarHBondContact CE1-SG 3.29Å; H16-C36 PolarHBondContact ND1-SG 2.98Å; H16-C36 VanDerWaalsContact ND1-SG 3.41Å | ||
| 17 | T | 91.5 | Very high | 88.5 | Confident | 78 Ų | 78 | 53.5 Ų | 53.5 | 48% | 0.479 | 28% | 0.275 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.2 | 140.6 | -176.6 | 54.6 | 0 | 0 | 0 | 0 | 111.8 | S10 A11 L49 | S10-T17 WeakPolarHBondContact O-CA 3.44Å; A11-T17 HydrophobicContact CB-CG2 4Å; T17-L49 HydrophobicContact CG2-CD1 3.67Å |
| 18 | F | 90.6 | Very high | 89.4 | Confident | 40 Ų | 40 | 54.7 Ų | 54.7 | 18% | 0.175 | 28% | 0.281 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -147.4 | 161.6 | -179.1 | -55.6 | -83.8 | 0 | 0 | 0 | 109.4 | L9 S10 L12 H16 A20 V23 P34 T35 | L9-F18 CarbonylContact C-O 3.59Å; L9-F18 WeakPolarHBondContact CA-O 3.5Å; S10-F18 PolarHBondContact N-O 3.29Å; S10-F18 PolarHBondContact O-N 2.89Å; S10-F18 VanDerWaalsContact O-O 3.11Å; L12-F18 HydrophobicContact CD1-CD2 4Å; L12-F18 HydrophobicContact CD1-CE2 3.57Å; L12-F18 HydrophobicContact CG-CD2 4.02Å; L12-F18 HydrophobicContact CG-CE2 3.96Å; H16-F18 HydrophobicContact CB-CE2 3.51Å; H16-F18 HydrophobicContact CB-CZ 3.73Å; F18-A20 PolarHBondContact O-N 3.44Å; F18-V23 HydrophobicContact CB-CB 3.62Å; F18-V23 HydrophobicContact CB-CG1 4.02Å; F18-V23 HydrophobicContact CB-CG2 4.21Å; F18-V23 HydrophobicContact CD2-CB 4.17Å; F18-V23 HydrophobicContact CD2-CG2 3.8Å; F18-V23 HydrophobicContact CE2-CG2 4.44Å; F18-V23 HydrophobicContact CG-CB 4Å; F18-V23 HydrophobicContact CG-CG2 4.06Å; F18-P34 HydrophobicContact CD1-CG 4.46Å; F18-P34 HydrophobicContact CE1-CB 4Å; F18-P34 HydrophobicContact CE1-CG 3.82Å; F18-P34 HydrophobicContact CZ-CB 4.16Å; F18-P34 HydrophobicContact CZ-CG 3.9Å; F18-T35 WeakPolarHBondContact CZ-OG1 3.42Å |
| 19 | H | 89.4 | Confident | 89.7 | Confident | 60 Ų | 60 | 56 Ų | 56 | 28% | 0.278 | 30% | 0.295 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -61.2 | 133 | 165.4 | -55.1 | 114.7 | 0 | 0 | 0 | 109.5 | C4 D8 E21 C22 V23 | C4-H19 HydrophobicContact CB-CB 4.24Å; C4-H19 VanDerWaalsContact CB-CE1 3.43Å; C4-H19 WeakPolarHBondContact CB-CE1 3.3Å; C4-H19 WeakPolarHBondContact CB-ND1 3.24Å; D8-H19 CarbonylContact O-C 3.49Å; D8-H19 VanDerWaalsContact O-CA 3.27Å; D8-H19 WeakPolarHBondContact O-CA 3.36Å; H19-E21 VanDerWaalsContact C-N 3.26Å; H19-E21 PolarHBondContact O-N 2.97Å; H19-C22 HydrophobicContact CB-CB 3.99Å; H19-C22 WeakPolarHBondContact O-CB 3.46Å; H19-C22 PolarHBondContact O-N 2.89Å; H19-V23 PolarHBondContact O-N 3.27Å |
| 20 | A | 87.1 | Confident | 89.9 | Confident | 15 Ų | 15 | 57.7 Ų | 57.7 | 12% | 0.124 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -52.9 | -48.7 | -173.3 | 0 | 0 | 0 | 0 | 0 | 110.8 | D8 S10 F18 C22 V23 R24 M46 | D8-A20 PolarHBondContact O-N 3.28Å; D8-A20 WeakPolarHBondContact OD1-CB 3.26Å; S10-A20 VanDerWaalsContact OG-CB 3.25Å; S10-A20 WeakPolarHBondContact OG-CB 3.35Å; F18-A20 PolarHBondContact O-N 3.44Å; A20-C22 PolarHBondContact O-N 3.38Å; A20-V23 WeakPolarHBondContact O-CG1 3.38Å; A20-R24 WeakPolarHBondContact O-CB 3.36Å; A20-R24 PolarHBondContact O-N 2.89Å; A20-M46 HydrophobicContact CB-CE 3.96Å; A20-M46 WeakPolarHBondContact O-CE 3.17Å |
| 21 | E | 86.7 | Confident | 89.9 | Confident | 58 Ų | 58 | 60.7 Ų | 60.7 | 27% | 0.271 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -67.6 | -36.8 | -179.9 | -178.5 | 55.7 | -157.1 | 0 | 0 | 113.3 | H19 R24 R25 | H19-E21 VanDerWaalsContact C-N 3.26Å; H19-E21 PolarHBondContact O-N 2.97Å; E21-R24 IonicContact OE1-CZ 2.79Å; E21-R24 IonicContact OE1-NE 2.7Å; E21-R24 IonicContact OE1-NH2 3.65Å; E21-R24 PolarHBondContact OE1-NH2 2.85Å; E21-R24 IonicContact OE2-CZ 3.11Å; E21-R24 VanDerWaalsContact OE2-CZ 3.26Å; E21-R24 IonicContact OE2-NE 2.93Å; E21-R24 PolarHBondContact OE2-NE 3.37Å; E21-R24 IonicContact OE2-NH2 3.26Å; E21-R24 PolarHBondContact OE2-NH2 3.48Å; E21-R25 WeakPolarHBondContact O-CG 3.35Å; E21-R25 PolarHBondContact O-N 3.34Å; E21-R25 IonicContact OE1-CZ 2.7Å; E21-R25 IonicContact OE1-NE 2.75Å; E21-R25 PolarHBondContact OE1-NE 3.43Å; E21-R25 IonicContact OE1-NH2 3.35Å; E21-R25 PolarHBondContact OE1-NH2 3.49Å; E21-R25 VanDerWaalsContact OE1-NH2 3.11Å |
| 22 | C | 88.8 | Confident | 90 | Very high | 49 Ų | 49 | 65.8 Ų | 65.8 | 33% | 0.331 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -65.1 | -48.2 | 177.7 | -71.6 | 0 | 0 | 0 | 0 | 111.7 | C4 H19 A20 R25 W26 | C4-C22 PolarHBondContact SG-SG 3.48Å; H19-C22 HydrophobicContact CB-CB 3.99Å; H19-C22 WeakPolarHBondContact O-CB 3.46Å; H19-C22 PolarHBondContact O-N 2.89Å; A20-C22 PolarHBondContact O-N 3.38Å; C22-R25 PolarHBondContact O-N 2.93Å; C22-W26 PolarHBondContact O-N 3.35Å |
| 23 | V | 90 | Very high | 90.1 | Very high | 2 Ų | 2 | 65.8 Ų | 65.8 | 1% | 0.012 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -72.9 | -32.5 | -179.2 | 71.5 | 0 | 0 | 0 | 0 | 111.5 | L12 F18 H19 A20 R25 W26 L27 M46 | L12-V23 HydrophobicContact CD1-CG2 3.93Å; L12-V23 HydrophobicContact CD2-CG2 3.9Å; L12-V23 HydrophobicContact CG-CG2 4.15Å; F18-V23 HydrophobicContact CB-CB 3.62Å; F18-V23 HydrophobicContact CB-CG1 4.02Å; F18-V23 HydrophobicContact CB-CG2 4.21Å; F18-V23 HydrophobicContact CD2-CB 4.17Å; F18-V23 HydrophobicContact CD2-CG2 3.8Å; F18-V23 HydrophobicContact CE2-CG2 4.44Å; F18-V23 HydrophobicContact CG-CB 4Å; F18-V23 HydrophobicContact CG-CG2 4.06Å; H19-V23 PolarHBondContact O-N 3.27Å; A20-V23 WeakPolarHBondContact O-CG1 3.38Å; V23-R25 PolarHBondContact O-N 3.32Å; V23-W26 WeakPolarHBondContact O-CB 3.45Å; V23-W26 PolarHBondContact O-N 2.89Å; V23-L27 HydrophobicContact CG2-CD1 4.04Å; V23-L27 HydrophobicContact CG2-CG 4.12Å; V23-L27 WeakPolarHBondContact O-CB 3.44Å; V23-L27 VanDerWaalsContact O-CG 3.23Å; V23-L27 WeakPolarHBondContact O-CG 3.46Å; V23-L27 PolarHBondContact O-N 2.92Å; V23-M46 HydrophobicContact CG1-CE 3.39Å; V23-M46 HydrophobicContact CG1-CG 4.49Å; V23-M46 HydrophobicContact CG1-SD 3.86Å |
| 24 | R | 88.7 | Confident | 90.3 | Very high | 95 Ų | 95 | 62.2 Ų | 62.2 | 36% | 0.358 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -58.9 | -48.1 | 171.9 | -171.4 | -172.5 | 71.7 | 80.2 | 0.2 | 111.2 | A20 E21 W26 L27 L28 M46 | A20-R24 WeakPolarHBondContact O-CB 3.36Å; A20-R24 PolarHBondContact O-N 2.89Å; E21-R24 IonicContact OE1-CZ 2.79Å; E21-R24 IonicContact OE1-NE 2.7Å; E21-R24 IonicContact OE1-NH2 3.65Å; E21-R24 PolarHBondContact OE1-NH2 2.85Å; E21-R24 IonicContact OE2-CZ 3.11Å; E21-R24 VanDerWaalsContact OE2-CZ 3.26Å; E21-R24 IonicContact OE2-NE 2.93Å; E21-R24 PolarHBondContact OE2-NE 3.37Å; E21-R24 IonicContact OE2-NH2 3.26Å; E21-R24 PolarHBondContact OE2-NH2 3.48Å; R24-W26 PolarHBondContact O-N 2.88Å; R24-L27 PolarHBondContact O-N 3.31Å; R24-L28 WeakPolarHBondContact O-CG 3.24Å; R24-L28 PolarHBondContact O-N 2.88Å; R24-L28 VanDerWaalsContact O-N 3.12Å; R24-M46 HydrophobicContact CB-SD 4.5Å |
| 25 | R | 89.4 | Confident | 90.4 | Very high | 109 Ų | 109 | 64.4 Ų | 64.4 | 41% | 0.411 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -60.4 | -43.3 | 175.6 | -71.5 | 175.1 | -157.9 | 158.1 | -2.2 | 112.3 | E2 E21 C22 V23 L28 | E2-R25 IonicContact OE2-CZ 3.99Å; E2-R25 IonicContact OE2-NH2 3.89Å; E2-R25 PolarHBondContact OE2-NH2 3.27Å; E21-R25 WeakPolarHBondContact O-CG 3.35Å; E21-R25 PolarHBondContact O-N 3.34Å; E21-R25 IonicContact OE1-CZ 2.7Å; E21-R25 IonicContact OE1-NE 2.75Å; E21-R25 PolarHBondContact OE1-NE 3.43Å; E21-R25 IonicContact OE1-NH2 3.35Å; E21-R25 PolarHBondContact OE1-NH2 3.49Å; E21-R25 VanDerWaalsContact OE1-NH2 3.11Å; C22-R25 PolarHBondContact O-N 2.93Å; V23-R25 PolarHBondContact O-N 3.32Å; R25-L28 PolarHBondContact O-N 2.96Å |
| 26 | W | 91.4 | Very high | 90.6 | Very high | 109 Ų | 109 | 64.1 Ų | 64.1 | 41% | 0.413 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -59 | -50.4 | 175.7 | 177 | -88.9 | 0 | 0 | 0 | 111.4 | C22 V23 R24 L28 S29 N30 Y32 P34 | C22-W26 PolarHBondContact O-N 3.35Å; V23-W26 WeakPolarHBondContact O-CB 3.45Å; V23-W26 PolarHBondContact O-N 2.89Å; R24-W26 PolarHBondContact O-N 2.88Å; W26-L28 VanDerWaalsContact C-N 3.25Å; W26-L28 PolarHBondContact O-N 2.9Å; W26-S29 PolarHBondContact O-N 3.11Å; W26-S29 PolarHBondContact O-OG 3.33Å; W26-N30 HydrophobicContact CZ2-CB 4.28Å; W26-N30 PolarHBondContact O-N 3.06Å; W26-Y32 PolarHBondContact NE1-O 2.98Å; W26-P34 HydrophobicContact CD2-CG 3.98Å; W26-P34 HydrophobicContact CG-CG 3.94Å; W26-P34 HydrophobicContact CZ2-CB 4.36Å; W26-P34 HydrophobicContact CZ2-CG 4.44Å |
| 27 | L | 90.6 | Very high | 90.6 | Very high | 12 Ų | 12 | 70.5 Ų | 70.5 | 6% | 0.063 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -68 | -19.1 | -176 | -67.5 | 178.4 | 0 | 0 | 0 | 114.4 | L12 V23 R24 S29 N30 C40 A42 | L12-L27 HydrophobicContact CD2-CD1 3.9Å; V23-L27 HydrophobicContact CG2-CD1 4.04Å; V23-L27 HydrophobicContact CG2-CG 4.12Å; V23-L27 WeakPolarHBondContact O-CB 3.44Å; V23-L27 VanDerWaalsContact O-CG 3.23Å; V23-L27 WeakPolarHBondContact O-CG 3.46Å; V23-L27 PolarHBondContact O-N 2.92Å; R24-L27 PolarHBondContact O-N 3.31Å; L27-S29 VanDerWaalsContact C-N 3.28Å; L27-N30 WeakPolarHBondContact CA-O 3.32Å; L27-N30 WeakPolarHBondContact CD2-O 3.39Å; L27-C40 HydrophobicContact CD1-CB 4.19Å; L27-C40 HydrophobicContact CD2-CB 3.68Å; L27-A42 HydrophobicContact CB-CB 3.89Å |
| 28 | L | 88.8 | Confident | 90.6 | Very high | 126 Ų | 126 | 69.6 Ų | 69.6 | 66% | 0.66 | 35% | 0.349 | S | S | * | . | H | α-helix | trans | -66.6 | -31 | 169.3 | -72.9 | 171.4 | 0 | 0 | 0 | 112.4 | R24 R25 W26 | R24-L28 WeakPolarHBondContact O-CG 3.24Å; R24-L28 PolarHBondContact O-N 2.88Å; R24-L28 VanDerWaalsContact O-N 3.12Å; R25-L28 PolarHBondContact O-N 2.96Å; W26-L28 VanDerWaalsContact C-N 3.25Å; W26-L28 PolarHBondContact O-N 2.9Å |
| 29 | S | 90 | Very high | 90.5 | Very high | 83 Ų | 83 | 72.6 Ų | 72.6 | 58% | 0.58 | 37% | 0.372 | S | S | * | . | H | α-helix | trans | -99.6 | -32.8 | -179.7 | 66.9 | 0 | 0 | 0 | 0 | 113.4 | W26 L27 | W26-S29 PolarHBondContact O-N 3.11Å; W26-S29 PolarHBondContact O-OG 3.33Å; L27-S29 VanDerWaalsContact C-N 3.28Å |
| 30 | N | 91.2 | Very high | 90.3 | Very high | 69 Ų | 69 | 69.9 Ų | 69.9 | 37% | 0.369 | 36% | 0.36 | S | S | . | . | trans | -137.5 | 111.4 | -171.3 | -77.4 | -75.5 | 0 | 0 | 0 | 110.2 | W26 L27 Y32 | W26-N30 HydrophobicContact CZ2-CB 4.28Å; W26-N30 PolarHBondContact O-N 3.06Å; L27-N30 WeakPolarHBondContact CA-O 3.32Å; L27-N30 WeakPolarHBondContact CD2-O 3.39Å; N30-Y32 PolarHBondContact O-N 3.35Å | ||
| 31 | P | 90.2 | Very high | 89.8 | Confident | 68 Ų | 68 | 78.6 Ų | 78.6 | 44% | 0.442 | 39% | 0.39 | S | S | . | . | S | Bend | trans | -76.9 | 29.4 | -175.3 | 33.9 | -37.5 | 0 | 0 | 0 | 113.7 | P39 C40 | P31-P39 CarbonylContact O-C 3.43Å; P31-P39 WeakPolarHBondContact O-CA 3.46Å; P31-C40 CarbonylContact C-O 3.5Å; P31-C40 PolarHBondContact O-N 3.17Å |
| 32 | Y | 92.6 | Very high | 88.9 | Confident | 119 Ų | 119 | 76.8 Ų | 76.8 | 47% | 0.467 | 39% | 0.385 | S | S | . | . | B | Isolated β-bridge | trans | -131.6 | 145.4 | -174 | -58.9 | -73.8 | 0 | 0 | 0 | 111 | W26 N30 R37 C38 P39 | W26-Y32 PolarHBondContact NE1-O 2.98Å; N30-Y32 PolarHBondContact O-N 3.35Å; Y32-R37 VanDerWaalsContact CD1-O 3.24Å; Y32-R37 WeakPolarHBondContact CD1-O 3.35Å; Y32-C38 WeakPolarHBondContact CA-O 3.44Å; Y32-P39 HydrophobicContact CD1-CG 4.42Å; Y32-P39 HydrophobicContact CE1-CG 4.28Å |
| 33 | C | 92 | Very high | 87.9 | Confident | 2 Ų | 2 | 81.6 Ų | 81.6 | 1% | 0.014 | 41% | 0.407 | C | S | . | . | trans | -57.6 | 133 | 172.5 | 175.2 | 0 | 0 | 0 | 0 | 111.2 | L12 T35 C36 R37 C38 | L12-C33 HydrophobicContact CD1-CB 3.91Å; C33-T35 PolarHBondContact O-N 2.97Å; C33-T35 PolarHBondContact SG-N 3.42Å; C33-T35 VanDerWaalsContact SG-N 3.39Å; C33-C36 VanDerWaalsContact SG-SG 3.62Å; C33-R37 WeakPolarHBondContact O-CA 3.41Å; C33-R37 PolarHBondContact O-N 3.49Å; C33-C38 PolarHBondContact N-O 3.36Å | ||
| 34 | P | 92.7 | Very high | 87 | Confident | 52 Ų | 52 | 85.3 Ų | 85.3 | 34% | 0.338 | 43% | 0.433 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -57.3 | -32.3 | 175.9 | -24.3 | 31.2 | 0 | 0 | 0 | 114.4 | F18 W26 | F18-P34 HydrophobicContact CD1-CG 4.46Å; F18-P34 HydrophobicContact CE1-CB 4Å; F18-P34 HydrophobicContact CE1-CG 3.82Å; F18-P34 HydrophobicContact CZ-CB 4.16Å; F18-P34 HydrophobicContact CZ-CG 3.9Å; W26-P34 HydrophobicContact CD2-CG 3.98Å; W26-P34 HydrophobicContact CG-CG 3.94Å; W26-P34 HydrophobicContact CZ2-CB 4.36Å; W26-P34 HydrophobicContact CZ2-CG 4.44Å |
| 35 | T | 93.6 | Very high | 86 | Confident | 88 Ų | 88 | 81.3 Ų | 81.3 | 54% | 0.54 | 42% | 0.42 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -88.7 | -59.8 | -174 | -46.8 | 0 | 0 | 0 | 0 | 112.2 | H16 F18 C33 | H16-T35 WeakPolarHBondContact NE2-CG2 3.49Å; F18-T35 WeakPolarHBondContact CZ-OG1 3.42Å; C33-T35 PolarHBondContact O-N 2.97Å; C33-T35 PolarHBondContact SG-N 3.42Å; C33-T35 VanDerWaalsContact SG-N 3.39Å |
| 36 | C | 95.2 | Very high | 85.6 | Confident | 51 Ų | 51 | 78.6 Ų | 78.6 | 35% | 0.345 | 41% | 0.412 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -103.8 | -2.2 | -174.1 | 64.7 | 0 | 0 | 0 | 0 | 114.6 | C14 H16 C33 C38 | C14-C36 VanDerWaalsContact SG-SG 3.66Å; H16-C36 VanDerWaalsContact CE1-CB 3.48Å; H16-C36 WeakPolarHBondContact CE1-CB 3.3Å; H16-C36 PolarHBondContact CE1-SG 3.29Å; H16-C36 PolarHBondContact ND1-SG 2.98Å; H16-C36 VanDerWaalsContact ND1-SG 3.41Å; C33-C36 VanDerWaalsContact SG-SG 3.62Å; C36-C38 PolarHBondContact O-N 2.85Å; C36-C38 VanDerWaalsContact O-N 3.1Å; C36-C38 PolarHBondContact SG-SG 2.7Å |
| 37 | R | 92.1 | Very high | 85.3 | Confident | 196 Ų | 196 | 80 Ų | 80 | 74% | 0.74 | 42% | 0.418 | S | S | * | . | trans | 59.4 | 16.8 | -177.4 | -52.4 | -178.6 | 178.9 | -165.2 | -0 | 115.2 | Y32 C33 | Y32-R37 VanDerWaalsContact CD1-O 3.24Å; Y32-R37 WeakPolarHBondContact CD1-O 3.35Å; C33-R37 WeakPolarHBondContact O-CA 3.41Å; C33-R37 PolarHBondContact O-N 3.49Å | ||
| 38 | C | 90.8 | Very high | 85 | Confident | 58 Ų | 58 | 86.3 Ų | 86.3 | 39% | 0.392 | 45% | 0.445 | S | S | . | . | trans | -63.2 | 140.5 | 171.1 | -69.4 | 0 | 0 | 0 | 0 | 111.1 | C14 Y32 C33 C36 C40 | C14-C38 HydrophobicContact CB-CB 3.98Å; Y32-C38 WeakPolarHBondContact CA-O 3.44Å; C33-C38 PolarHBondContact N-O 3.36Å; C36-C38 PolarHBondContact O-N 2.85Å; C36-C38 VanDerWaalsContact O-N 3.1Å; C36-C38 PolarHBondContact SG-SG 2.7Å; C38-C40 PolarHBondContact O-N 2.93Å; C38-C40 PolarHBondContact O-SG 3.22Å | ||
| 39 | P | 89.6 | Confident | 84.7 | Confident | 103 Ų | 103 | 82.9 Ų | 82.9 | 67% | 0.669 | 43% | 0.427 | S | S | * | . | B | Isolated β-bridge | trans | -57.7 | 125.4 | 178.3 | -24.2 | 33.1 | 0 | 0 | 0 | 112.6 | P31 Y32 | P31-P39 CarbonylContact O-C 3.43Å; P31-P39 WeakPolarHBondContact O-CA 3.46Å; Y32-P39 HydrophobicContact CD1-CG 4.42Å; Y32-P39 HydrophobicContact CE1-CG 4.28Å |
| 40 | C | 84.2 | Confident | 83.9 | Confident | 3 Ų | 3 | 87.6 Ų | 87.6 | 2% | 0.02 | 44% | 0.441 | C | S | . | . | trans | -134.6 | 124.2 | -178.3 | -66.7 | 0 | 0 | 0 | 0 | 109.8 | L12 L27 P31 C38 C45 | L12-C40 HydrophobicContact CD1-CB 4.3Å; L12-C40 HydrophobicContact CD2-CB 4.42Å; L27-C40 HydrophobicContact CD1-CB 4.19Å; L27-C40 HydrophobicContact CD2-CB 3.68Å; P31-C40 CarbonylContact C-O 3.5Å; P31-C40 PolarHBondContact O-N 3.17Å; C38-C40 PolarHBondContact O-N 2.93Å; C38-C40 PolarHBondContact O-SG 3.22Å; C40-C45 HydrophobicContact CB-CB 4.36Å | ||
| 41 | R | 76.4 | Confident | 83 | Confident | 198 Ų | 198 | 88.8 Ų | 88.8 | 75% | 0.747 | 45% | 0.446 | S | S | * | . | trans | -94 | 130.4 | 174.6 | -68.7 | -174.3 | 179.3 | 164.8 | 0.3 | 109.8 | N43 S44 C45 | R41-N43 PolarHBondContact O-N 3.34Å; R41-S44 PolarHBondContact O-N 2.99Å; R41-S44 VanDerWaalsContact O-N 3.13Å; R41-C45 PolarHBondContact N-SG 3.47Å; R41-C45 PolarHBondContact O-N 2.69Å | ||
| 42 | A | 69.3 | Low | 82.1 | Confident | 21 Ų | 21 | 93.9 Ų | 93.9 | 17% | 0.174 | 46% | 0.464 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -48.4 | -36.6 | -169.7 | 0 | 0 | 0 | 0 | 0 | 115.2 | L27 M46 | L27-A42 HydrophobicContact CB-CB 3.89Å; A42-M46 VanDerWaalsContact O-SD 3.36Å |
| 43 | N | 67.9 | Low | 80.9 | Confident | 150 Ų | 150 | 94.4 Ų | 94.4 | 80% | 0.802 | 47% | 0.474 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -109.5 | -5 | -175.1 | -67.1 | -0.7 | 0 | 0 | 0 | 114.5 | R41 | R41-N43 PolarHBondContact O-N 3.34Š|
| 44 | S | 70.7 | Confident | 79.7 | Confident | 80 Ų | 80 | 100.2 Ų | 100.2 | 56% | 0.559 | 51% | 0.509 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -119 | -2 | -172.4 | -50.5 | 0 | 0 | 0 | 0 | 113.8 | K13 R41 | K13-S44 WeakPolarHBondContact CE-O 3.44Å; K13-S44 PolarHBondContact NZ-O 3.44Å; R41-S44 PolarHBondContact O-N 2.99Å; R41-S44 VanDerWaalsContact O-N 3.13Å |
| 45 | C | 67.9 | Low | 78.1 | Confident | 11 Ų | 11 | 99.9 Ų | 99.9 | 7% | 0.074 | 52% | 0.515 | C | S | . | . | S | Bend | trans | -125.3 | 10.1 | -173.2 | -67.7 | 0 | 0 | 0 | 0 | 114.2 | L12 K13 C40 R41 | L12-C45 CarbonylContact C-O 3.59Å; L12-C45 WeakPolarHBondContact CA-O 3.4Å; K13-C45 HydrophobicContact CB-CB 4.5Å; K13-C45 HydrophobicContact CD-CB 4.19Å; K13-C45 VanDerWaalsContact CD-SG 3.54Å; K13-C45 HydrophobicContact CG-CB 3.9Å; K13-C45 PolarHBondContact N-O 3.47Å; K13-C45 VanDerWaalsContact N-O 3.13Å; C40-C45 HydrophobicContact CB-CB 4.36Å; R41-C45 PolarHBondContact N-SG 3.47Å; R41-C45 PolarHBondContact O-N 2.69Å |
| 46 | M | 80.6 | Confident | 76.1 | Confident | 51 Ų | 51 | 104.7 Ų | 104.7 | 25% | 0.251 | 53% | 0.528 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -109 | 121.9 | -178.4 | -67.3 | 179.4 | 59.1 | 0 | 0 | 111.2 | A11 L12 A20 V23 R24 A42 | A11-M46 CarbonylContact O-C 3.6Å; A11-M46 WeakPolarHBondContact O-CA 3.47Å; L12-M46 HydrophobicContact CD2-CG 3.91Å; A20-M46 HydrophobicContact CB-CE 3.96Å; A20-M46 WeakPolarHBondContact O-CE 3.17Å; V23-M46 HydrophobicContact CG1-CE 3.39Å; V23-M46 HydrophobicContact CG1-CG 4.49Å; V23-M46 HydrophobicContact CG1-SD 3.86Å; R24-M46 HydrophobicContact CB-SD 4.5Å; A42-M46 VanDerWaalsContact O-SD 3.36Å |
| 47 | Y | 84.9 | Confident | 73.8 | Confident | 138 Ų | 138 | 107.9 Ų | 107.9 | 54% | 0.541 | 55% | 0.547 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.4 | 115.6 | 171.8 | -58.7 | -78.7 | 0 | 0 | 0 | 109 | S10 A11 K13 L49 | S10-Y47 CarbonylContact C-O 3.47Å; S10-Y47 WeakPolarHBondContact CA-O 3.33Å; A11-Y47 PolarHBondContact N-O 2.86Å; A11-Y47 PolarHBondContact O-N 3.17Å; K13-Y47 HydrophobicContact CG-CE2 3.93Å; Y47-L49 PolarHBondContact O-N 3.02Å |
| 48 | K | 84.6 | Confident | 71.6 | Confident | 145 Ų | 145 | 106 Ų | 106 | 63% | 0.63 | 55% | 0.551 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -68.3 | 123.9 | 176.4 | -173.4 | 171.5 | -175.6 | 173.3 | 0 | 109.3 | ||
| 49 | L | 82.1 | Confident | 69.6 | Low | 54 Ų | 54 | 111.2 Ų | 111.2 | 28% | 0.283 | 57% | 0.57 | S | S | . | * | trans | -90.2 | 125.9 | 177 | -59.7 | 177.9 | 0 | 0 | 0 | 108.7 | L9 A11 T17 Y47 L51 | L9-L49 HydrophobicContact CB-CB 4.41Å; L9-L49 HydrophobicContact CB-CD1 4.28Å; L9-L49 PolarHBondContact O-N 2.92Å; A11-L49 HydrophobicContact CB-CD1 4.34Å; A11-L49 HydrophobicContact CB-CD2 4.3Å; A11-L49 HydrophobicContact CB-CG 4.44Å; T17-L49 HydrophobicContact CG2-CD1 3.67Å; Y47-L49 PolarHBondContact O-N 3.02Å; L49-L51 HydrophobicContact CB-CG 4.38Å | ||
| 50 | Q | 74.2 | Confident | 67.5 | Low | 183 Ų | 183 | 113.9 Ų | 113.9 | 86% | 0.855 | 58% | 0.578 | S | S | * | * | trans | -98.7 | 99.4 | 169.9 | -67.8 | 179.7 | -1.2 | 0 | 0 | 107 | ||||
| 51 | L | 71.4 | Confident | 65.6 | Low | 94 Ų | 94 | 122.7 Ų | 122.7 | 49% | 0.492 | 62% | 0.619 | S | S | . | * | trans | -98 | 118.4 | 176.7 | -58.7 | 176.9 | 0 | 0 | 0 | 108.1 | L9 L49 | L9-L51 HydrophobicContact CD1-CD1 3.74Å; L49-L51 HydrophobicContact CB-CG 4.38Å | ||
| 52 | E | 71 | Confident | 63.9 | Low | 175 Ų | 175 | 120.7 Ų | 120.7 | 82% | 0.818 | 62% | 0.623 | S | S | * | * | trans | -93.7 | 111.6 | 169.5 | -173.1 | 169.4 | -162.4 | 0 | 0 | 107.7 | V54 | E52-V54 HydrophobicContact CG-CG2 4.33Å; E52-V54 PolarHBondContact O-N 3.42Å; E52-V54 VanDerWaalsContact O-N 3.11Å | ||
| 53 | I | 66.9 | Low | 63 | Low | 129 Ų | 129 | 125.3 Ų | 125.3 | 66% | 0.662 | 65% | 0.654 | S | S | * | * | trans | -79.2 | 95.6 | 173 | -56.9 | 175.5 | 0 | 0 | 0 | 106.2 | G55 | I53-G55 PolarHBondContact O-N 2.77Š| ||
| 54 | V | 68.4 | Low | 61.8 | Low | 124 Ų | 124 | 127.1 Ų | 127.1 | 75% | 0.752 | 66% | 0.657 | S | S | * | * | trans | -71.3 | 86 | 169.2 | -174.6 | 0 | 0 | 0 | 0 | 107.2 | E52 | E52-V54 HydrophobicContact CG-CG2 4.33Å; E52-V54 PolarHBondContact O-N 3.42Å; E52-V54 VanDerWaalsContact O-N 3.11Å | ||
| 55 | G | 57.7 | Low | 60.9 | Low | 45 Ų | 45 | 130 Ų | 130 | 46% | 0.464 | 67% | 0.666 | S | S | . | * | trans | -64.1 | 132.9 | 165.4 | 0 | 0 | 0 | 0 | 0 | 108.1 | I53 T57 | I53-G55 PolarHBondContact O-N 2.77Å; G55-T57 PolarHBondContact O-N 2.89Å | ||
| 56 | K | 52.8 | Low | 60.2 | Low | 189 Ų | 189 | 133.9 Ų | 133.9 | 82% | 0.822 | 69% | 0.694 | S | S | * | * | trans | -60.3 | 98 | 161.3 | -74.7 | 179.7 | 176.9 | 178.9 | 0 | 105.8 | D58 | K56-D58 PolarHBondContact O-N 2.85Å; K56-D58 VanDerWaalsContact O-N 3.15Å | ||
| 57 | T | 45.6 | Very low | 59.1 | Low | 119 Ų | 119 | 135.5 Ų | 135.5 | 73% | 0.73 | 71% | 0.71 | S | S | * | * | trans | -68.7 | 107.7 | 170 | 38.9 | 0 | 0 | 0 | 0 | 106.7 | G55 E59 | G55-T57 PolarHBondContact O-N 2.89Å; T57-E59 VanDerWaalsContact C-N 3.25Å; T57-E59 PolarHBondContact O-N 3.46Å | ||
| 58 | D | 47.5 | Very low | 57.8 | Low | 156 Ų | 156 | 132.7 Ų | 132.7 | 83% | 0.834 | 71% | 0.707 | S | S | * | * | trans | -63.2 | 86.3 | 169.8 | -66.6 | -44.5 | 0 | 0 | 0 | 109.2 | K56 | K56-D58 PolarHBondContact O-N 2.85Å; K56-D58 VanDerWaalsContact O-N 3.15Å | ||
| 59 | E | 48 | Very low | 56.9 | Low | 168 Ų | 168 | 131.3 Ų | 131.3 | 79% | 0.785 | 71% | 0.707 | S | S | * | * | trans | -111.1 | 72.9 | 161 | -67.8 | -170.6 | 174.4 | 0 | 0 | 107.7 | T57 | T57-E59 VanDerWaalsContact C-N 3.25Å; T57-E59 PolarHBondContact O-N 3.46Å | ||
| 60 | N | 46 | Very low | 56.4 | Low | 158 Ų | 158 | 133.5 Ų | 133.5 | 85% | 0.845 | 72% | 0.719 | S | S | * | * | trans | 179 | 85.7 | 148.6 | -95.1 | -20.6 | 0 | 0 | 0 | 109.1 | D62 | N60-D62 VanDerWaalsContact C-N 3.33Å; N60-D62 PolarHBondContact O-N 3.22Å; N60-D62 VanDerWaalsContact O-N 3.12Å | ||
| 61 | E | 43.5 | Very low | 56.9 | Low | 189 Ų | 189 | 129 Ų | 129 | 88% | 0.883 | 70% | 0.703 | S | S | * | * | trans | -59.9 | 100.8 | 146.7 | -64.7 | -168.8 | 147.2 | 0 | 0 | 106.7 | ||||
| 62 | D | 41.1 | Very low | 57.6 | Low | 155 Ų | 155 | 129.7 Ų | 129.7 | 83% | 0.829 | 70% | 0.704 | S | S | * | * | trans | 162.9 | 74.5 | 154.9 | -82.6 | -23.2 | 0 | 0 | 0 | 111.7 | N60 | N60-D62 VanDerWaalsContact C-N 3.33Å; N60-D62 PolarHBondContact O-N 3.22Å; N60-D62 VanDerWaalsContact O-N 3.12Å | ||
| 63 | S | 49.5 | Very low | 58.4 | Low | 118 Ų | 118 | 127.1 Ų | 127.1 | 83% | 0.825 | 69% | 0.691 | S | S | * | * | trans | 178.9 | 98.4 | 145.4 | -93 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 64 | H | 44.3 | Very low | 59.6 | Low | 188 Ų | 188 | 128.7 Ų | 128.7 | 87% | 0.87 | 69% | 0.688 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -55.7 | 132.7 | 170 | -98.5 | -87 | 0 | 0 | 0 | 112.3 | ||
| 65 | N | 51.7 | Low | 60.7 | Low | 140 Ų | 140 | 129 Ų | 129 | 75% | 0.749 | 68% | 0.682 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 103.9 | 21.9 | 156.7 | -64.4 | 2.6 | 0 | 0 | 0 | 121.8 | ||
| 66 | S | 52.9 | Low | 62.3 | Low | 94 Ų | 94 | 130.7 Ų | 130.7 | 66% | 0.657 | 68% | 0.683 | S | S | * | * | S | Bend | trans | -117 | -7.2 | 166.9 | 66.4 | 0 | 0 | 0 | 0 | 116.3 | ||
| 67 | S | 56.3 | Low | 64.3 | Low | 84 Ų | 84 | 123.3 Ų | 123.3 | 59% | 0.587 | 66% | 0.657 | S | S | * | * | S | Bend | trans | -82.4 | -11.8 | -178.4 | -178.6 | 0 | 0 | 0 | 0 | 114.4 | ||
| 68 | V | 59 | Low | 66.6 | Low | 79 Ų | 79 | 122.9 Ų | 122.9 | 48% | 0.479 | 65% | 0.65 | S | S | . | * | H | α-helix | trans | -72.2 | -36 | -176.8 | -176.4 | 0 | 0 | 0 | 0 | 110.6 | D70 V71 E72 | V68-D70 PolarHBondContact O-N 3.49Å; V68-V71 PolarHBondContact O-N 3Å; V68-E72 HydrophobicContact CG1-CG 4.24Å; V68-E72 WeakPolarHBondContact O-CG 3.49Å; V68-E72 PolarHBondContact O-N 3.05Å |
| 69 | D | 64.1 | Low | 68.9 | Low | 117 Ų | 117 | 120.1 Ų | 120.1 | 63% | 0.626 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -64.9 | -36.7 | -178.5 | -67.1 | -18.7 | 0 | 0 | 0 | 112.9 | F73 | D69-F73 WeakPolarHBondContact O-CB 3.44Å; D69-F73 PolarHBondContact O-N 3.27Å; D69-F73 VanDerWaalsContact O-N 3.09Å |
| 70 | D | 73.2 | Confident | 71.1 | Confident | 99 Ų | 99 | 116.7 Ų | 116.7 | 53% | 0.529 | 62% | 0.619 | S | S | . | * | H | α-helix | trans | -70.2 | -40 | 178.5 | -82.1 | -15.1 | 0 | 0 | 0 | 111.9 | V68 W74 | V68-D70 PolarHBondContact O-N 3.49Å; D70-W74 PolarHBondContact O-N 3.31Å |
| 71 | V | 84.8 | Confident | 73.5 | Confident | 88 Ų | 88 | 113.8 Ų | 113.8 | 53% | 0.533 | 60% | 0.6 | S | S | . | * | H | α-helix | trans | -70.8 | -43.5 | -179.8 | 178.1 | 0 | 0 | 0 | 0 | 110.6 | V68 F73 W74 Q75 | V68-V71 PolarHBondContact O-N 3Å; V71-F73 VanDerWaalsContact C-N 3.31Å; V71-F73 PolarHBondContact O-N 3.21Å; V71-W74 PolarHBondContact O-N 3.09Å; V71-Q75 VanDerWaalsContact O-CB 3.26Å; V71-Q75 WeakPolarHBondContact O-CB 3.43Å; V71-Q75 PolarHBondContact O-N 2.94Å |
| 72 | E | 85.6 | Confident | 76 | Confident | 109 Ų | 109 | 107 Ų | 107 | 51% | 0.509 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -62.7 | -37.7 | 176.6 | -73.9 | -173.7 | -177.7 | 0 | 0 | 112 | V68 T76 | V68-E72 HydrophobicContact CG1-CG 4.24Å; V68-E72 WeakPolarHBondContact O-CG 3.49Å; V68-E72 PolarHBondContact O-N 3.05Å; E72-T76 WeakPolarHBondContact O-CB 3.38Å; E72-T76 PolarHBondContact O-N 3.37Å; E72-T76 PolarHBondContact O-OG1 2.88Å |
| 73 | F | 88.1 | Confident | 78.6 | Confident | 122 Ų | 122 | 103 Ų | 103 | 54% | 0.535 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -59.8 | -53.3 | 173.6 | 173 | -96.1 | 0 | 0 | 0 | 111.8 | D69 V71 Q75 T76 A77 | D69-F73 WeakPolarHBondContact O-CB 3.44Å; D69-F73 PolarHBondContact O-N 3.27Å; D69-F73 VanDerWaalsContact O-N 3.09Å; V71-F73 VanDerWaalsContact C-N 3.31Å; V71-F73 PolarHBondContact O-N 3.21Å; F73-Q75 VanDerWaalsContact C-N 3.35Å; F73-Q75 PolarHBondContact O-N 3.26Å; F73-T76 PolarHBondContact O-N 3.19Å; F73-A77 WeakPolarHBondContact O-CB 3.36Å; F73-A77 PolarHBondContact O-N 3.02Å |
| 74 | W | 91.7 | Very high | 80.9 | Confident | 162 Ų | 162 | 104.1 Ų | 104.1 | 61% | 0.614 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -67.1 | -35.9 | -179.4 | -72.1 | 115.9 | 0 | 0 | 0 | 112.4 | D70 V71 T76 A77 L78 | D70-W74 PolarHBondContact O-N 3.31Å; V71-W74 PolarHBondContact O-N 3.09Å; W74-T76 VanDerWaalsContact C-N 3.35Å; W74-A77 HydrophobicContact CE3-CB 4.46Å; W74-A77 PolarHBondContact O-N 3.39Å; W74-L78 WeakPolarHBondContact O-CB 3.49Å; W74-L78 VanDerWaalsContact O-CG 3.3Å; W74-L78 WeakPolarHBondContact O-CG 3.27Å; W74-L78 PolarHBondContact O-N 3.05Å |
| 75 | Q | 91.5 | Very high | 83.4 | Confident | 130 Ų | 130 | 100.8 Ų | 100.8 | 61% | 0.607 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -62.9 | -43.5 | 174.5 | -174.4 | 173.4 | -2.7 | 0 | 0 | 111.2 | V71 F73 Q79 | V71-Q75 VanDerWaalsContact O-CB 3.26Å; V71-Q75 WeakPolarHBondContact O-CB 3.43Å; V71-Q75 PolarHBondContact O-N 2.94Å; F73-Q75 VanDerWaalsContact C-N 3.35Å; F73-Q75 PolarHBondContact O-N 3.26Å; Q75-Q79 VanDerWaalsContact O-CB 3.24Å; Q75-Q79 WeakPolarHBondContact O-CB 3.45Å; Q75-Q79 PolarHBondContact O-N 3.09Å |
| 76 | T | 91.7 | Very high | 85.5 | Confident | 80 Ų | 80 | 99.8 Ų | 99.8 | 49% | 0.491 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -66.7 | -41.3 | 175.9 | -56.1 | 0 | 0 | 0 | 0 | 111.6 | E72 F73 W74 Q79 N80 | E72-T76 WeakPolarHBondContact O-CB 3.38Å; E72-T76 PolarHBondContact O-N 3.37Å; E72-T76 PolarHBondContact O-OG1 2.88Å; F73-T76 PolarHBondContact O-N 3.19Å; W74-T76 VanDerWaalsContact C-N 3.35Å; T76-Q79 PolarHBondContact O-N 3.49Å; T76-N80 WeakPolarHBondContact O-CB 3.43Å; T76-N80 PolarHBondContact O-N 2.8Å; T76-N80 PolarHBondContact O-ND2 3.37Å |
| 77 | A | 93.5 | Very high | 87.7 | Confident | 34 Ų | 34 | 98.6 Ų | 98.6 | 28% | 0.281 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -62.6 | -47.8 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112 | F73 W74 Q79 N80 E81 | F73-A77 WeakPolarHBondContact O-CB 3.36Å; F73-A77 PolarHBondContact O-N 3.02Å; W74-A77 HydrophobicContact CE3-CB 4.46Å; W74-A77 PolarHBondContact O-N 3.39Å; A77-Q79 VanDerWaalsContact C-N 3.33Å; A77-Q79 PolarHBondContact O-N 2.9Å; A77-N80 PolarHBondContact O-N 3.45Å; A77-E81 PolarHBondContact O-N 2.94Å |
| 78 | L | 94.3 | Very high | 89.7 | Confident | 111 Ų | 111 | 99.3 Ų | 99.3 | 58% | 0.581 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -63.8 | -38.3 | 175.6 | -73.4 | 171.6 | 0 | 0 | 0 | 111.8 | W74 E81 S82 | W74-L78 WeakPolarHBondContact O-CB 3.49Å; W74-L78 VanDerWaalsContact O-CG 3.3Å; W74-L78 WeakPolarHBondContact O-CG 3.27Å; W74-L78 PolarHBondContact O-N 3.05Å; L78-E81 PolarHBondContact O-N 3.37Å; L78-S82 WeakPolarHBondContact O-CB 3.41Å; L78-S82 PolarHBondContact O-N 3.46Å |
| 79 | Q | 95.3 | Very high | 91.5 | Very high | 98 Ų | 98 | 100 Ų | 100 | 46% | 0.458 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -64.9 | -41.5 | 175.7 | -172.6 | 62.8 | 45.9 | 0 | 0 | 111.4 | Q75 T76 A77 S82 N83 | Q75-Q79 VanDerWaalsContact O-CB 3.24Å; Q75-Q79 WeakPolarHBondContact O-CB 3.45Å; Q75-Q79 PolarHBondContact O-N 3.09Å; T76-Q79 PolarHBondContact O-N 3.49Å; A77-Q79 VanDerWaalsContact C-N 3.33Å; A77-Q79 PolarHBondContact O-N 2.9Å; Q79-S82 WeakPolarHBondContact O-CB 3.4Å; Q79-S82 PolarHBondContact O-N 3.36Å; Q79-N83 PolarHBondContact NE2-OD1 3.21Å; Q79-N83 WeakPolarHBondContact O-CB 3.45Å; Q79-N83 PolarHBondContact O-N 2.76Å; Q79-N83 PolarHBondContact O-ND2 3.42Å; Q79-N83 PolarHBondContact O-OD1 3.31Å |
| 80 | N | 94.7 | Very high | 93.1 | Very high | 95 Ų | 95 | 96 Ų | 96 | 51% | 0.508 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -64.3 | -43 | 176.4 | -71.3 | -21.7 | 0 | 0 | 0 | 111.7 | T76 A77 N83 E84 | T76-N80 WeakPolarHBondContact O-CB 3.43Å; T76-N80 PolarHBondContact O-N 2.8Å; T76-N80 PolarHBondContact O-ND2 3.37Å; A77-N80 PolarHBondContact O-N 3.45Å; N80-N83 PolarHBondContact O-N 2.85Å; N80-E84 WeakPolarHBondContact O-CB 3.2Å; N80-E84 PolarHBondContact O-N 2.86Å |
| 81 | E | 96 | Very high | 94.3 | Very high | 97 Ų | 97 | 96.3 Ų | 96.3 | 45% | 0.453 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -64.1 | -41 | 175.9 | -162.3 | -176.4 | 178.9 | 0 | 0 | 111.2 | A77 L78 E84 F85 | A77-E81 PolarHBondContact O-N 2.94Å; L78-E81 PolarHBondContact O-N 3.37Å; E81-E84 PolarHBondContact O-N 3.26Å; E81-F85 HydrophobicContact CG-CD2 4.08Å; E81-F85 HydrophobicContact CG-CE2 3.5Å; E81-F85 VanDerWaalsContact CG-CE2 3.5Å; E81-F85 HydrophobicContact CG-CZ 4.07Å; E81-F85 WeakPolarHBondContact O-CD2 3.5Å; E81-F85 PolarHBondContact O-N 3.21Å |
| 82 | S | 95.7 | Very high | 94.9 | Very high | 48 Ų | 48 | 96 Ų | 96 | 34% | 0.336 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -59.5 | -46.9 | 172.5 | -167.8 | 0 | 0 | 0 | 0 | 111.6 | L78 Q79 E84 F85 E86 | L78-S82 WeakPolarHBondContact O-CB 3.41Å; L78-S82 PolarHBondContact O-N 3.46Å; Q79-S82 WeakPolarHBondContact O-CB 3.4Å; Q79-S82 PolarHBondContact O-N 3.36Å; S82-E84 VanDerWaalsContact C-N 3.31Å; S82-E84 PolarHBondContact O-N 3.35Å; S82-F85 PolarHBondContact O-N 3.39Å; S82-E86 WeakPolarHBondContact O-CB 3.17Å; S82-E86 WeakPolarHBondContact O-CG 3.37Å; S82-E86 PolarHBondContact O-N 2.83Å |
| 83 | N | 96.7 | Very high | 95.5 | Very high | 71 Ų | 71 | 96.9 Ų | 96.9 | 38% | 0.38 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -63.6 | -37.1 | 178 | -64.7 | -16.3 | 0 | 0 | 0 | 111.7 | Q79 N80 E86 A87 | Q79-N83 PolarHBondContact NE2-OD1 3.21Å; Q79-N83 WeakPolarHBondContact O-CB 3.45Å; Q79-N83 PolarHBondContact O-N 2.76Å; Q79-N83 PolarHBondContact O-ND2 3.42Å; Q79-N83 PolarHBondContact O-OD1 3.31Å; N80-N83 PolarHBondContact O-N 2.85Å; N83-E86 PolarHBondContact O-N 2.65Å; N83-A87 WeakPolarHBondContact O-CB 3.42Å; N83-A87 PolarHBondContact O-N 2.87Å |
| 84 | E | 97.5 | Very high | 95.9 | Very high | 141 Ų | 141 | 93.6 Ų | 93.6 | 66% | 0.659 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -65.6 | -44.7 | 176 | -174.5 | 177.6 | 171.9 | 0 | 0 | 111.5 | N80 E81 S82 A87 K88 | N80-E84 WeakPolarHBondContact O-CB 3.2Å; N80-E84 PolarHBondContact O-N 2.86Å; E81-E84 PolarHBondContact O-N 3.26Å; S82-E84 VanDerWaalsContact C-N 3.31Å; S82-E84 PolarHBondContact O-N 3.35Å; E84-A87 PolarHBondContact O-N 3.35Å; E84-K88 PolarHBondContact O-N 3.07Å |
| 85 | F | 96.4 | Very high | 96.2 | Very high | 118 Ų | 118 | 90.5 Ų | 90.5 | 52% | 0.518 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -64.8 | -41.4 | 174.8 | -69.8 | -48 | 0 | 0 | 0 | 112.2 | E81 S82 A87 K88 I89 | E81-F85 HydrophobicContact CG-CD2 4.08Å; E81-F85 HydrophobicContact CG-CE2 3.5Å; E81-F85 VanDerWaalsContact CG-CE2 3.5Å; E81-F85 HydrophobicContact CG-CZ 4.07Å; E81-F85 WeakPolarHBondContact O-CD2 3.5Å; E81-F85 PolarHBondContact O-N 3.21Å; S82-F85 PolarHBondContact O-N 3.39Å; F85-A87 VanDerWaalsContact C-N 3.34Å; F85-A87 PolarHBondContact O-N 3.19Å; F85-K88 PolarHBondContact O-N 3.37Å; F85-I89 WeakPolarHBondContact O-CB 3.49Å; F85-I89 VanDerWaalsContact O-CG1 3.24Å; F85-I89 WeakPolarHBondContact O-CG1 3.46Å; F85-I89 PolarHBondContact O-N 2.93Å |
| 86 | E | 97.5 | Very high | 96.5 | Very high | 119 Ų | 119 | 87.9 Ų | 87.9 | 56% | 0.556 | 47% | 0.468 | S | S | * | . | H | α-helix | trans | -60.1 | -43.2 | 174.3 | -76.7 | 177.2 | -162.8 | 0 | 0 | 111.6 | S82 N83 K88 I89 G90 | S82-E86 WeakPolarHBondContact O-CB 3.17Å; S82-E86 WeakPolarHBondContact O-CG 3.37Å; S82-E86 PolarHBondContact O-N 2.83Å; N83-E86 PolarHBondContact O-N 2.65Å; E86-K88 PolarHBondContact O-N 2.87Å; E86-I89 PolarHBondContact O-N 3.4Å; E86-G90 PolarHBondContact O-N 3.17Å |
| 87 | A | 97.6 | Very high | 96.8 | Very high | 68 Ų | 68 | 91.3 Ų | 91.3 | 56% | 0.562 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -62.2 | -42.4 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | N83 E84 F85 G90 E91 | N83-A87 WeakPolarHBondContact O-CB 3.42Å; N83-A87 PolarHBondContact O-N 2.87Å; E84-A87 PolarHBondContact O-N 3.35Å; F85-A87 VanDerWaalsContact C-N 3.34Å; F85-A87 PolarHBondContact O-N 3.19Å; A87-G90 PolarHBondContact O-N 3.26Å; A87-E91 PolarHBondContact O-N 2.95Å |
| 88 | K | 97.8 | Very high | 97.1 | Very high | 100 Ų | 100 | 96 Ų | 96 | 44% | 0.435 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -68.3 | -38.7 | 178.9 | -170.8 | 66.6 | -166.4 | 169.4 | 0 | 112.7 | E84 F85 E86 E91 L92 | E84-K88 PolarHBondContact O-N 3.07Å; F85-K88 PolarHBondContact O-N 3.37Å; E86-K88 PolarHBondContact O-N 2.87Å; K88-E91 WeakPolarHBondContact CD-OE2 3.21Å; K88-E91 IonicContact NZ-OE1 3.62Å; K88-E91 IonicContact NZ-OE2 3.45Å; K88-E91 PolarHBondContact NZ-OE2 3.48Å; K88-E91 PolarHBondContact O-N 3.14Å; K88-L92 HydrophobicContact CG-CD1 4.26Å; K88-L92 WeakPolarHBondContact O-CG 3.25Å; K88-L92 PolarHBondContact O-N 2.98Å |
| 89 | I | 97.5 | Very high | 97.2 | Very high | 92 Ų | 92 | 95.2 Ų | 95.2 | 47% | 0.472 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -60.6 | -48.8 | 173.3 | -71.6 | 165.6 | 0 | 0 | 0 | 109.3 | F85 E86 E91 L92 E93 | F85-I89 WeakPolarHBondContact O-CB 3.49Å; F85-I89 VanDerWaalsContact O-CG1 3.24Å; F85-I89 WeakPolarHBondContact O-CG1 3.46Å; F85-I89 PolarHBondContact O-N 2.93Å; E86-I89 PolarHBondContact O-N 3.4Å; I89-E91 VanDerWaalsContact C-N 3.3Å; I89-E91 PolarHBondContact O-N 3.43Å; I89-L92 PolarHBondContact O-N 3.02Å; I89-E93 HydrophobicContact CG2-CG 4.2Å; I89-E93 WeakPolarHBondContact O-CB 3.07Å; I89-E93 VanDerWaalsContact O-CG 3.3Å; I89-E93 WeakPolarHBondContact O-CG 3.42Å; I89-E93 PolarHBondContact O-N 3.39Å |
| 90 | G | 97.9 | Very high | 97.3 | Very high | 35 Ų | 35 | 96.2 Ų | 96.2 | 36% | 0.361 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -59 | -39 | 177.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | E86 A87 S94 | E86-G90 PolarHBondContact O-N 3.17Å; A87-G90 PolarHBondContact O-N 3.26Å; G90-S94 WeakPolarHBondContact O-CB 3.48Å; G90-S94 PolarHBondContact O-N 3.41Å |
| 91 | E | 98 | Very high | 97.5 | Very high | 105 Ų | 105 | 98.9 Ų | 98.9 | 49% | 0.491 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -62.5 | -51.4 | 174.5 | -171 | -173 | -171.4 | 0 | 0 | 111.6 | A87 K88 I89 E93 S94 E95 | A87-E91 PolarHBondContact O-N 2.95Å; K88-E91 WeakPolarHBondContact CD-OE2 3.21Å; K88-E91 IonicContact NZ-OE1 3.62Å; K88-E91 IonicContact NZ-OE2 3.45Å; K88-E91 PolarHBondContact NZ-OE2 3.48Å; K88-E91 PolarHBondContact O-N 3.14Å; I89-E91 VanDerWaalsContact C-N 3.3Å; I89-E91 PolarHBondContact O-N 3.43Å; E91-E93 PolarHBondContact O-N 2.92Å; E91-S94 WeakPolarHBondContact O-CB 3.49Å; E91-S94 PolarHBondContact O-N 3.33Å; E91-S94 VanDerWaalsContact O-N 3.17Å; E91-S94 PolarHBondContact O-OG 3.43Å; E91-E95 PolarHBondContact O-N 3.05Å |
| 92 | L | 97.5 | Very high | 97.6 | Very high | 81 Ų | 81 | 100 Ų | 100 | 42% | 0.424 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -64.9 | -36.9 | -179.2 | -71.7 | 172.2 | 0 | 0 | 0 | 112.5 | K88 I89 S94 E95 T96 | K88-L92 HydrophobicContact CG-CD1 4.26Å; K88-L92 WeakPolarHBondContact O-CG 3.25Å; K88-L92 PolarHBondContact O-N 2.98Å; I89-L92 PolarHBondContact O-N 3.02Å; L92-S94 VanDerWaalsContact C-N 3.34Å; L92-E95 PolarHBondContact O-N 3.13Å; L92-T96 WeakPolarHBondContact O-CB 3.41Å; L92-T96 PolarHBondContact O-N 3.24Å; L92-T96 PolarHBondContact O-OG1 3.48Å |
| 93 | E | 98.2 | Very high | 97.7 | Very high | 128 Ų | 128 | 103.3 Ų | 103.3 | 60% | 0.598 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -63.4 | -41.5 | 173.3 | -74.9 | 179.8 | 168.3 | 0 | 0 | 111.2 | I89 E91 E95 T96 K97 | I89-E93 HydrophobicContact CG2-CG 4.2Å; I89-E93 WeakPolarHBondContact O-CB 3.07Å; I89-E93 VanDerWaalsContact O-CG 3.3Å; I89-E93 WeakPolarHBondContact O-CG 3.42Å; I89-E93 PolarHBondContact O-N 3.39Å; E91-E93 PolarHBondContact O-N 2.92Å; E93-E95 VanDerWaalsContact C-N 3.33Å; E93-E95 PolarHBondContact O-N 2.84Å; E93-T96 PolarHBondContact O-N 3.24Å; E93-K97 WeakPolarHBondContact O-CB 3.33Å; E93-K97 PolarHBondContact O-N 3.45Å |
| 94 | S | 97.5 | Very high | 97.7 | Very high | 52 Ų | 52 | 103.2 Ų | 103.2 | 36% | 0.364 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -64.4 | -37.7 | 176 | 87.1 | 0 | 0 | 0 | 0 | 112.4 | G90 E91 L92 K98 | G90-S94 WeakPolarHBondContact O-CB 3.48Å; G90-S94 PolarHBondContact O-N 3.41Å; E91-S94 WeakPolarHBondContact O-CB 3.49Å; E91-S94 PolarHBondContact O-N 3.33Å; E91-S94 VanDerWaalsContact O-N 3.17Å; E91-S94 PolarHBondContact O-OG 3.43Å; L92-S94 VanDerWaalsContact C-N 3.34Å; S94-K98 VanDerWaalsContact O-CG 3.32Å; S94-K98 WeakPolarHBondContact O-CG 3.5Å; S94-K98 PolarHBondContact O-N 3.41Å; S94-K98 VanDerWaalsContact O-N 3.17Å |
| 95 | E | 98.3 | Very high | 97.7 | Very high | 98 Ų | 98 | 101.6 Ų | 101.6 | 46% | 0.458 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -68.8 | -45.3 | 176.9 | -173.5 | 174.5 | -168.2 | 0 | 0 | 111.2 | E91 L92 E93 K97 K98 L99 | E91-E95 PolarHBondContact O-N 3.05Å; L92-E95 PolarHBondContact O-N 3.13Å; E93-E95 VanDerWaalsContact C-N 3.33Å; E93-E95 PolarHBondContact O-N 2.84Å; E95-K97 VanDerWaalsContact C-N 3.31Å; E95-K97 PolarHBondContact O-N 3.04Å; E95-K98 WeakPolarHBondContact O-CB 3.29Å; E95-K98 PolarHBondContact O-N 3.42Å; E95-K98 VanDerWaalsContact O-N 3.09Å; E95-L99 HydrophobicContact CG-CD1 4.3Å; E95-L99 WeakPolarHBondContact O-CG 3.5Å; E95-L99 PolarHBondContact O-N 2.91Å |
| 96 | T | 97.5 | Very high | 97.8 | Very high | 74 Ų | 74 | 101 Ų | 101 | 45% | 0.454 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -57 | -46.2 | 176.3 | -55.9 | 0 | 0 | 0 | 0 | 110.6 | L92 E93 K98 L99 E100 | L92-T96 WeakPolarHBondContact O-CB 3.41Å; L92-T96 PolarHBondContact O-N 3.24Å; L92-T96 PolarHBondContact O-OG1 3.48Å; E93-T96 PolarHBondContact O-N 3.24Å; T96-K98 VanDerWaalsContact C-N 3.34Å; T96-K98 PolarHBondContact O-N 3.26Å; T96-L99 PolarHBondContact O-N 3.33Å; T96-E100 WeakPolarHBondContact O-CG 3.44Å; T96-E100 PolarHBondContact O-N 3.5Å |
| 97 | K | 98.1 | Very high | 97.8 | Very high | 153 Ų | 153 | 97.7 Ų | 97.7 | 67% | 0.665 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -61.9 | -37.2 | 176.7 | -172.9 | 176.4 | -178.2 | 176.4 | 0 | 113.2 | E93 E95 K101 | E93-K97 WeakPolarHBondContact O-CB 3.33Å; E93-K97 PolarHBondContact O-N 3.45Å; E95-K97 VanDerWaalsContact C-N 3.31Å; E95-K97 PolarHBondContact O-N 3.04Å; K97-K101 PolarHBondContact O-N 3.41Å |
| 98 | K | 98.1 | Very high | 97.8 | Very high | 132 Ų | 132 | 97.6 Ų | 97.6 | 57% | 0.574 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -66 | -45.6 | 175 | -71.9 | 166.9 | -174.5 | 168.3 | 0 | 110.9 | S94 E95 T96 K101 H102 | S94-K98 VanDerWaalsContact O-CG 3.32Å; S94-K98 WeakPolarHBondContact O-CG 3.5Å; S94-K98 PolarHBondContact O-N 3.41Å; S94-K98 VanDerWaalsContact O-N 3.17Å; E95-K98 WeakPolarHBondContact O-CB 3.29Å; E95-K98 PolarHBondContact O-N 3.42Å; E95-K98 VanDerWaalsContact O-N 3.09Å; T96-K98 VanDerWaalsContact C-N 3.34Å; T96-K98 PolarHBondContact O-N 3.26Å; K98-K101 WeakPolarHBondContact O-CB 3.15Å; K98-K101 PolarHBondContact O-N 3Å; K98-H102 PolarHBondContact O-CD2 3.28Å; K98-H102 VanDerWaalsContact O-CD2 3.31Å; K98-H102 PolarHBondContact O-N 3.21Å |
| 99 | L | 97.7 | Very high | 97.8 | Very high | 95 Ų | 95 | 96.1 Ų | 96.1 | 50% | 0.497 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -63.8 | -41.5 | 178.3 | -70.9 | 173.1 | 0 | 0 | 0 | 112.1 | E95 T96 K101 H102 L103 | E95-L99 HydrophobicContact CG-CD1 4.3Å; E95-L99 WeakPolarHBondContact O-CG 3.5Å; E95-L99 PolarHBondContact O-N 2.91Å; T96-L99 PolarHBondContact O-N 3.33Å; L99-K101 VanDerWaalsContact C-N 3.31Å; L99-K101 PolarHBondContact O-N 3.48Å; L99-H102 PolarHBondContact O-N 3.47Å; L99-L103 WeakPolarHBondContact O-CG 3.33Å; L99-L103 PolarHBondContact O-N 3.45Å |
| 100 | E | 98.1 | Very high | 97.8 | Very high | 118 Ų | 118 | 96.3 Ų | 96.3 | 55% | 0.551 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -58.5 | -42.7 | 173.7 | -74.9 | 176.2 | 166.5 | 0 | 0 | 111.9 | T96 L103 S104 | T96-E100 WeakPolarHBondContact O-CG 3.44Å; T96-E100 PolarHBondContact O-N 3.5Å; E100-L103 PolarHBondContact O-N 2.96Å; E100-S104 WeakPolarHBondContact O-CB 3.23Å; E100-S104 PolarHBondContact O-N 2.7Å |
| 101 | K | 98 | Very high | 97.8 | Very high | 152 Ų | 152 | 100.7 Ų | 100.7 | 66% | 0.661 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -62.5 | -43.8 | 175.1 | -173.8 | -177.9 | 178.4 | -176.5 | 0 | 111.3 | K97 K98 L99 S104 Q105 | K97-K101 PolarHBondContact O-N 3.41Å; K98-K101 WeakPolarHBondContact O-CB 3.15Å; K98-K101 PolarHBondContact O-N 3Å; L99-K101 VanDerWaalsContact C-N 3.31Å; L99-K101 PolarHBondContact O-N 3.48Å; K101-S104 PolarHBondContact O-N 3.09Å; K101-S104 PolarHBondContact O-OG 3.49Å; K101-Q105 PolarHBondContact O-N 2.87Å |
| 102 | H | 98 | Very high | 97.8 | Very high | 119 Ų | 119 | 100.6 Ų | 100.6 | 55% | 0.551 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -63.2 | -43.3 | 177 | -71.8 | -165.4 | 0 | 0 | 0 | 112.1 | K98 L99 S104 Q105 I106 | K98-H102 PolarHBondContact O-CD2 3.28Å; K98-H102 VanDerWaalsContact O-CD2 3.31Å; K98-H102 PolarHBondContact O-N 3.21Å; L99-H102 PolarHBondContact O-N 3.47Å; H102-S104 VanDerWaalsContact C-N 3.28Å; H102-S104 PolarHBondContact O-N 3.12Å; H102-Q105 PolarHBondContact O-N 2.75Å; H102-I106 WeakPolarHBondContact O-CG1 3.41Å; H102-I106 PolarHBondContact O-N 3.32Å |
| 103 | L | 97.7 | Very high | 97.8 | Very high | 118 Ų | 118 | 100.6 Ų | 100.6 | 62% | 0.618 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -61.2 | -38 | 175 | -74 | 175.4 | 0 | 0 | 0 | 111.8 | L99 E100 Q105 I106 A107 | L99-L103 WeakPolarHBondContact O-CG 3.33Å; L99-L103 PolarHBondContact O-N 3.45Å; E100-L103 PolarHBondContact O-N 2.96Å; L103-Q105 VanDerWaalsContact C-N 3.35Å; L103-I106 PolarHBondContact O-N 3.42Å; L103-A107 WeakPolarHBondContact O-CB 3.24Å; L103-A107 PolarHBondContact O-N 3.5Å |
| 104 | S | 97.1 | Very high | 97.7 | Very high | 70 Ų | 70 | 99.1 Ų | 99.1 | 49% | 0.49 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -63.6 | -40.3 | 176 | 80.8 | 0 | 0 | 0 | 0 | 112.1 | E100 K101 H102 A107 T108 | E100-S104 WeakPolarHBondContact O-CB 3.23Å; E100-S104 PolarHBondContact O-N 2.7Å; K101-S104 PolarHBondContact O-N 3.09Å; K101-S104 PolarHBondContact O-OG 3.49Å; H102-S104 VanDerWaalsContact C-N 3.28Å; H102-S104 PolarHBondContact O-N 3.12Å; S104-A107 PolarHBondContact O-N 3.06Å; S104-T108 PolarHBondContact O-N 2.93Å; S104-T108 VanDerWaalsContact O-N 3.12Å; S104-T108 PolarHBondContact O-OG1 2.9Å |
| 105 | Q | 97.8 | Very high | 97.7 | Very high | 106 Ų | 106 | 104.6 Ų | 104.6 | 50% | 0.495 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -68.3 | -46.3 | 176.8 | -174.2 | 61.4 | 53.3 | 0 | 0 | 111.8 | K101 H102 L103 A107 T108 D109 | K101-Q105 PolarHBondContact O-N 2.87Å; H102-Q105 PolarHBondContact O-N 2.75Å; L103-Q105 VanDerWaalsContact C-N 3.35Å; Q105-A107 PolarHBondContact O-N 3.11Å; Q105-T108 WeakPolarHBondContact CA-OG1 3.44Å; Q105-T108 PolarHBondContact NE2-OG1 2.79Å; Q105-T108 PolarHBondContact O-N 2.7Å; Q105-T108 VanDerWaalsContact O-N 3.09Å; Q105-T108 PolarHBondContact O-OG1 2.85Å; Q105-D109 PolarHBondContact NE2-OD1 2.81Å; Q105-D109 PolarHBondContact O-N 3.1Å |
| 106 | I | 97.8 | Very high | 97.6 | Very high | 105 Ų | 105 | 102.5 Ų | 102.5 | 54% | 0.538 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -60.5 | -38.9 | 176.9 | -68.2 | 167.6 | 0 | 0 | 0 | 110.4 | H102 L103 T108 D109 L110 | H102-I106 WeakPolarHBondContact O-CG1 3.41Å; H102-I106 PolarHBondContact O-N 3.32Å; L103-I106 PolarHBondContact O-N 3.42Å; I106-T108 VanDerWaalsContact C-N 3.34Å; I106-T108 PolarHBondContact O-N 2.75Å; I106-D109 PolarHBondContact O-N 3.26Å; I106-L110 VanDerWaalsContact O-CB 3.29Å; I106-L110 WeakPolarHBondContact O-CB 3.37Å; I106-L110 PolarHBondContact O-N 3.07Å |
| 107 | A | 97.8 | Very high | 97.6 | Very high | 50 Ų | 50 | 103.4 Ų | 103.4 | 41% | 0.413 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -64.6 | -36.7 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | L103 S104 Q105 K111 | L103-A107 WeakPolarHBondContact O-CB 3.24Å; L103-A107 PolarHBondContact O-N 3.5Å; S104-A107 PolarHBondContact O-N 3.06Å; Q105-A107 PolarHBondContact O-N 3.11Å; A107-K111 WeakPolarHBondContact O-CG 3.29Å; A107-K111 PolarHBondContact O-N 3.49Å |
| 108 | T | 97.8 | Very high | 97.6 | Very high | 67 Ų | 67 | 103 Ų | 103 | 41% | 0.411 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -68.9 | -42.5 | 173.2 | 51 | 0 | 0 | 0 | 0 | 112.1 | S104 Q105 I106 L110 K111 L112 | S104-T108 PolarHBondContact O-N 2.93Å; S104-T108 VanDerWaalsContact O-N 3.12Å; S104-T108 PolarHBondContact O-OG1 2.9Å; Q105-T108 WeakPolarHBondContact CA-OG1 3.44Å; Q105-T108 PolarHBondContact NE2-OG1 2.79Å; Q105-T108 PolarHBondContact O-N 2.7Å; Q105-T108 VanDerWaalsContact O-N 3.09Å; Q105-T108 PolarHBondContact O-OG1 2.85Å; I106-T108 VanDerWaalsContact C-N 3.34Å; I106-T108 PolarHBondContact O-N 2.75Å; T108-L110 VanDerWaalsContact C-N 3.35Å; T108-L110 PolarHBondContact O-N 2.95Å; T108-K111 WeakPolarHBondContact O-CB 3.43Å; T108-K111 PolarHBondContact O-N 2.83Å; T108-L112 PolarHBondContact O-N 3.13Å; T108-L112 VanDerWaalsContact O-N 3.08Å |
| 109 | D | 98.1 | Very high | 97.6 | Very high | 68 Ų | 68 | 100.7 Ų | 100.7 | 36% | 0.364 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -65.2 | -40.4 | 179.8 | -62.9 | -12.4 | 0 | 0 | 0 | 111 | Q105 I106 K111 L112 C113 | Q105-D109 PolarHBondContact NE2-OD1 2.81Å; Q105-D109 PolarHBondContact O-N 3.1Å; I106-D109 PolarHBondContact O-N 3.26Å; D109-K111 VanDerWaalsContact C-N 3.31Å; D109-K111 PolarHBondContact O-N 3.24Å; D109-L112 WeakPolarHBondContact O-CB 3.47Å; D109-L112 PolarHBondContact O-N 3.02Å; D109-L112 VanDerWaalsContact O-N 3.12Å; D109-C113 PolarHBondContact O-N 3.3Å; D109-C113 PolarHBondContact O-SG 2.9Å; D109-C113 VanDerWaalsContact O-SG 3.4Å |
| 110 | L | 97.8 | Very high | 97.5 | Very high | 96 Ų | 96 | 99.9 Ų | 99.9 | 50% | 0.503 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -61.2 | -39.5 | 175.7 | -173.7 | 140.1 | 0 | 0 | 0 | 111.8 | I106 T108 C113 Q114 | I106-L110 VanDerWaalsContact O-CB 3.29Å; I106-L110 WeakPolarHBondContact O-CB 3.37Å; I106-L110 PolarHBondContact O-N 3.07Å; T108-L110 VanDerWaalsContact C-N 3.35Å; T108-L110 PolarHBondContact O-N 2.95Å; L110-C113 PolarHBondContact O-N 2.99Å; L110-Q114 HydrophobicContact CD2-CG 4.34Å; L110-Q114 VanDerWaalsContact CD2-NE2 3.32Å; L110-Q114 WeakPolarHBondContact O-CB 3.39Å; L110-Q114 VanDerWaalsContact O-CG 3.27Å; L110-Q114 WeakPolarHBondContact O-CG 3.42Å; L110-Q114 PolarHBondContact O-N 3.31Å |
| 111 | K | 97.5 | Very high | 97.5 | Very high | 127 Ų | 127 | 96.6 Ų | 96.6 | 55% | 0.552 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -64.7 | -38.7 | 173.8 | -72.7 | 174 | -178 | 177.9 | 0 | 112.1 | A107 T108 D109 R115 | A107-K111 WeakPolarHBondContact O-CG 3.29Å; A107-K111 PolarHBondContact O-N 3.49Å; T108-K111 WeakPolarHBondContact O-CB 3.43Å; T108-K111 PolarHBondContact O-N 2.83Å; D109-K111 VanDerWaalsContact C-N 3.31Å; D109-K111 PolarHBondContact O-N 3.24Å; K111-R115 WeakPolarHBondContact O-CG 3.27Å; K111-R115 PolarHBondContact O-N 3.44Å |
| 112 | L | 97.2 | Very high | 97.5 | Very high | 104 Ų | 104 | 94.8 Ų | 94.8 | 55% | 0.545 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -66.2 | -46.7 | 175.8 | -69 | 174.8 | 0 | 0 | 0 | 111.2 | T108 D109 Q114 R115 A116 | T108-L112 PolarHBondContact O-N 3.13Å; T108-L112 VanDerWaalsContact O-N 3.08Å; D109-L112 WeakPolarHBondContact O-CB 3.47Å; D109-L112 PolarHBondContact O-N 3.02Å; D109-L112 VanDerWaalsContact O-N 3.12Å; L112-Q114 VanDerWaalsContact C-N 3.32Å; L112-Q114 PolarHBondContact O-N 3.35Å; L112-R115 PolarHBondContact O-N 3.3Å; L112-R115 VanDerWaalsContact O-N 3.15Å; L112-A116 PolarHBondContact O-N 3.21Å |
| 113 | C | 97 | Very high | 97.4 | Very high | 81 Ų | 81 | 93.7 Ų | 93.7 | 55% | 0.547 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -59.5 | -41.4 | 175.8 | -71.7 | 0 | 0 | 0 | 0 | 112 | D109 L110 R115 A116 V117 | D109-C113 PolarHBondContact O-N 3.3Å; D109-C113 PolarHBondContact O-SG 2.9Å; D109-C113 VanDerWaalsContact O-SG 3.4Å; L110-C113 PolarHBondContact O-N 2.99Å; C113-R115 VanDerWaalsContact C-N 3.33Å; C113-R115 PolarHBondContact O-N 3.04Å; C113-A116 PolarHBondContact O-N 3.3Å; C113-V117 WeakPolarHBondContact O-CG2 3.41Å; C113-V117 PolarHBondContact O-N 3.45Å |
| 114 | Q | 97.6 | Very high | 97.4 | Very high | 97 Ų | 97 | 93.8 Ų | 93.8 | 45% | 0.453 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -59.9 | -40.8 | 175.2 | -78.4 | 176 | -10.5 | 0 | 0 | 112.7 | L110 L112 K118 | L110-Q114 HydrophobicContact CD2-CG 4.34Å; L110-Q114 VanDerWaalsContact CD2-NE2 3.32Å; L110-Q114 WeakPolarHBondContact O-CB 3.39Å; L110-Q114 VanDerWaalsContact O-CG 3.27Å; L110-Q114 WeakPolarHBondContact O-CG 3.42Å; L110-Q114 PolarHBondContact O-N 3.31Å; L112-Q114 VanDerWaalsContact C-N 3.32Å; L112-Q114 PolarHBondContact O-N 3.35Å; Q114-K118 WeakPolarHBondContact O-CG 3.47Å; Q114-K118 PolarHBondContact O-N 3.27Å |
| 115 | R | 97 | Very high | 97.5 | Very high | 167 Ų | 167 | 98.8 Ų | 98.8 | 63% | 0.63 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -65.3 | -46.6 | 174.9 | -69 | 174.4 | -176.1 | 179.8 | 0.2 | 111.1 | K111 L112 C113 V117 K118 D119 | K111-R115 WeakPolarHBondContact O-CG 3.27Å; K111-R115 PolarHBondContact O-N 3.44Å; L112-R115 PolarHBondContact O-N 3.3Å; L112-R115 VanDerWaalsContact O-N 3.15Å; C113-R115 VanDerWaalsContact C-N 3.33Å; C113-R115 PolarHBondContact O-N 3.04Å; R115-V117 VanDerWaalsContact C-N 3.32Å; R115-V117 PolarHBondContact O-N 2.95Å; R115-K118 WeakPolarHBondContact O-CB 3.46Å; R115-K118 PolarHBondContact O-N 3.12Å; R115-K118 VanDerWaalsContact O-N 3.12Å; R115-D119 PolarHBondContact O-N 3.08Å |
| 116 | A | 97.1 | Very high | 97.4 | Very high | 54 Ų | 54 | 96.2 Ų | 96.2 | 45% | 0.446 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -58.5 | -42 | 178 | 0 | 0 | 0 | 0 | 0 | 112.2 | L112 C113 K118 D119 V120 | L112-A116 PolarHBondContact O-N 3.21Å; C113-A116 PolarHBondContact O-N 3.3Å; A116-K118 PolarHBondContact O-N 3.39Å; A116-D119 PolarHBondContact O-N 3.47Å; A116-V120 WeakPolarHBondContact O-CG2 3.42Å; A116-V120 PolarHBondContact O-N 3.4Å |
| 117 | V | 97.4 | Very high | 97.4 | Very high | 93 Ų | 93 | 94.9 Ų | 94.9 | 56% | 0.564 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -60.6 | -45.7 | 175.2 | 170.7 | 0 | 0 | 0 | 0 | 111.1 | C113 R115 D119 V120 S121 | C113-V117 WeakPolarHBondContact O-CG2 3.41Å; C113-V117 PolarHBondContact O-N 3.45Å; R115-V117 VanDerWaalsContact C-N 3.32Å; R115-V117 PolarHBondContact O-N 2.95Å; V117-D119 VanDerWaalsContact C-N 3.29Å; V117-D119 PolarHBondContact O-N 2.92Å; V117-V120 PolarHBondContact O-N 2.87Å; V117-S121 PolarHBondContact O-N 3.45Å; V117-S121 PolarHBondContact O-OG 3.4Å; V117-S121 VanDerWaalsContact O-OG 3.14Å |
| 118 | K | 97.4 | Very high | 97.4 | Very high | 145 Ų | 145 | 95.4 Ų | 95.4 | 63% | 0.63 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -59.6 | -40 | 176.4 | -72.1 | -178.3 | 179.5 | -171.2 | 0 | 112.1 | Q114 R115 A116 S121 K122 | Q114-K118 WeakPolarHBondContact O-CG 3.47Å; Q114-K118 PolarHBondContact O-N 3.27Å; R115-K118 WeakPolarHBondContact O-CB 3.46Å; R115-K118 PolarHBondContact O-N 3.12Å; R115-K118 VanDerWaalsContact O-N 3.12Å; A116-K118 PolarHBondContact O-N 3.39Å; K118-S121 PolarHBondContact O-N 3.12Å; K118-K122 WeakPolarHBondContact O-CG 3.28Å; K118-K122 PolarHBondContact O-N 2.86Å |
| 119 | D | 97 | Very high | 97.4 | Very high | 82 Ų | 82 | 99 Ų | 99 | 44% | 0.439 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -72.4 | -38.4 | 179.5 | -67.6 | -27.2 | 0 | 0 | 0 | 112.2 | R115 A116 V117 S121 K122 V123 | R115-D119 PolarHBondContact O-N 3.08Å; A116-D119 PolarHBondContact O-N 3.47Å; V117-D119 VanDerWaalsContact C-N 3.29Å; V117-D119 PolarHBondContact O-N 2.92Å; D119-S121 VanDerWaalsContact C-N 3.35Å; D119-S121 PolarHBondContact O-N 3.32Å; D119-K122 WeakPolarHBondContact O-CB 3.34Å; D119-K122 PolarHBondContact O-N 2.83Å; D119-K122 VanDerWaalsContact O-N 3.16Å; D119-K122 IonicContact OD1-NZ 3.46Å; D119-K122 PolarHBondContact OD1-NZ 3.43Å; D119-V123 WeakPolarHBondContact O-CG2 3.37Å; D119-V123 PolarHBondContact O-N 2.98Å |
| 120 | V | 97.5 | Very high | 97.3 | Very high | 78 Ų | 78 | 101.3 Ų | 101.3 | 47% | 0.473 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -58.4 | -46.5 | 170.9 | 170.4 | 0 | 0 | 0 | 0 | 110.6 | A116 V117 K122 V123 E124 | A116-V120 WeakPolarHBondContact O-CG2 3.42Å; A116-V120 PolarHBondContact O-N 3.4Å; V117-V120 PolarHBondContact O-N 2.87Å; V120-K122 VanDerWaalsContact C-N 3.26Å; V120-K122 PolarHBondContact O-N 3.25Å; V120-V123 PolarHBondContact O-N 3.48Å; V120-E124 HydrophobicContact CG1-CG 4.22Å; V120-E124 WeakPolarHBondContact O-CG 3.35Å; V120-E124 PolarHBondContact O-N 3.28Å |
| 121 | S | 97.3 | Very high | 97.3 | Very high | 49 Ų | 49 | 102.9 Ų | 102.9 | 34% | 0.343 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -62.4 | -29.8 | 177.4 | -58.4 | 0 | 0 | 0 | 0 | 113.5 | V117 K118 D119 R125 | V117-S121 PolarHBondContact O-N 3.45Å; V117-S121 PolarHBondContact O-OG 3.4Å; V117-S121 VanDerWaalsContact O-OG 3.14Å; K118-S121 PolarHBondContact O-N 3.12Å; D119-S121 VanDerWaalsContact C-N 3.35Å; D119-S121 PolarHBondContact O-N 3.32Å; S121-R125 WeakPolarHBondContact O-CG 3.22Å; S121-R125 PolarHBondContact O-N 2.85Å; S121-R125 PolarHBondContact O-NE 3.33Å |
| 122 | K | 97.5 | Very high | 97.3 | Very high | 114 Ų | 114 | 99.5 Ų | 99.5 | 50% | 0.496 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -69 | -44.6 | 171.3 | -68 | 170.1 | -167 | 159.9 | 0 | 111.3 | K118 D119 V120 E124 R125 A126 | K118-K122 WeakPolarHBondContact O-CG 3.28Å; K118-K122 PolarHBondContact O-N 2.86Å; D119-K122 WeakPolarHBondContact O-CB 3.34Å; D119-K122 PolarHBondContact O-N 2.83Å; D119-K122 VanDerWaalsContact O-N 3.16Å; D119-K122 IonicContact OD1-NZ 3.46Å; D119-K122 PolarHBondContact OD1-NZ 3.43Å; V120-K122 VanDerWaalsContact C-N 3.26Å; V120-K122 PolarHBondContact O-N 3.25Å; K122-E124 VanDerWaalsContact C-N 3.35Å; K122-R125 PolarHBondContact O-N 2.98Å; K122-A126 PolarHBondContact O-N 2.61Å |
| 123 | V | 96.7 | Very high | 97.3 | Very high | 97 Ų | 97 | 98 Ų | 98 | 59% | 0.588 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -64.2 | -39.8 | 178.4 | 173.4 | 0 | 0 | 0 | 0 | 111.3 | D119 V120 A126 N127 | D119-V123 WeakPolarHBondContact O-CG2 3.37Å; D119-V123 PolarHBondContact O-N 2.98Å; V120-V123 PolarHBondContact O-N 3.48Å; V123-A126 PolarHBondContact O-N 3.47Å; V123-N127 WeakPolarHBondContact O-CB 3.29Å; V123-N127 PolarHBondContact O-N 3.1Å |
| 124 | E | 97.7 | Very high | 97.2 | Very high | 119 Ų | 119 | 98.5 Ų | 98.5 | 56% | 0.556 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -61.5 | -44.1 | 176.3 | -74 | 176.6 | 157.3 | 0 | 0 | 112.1 | V120 K122 N127 A128 | V120-E124 HydrophobicContact CG1-CG 4.22Å; V120-E124 WeakPolarHBondContact O-CG 3.35Å; V120-E124 PolarHBondContact O-N 3.28Å; K122-E124 VanDerWaalsContact C-N 3.35Å; E124-N127 PolarHBondContact O-N 2.9Å; E124-A128 PolarHBondContact O-N 3.35Å |
| 125 | R | 97.5 | Very high | 97.2 | Very high | 175 Ų | 175 | 97.5 Ų | 97.5 | 66% | 0.66 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -60.9 | -44.6 | 173.6 | -74.7 | -175.2 | -72.4 | 170.4 | -4 | 112.2 | S121 K122 N127 A128 K129 | S121-R125 WeakPolarHBondContact O-CG 3.22Å; S121-R125 PolarHBondContact O-N 2.85Å; S121-R125 PolarHBondContact O-NE 3.33Å; K122-R125 PolarHBondContact O-N 2.98Å; R125-N127 VanDerWaalsContact C-N 3.33Å; R125-N127 PolarHBondContact O-N 3.04Å; R125-A128 PolarHBondContact O-N 3.41Å; R125-K129 PolarHBondContact O-N 3.04Å |
| 126 | A | 97.6 | Very high | 97.1 | Very high | 52 Ų | 52 | 95.4 Ų | 95.4 | 43% | 0.43 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -62.8 | -39.4 | 176 | 0 | 0 | 0 | 0 | 0 | 112.3 | K122 V123 K129 L130 | K122-A126 PolarHBondContact O-N 2.61Å; V123-A126 PolarHBondContact O-N 3.47Å; A126-K129 PolarHBondContact O-N 2.92Å; A126-L130 WeakPolarHBondContact O-CG 3.32Å; A126-L130 PolarHBondContact O-N 2.9Å |
| 127 | N | 96.2 | Very high | 96.9 | Very high | 78 Ų | 78 | 97.3 Ų | 97.3 | 42% | 0.417 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -66.4 | -39.7 | 176.5 | -167.1 | -3.8 | 0 | 0 | 0 | 111.7 | V123 E124 R125 K129 L130 K131 | V123-N127 WeakPolarHBondContact O-CB 3.29Å; V123-N127 PolarHBondContact O-N 3.1Å; E124-N127 PolarHBondContact O-N 2.9Å; R125-N127 VanDerWaalsContact C-N 3.33Å; R125-N127 PolarHBondContact O-N 3.04Å; N127-K129 VanDerWaalsContact C-N 3.35Å; N127-K129 PolarHBondContact O-N 2.97Å; N127-L130 PolarHBondContact O-N 3.12Å; N127-K131 WeakPolarHBondContact O-CB 3.44Å; N127-K131 VanDerWaalsContact O-CG 3.31Å; N127-K131 WeakPolarHBondContact O-CG 3.46Å; N127-K131 PolarHBondContact O-N 3.36Å; N127-K131 WeakPolarHBondContact OD1-CE 3.46Å |
| 128 | A | 97.7 | Very high | 96.8 | Very high | 61 Ų | 61 | 98.9 Ų | 98.9 | 50% | 0.504 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -60.1 | -44.5 | 173.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | E124 R125 K131 A132 | E124-A128 PolarHBondContact O-N 3.35Å; R125-A128 PolarHBondContact O-N 3.41Å; A128-K131 PolarHBondContact O-N 3.01Å; A128-A132 PolarHBondContact O-N 3.21Å; A128-A132 VanDerWaalsContact O-N 3.08Å |
| 129 | K | 97.8 | Very high | 96.6 | Very high | 142 Ų | 142 | 98.8 Ų | 98.8 | 62% | 0.617 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -60.6 | -50.2 | 174.6 | -174.4 | 177.9 | 178.6 | 180 | 0 | 112.1 | R125 A126 N127 K131 A132 D133 | R125-K129 PolarHBondContact O-N 3.04Å; A126-K129 PolarHBondContact O-N 2.92Å; N127-K129 VanDerWaalsContact C-N 3.35Å; N127-K129 PolarHBondContact O-N 2.97Å; K129-K131 VanDerWaalsContact C-N 3.27Å; K129-K131 PolarHBondContact O-N 3.15Å; K129-A132 WeakPolarHBondContact O-CB 3.33Å; K129-A132 PolarHBondContact O-N 3.4Å; K129-A132 VanDerWaalsContact O-N 3.07Å; K129-D133 PolarHBondContact O-N 3.25Å |
| 130 | L | 97 | Very high | 96.4 | Very high | 116 Ų | 116 | 98.5 Ų | 98.5 | 61% | 0.607 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -59.8 | -36.1 | 178.3 | -74.9 | 171.5 | 0 | 0 | 0 | 112.8 | A126 N127 L134 | A126-L130 WeakPolarHBondContact O-CG 3.32Å; A126-L130 PolarHBondContact O-N 2.9Å; N127-L130 PolarHBondContact O-N 3.12Å; L130-L134 VanDerWaalsContact O-CB 3.26Å; L130-L134 WeakPolarHBondContact O-CB 3.48Å; L130-L134 PolarHBondContact O-N 2.9Å |
| 131 | K | 97.6 | Very high | 96.1 | Very high | 130 Ų | 130 | 98.8 Ų | 98.8 | 57% | 0.565 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -65.1 | -44 | 174 | -76.1 | 173.8 | -178.5 | 175.9 | 0 | 111.6 | N127 A128 K129 L134 T135 | N127-K131 WeakPolarHBondContact O-CB 3.44Å; N127-K131 VanDerWaalsContact O-CG 3.31Å; N127-K131 WeakPolarHBondContact O-CG 3.46Å; N127-K131 PolarHBondContact O-N 3.36Å; N127-K131 WeakPolarHBondContact OD1-CE 3.46Å; A128-K131 PolarHBondContact O-N 3.01Å; K129-K131 VanDerWaalsContact C-N 3.27Å; K129-K131 PolarHBondContact O-N 3.15Å; K131-L134 PolarHBondContact O-N 3.19Å; K131-T135 WeakPolarHBondContact O-CG2 3.42Å; K131-T135 PolarHBondContact O-N 3.41Å |
| 132 | A | 97.4 | Very high | 95.8 | Very high | 56 Ų | 56 | 100.1 Ų | 100.1 | 46% | 0.463 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -60.1 | -48.6 | 175.9 | 0 | 0 | 0 | 0 | 0 | 110.9 | A128 K129 L134 T135 K136 | A128-A132 PolarHBondContact O-N 3.21Å; A128-A132 VanDerWaalsContact O-N 3.08Å; K129-A132 WeakPolarHBondContact O-CB 3.33Å; K129-A132 PolarHBondContact O-N 3.4Å; K129-A132 VanDerWaalsContact O-N 3.07Å; A132-L134 VanDerWaalsContact C-N 3.31Å; A132-L134 PolarHBondContact O-N 3.26Å; A132-T135 PolarHBondContact O-N 3.33Å; A132-T135 VanDerWaalsContact O-N 3.08Å; A132-T135 PolarHBondContact O-OG1 3.28Å; A132-K136 PolarHBondContact O-N 2.89Å; A132-K136 VanDerWaalsContact O-N 3.08Å |
| 133 | D | 97 | Very high | 95.4 | Very high | 71 Ų | 71 | 98.9 Ų | 98.9 | 38% | 0.38 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -59.2 | -41.9 | 177.1 | -67 | -24.2 | 0 | 0 | 0 | 111.5 | K129 T135 K136 M137 | K129-D133 PolarHBondContact O-N 3.25Å; D133-T135 VanDerWaalsContact C-N 3.32Å; D133-T135 PolarHBondContact O-N 3.24Å; D133-K136 WeakPolarHBondContact O-CB 3.49Å; D133-K136 PolarHBondContact O-N 3.5Å; D133-K136 VanDerWaalsContact O-N 3.09Å; D133-M137 WeakPolarHBondContact O-CG 3.46Å; D133-M137 PolarHBondContact O-N 3.38Å |
| 134 | L | 95.9 | Very high | 95 | Very high | 93 Ų | 93 | 99.2 Ų | 99.2 | 49% | 0.487 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -63.7 | -34.3 | 176.6 | -175.7 | 139.7 | 0 | 0 | 0 | 112.9 | L130 K131 A132 K138 | L130-L134 VanDerWaalsContact O-CB 3.26Å; L130-L134 WeakPolarHBondContact O-CB 3.48Å; L130-L134 PolarHBondContact O-N 2.9Å; K131-L134 PolarHBondContact O-N 3.19Å; A132-L134 VanDerWaalsContact C-N 3.31Å; A132-L134 PolarHBondContact O-N 3.26Å; L134-K138 HydrophobicContact CD2-CD 3.9Å; L134-K138 VanDerWaalsContact CD2-CE 3.41Å; L134-K138 WeakPolarHBondContact O-CB 3.45Å; L134-K138 VanDerWaalsContact O-CG 3.25Å; L134-K138 WeakPolarHBondContact O-CG 3.38Å; L134-K138 PolarHBondContact O-N 3.16Å; L134-K138 VanDerWaalsContact O-N 3.09Å |
| 135 | T | 96.1 | Very high | 94.6 | Very high | 76 Ų | 76 | 98.8 Ų | 98.8 | 47% | 0.466 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -69.2 | -35.4 | 172.4 | 66.8 | 0 | 0 | 0 | 0 | 112.4 | K131 A132 D133 K139 | K131-T135 WeakPolarHBondContact O-CG2 3.42Å; K131-T135 PolarHBondContact O-N 3.41Å; A132-T135 PolarHBondContact O-N 3.33Å; A132-T135 VanDerWaalsContact O-N 3.08Å; A132-T135 PolarHBondContact O-OG1 3.28Å; D133-T135 VanDerWaalsContact C-N 3.32Å; D133-T135 PolarHBondContact O-N 3.24Å; T135-K139 WeakPolarHBondContact O-CG 3.4Å; T135-K139 PolarHBondContact O-N 3.31Å |
| 136 | K | 96 | Very high | 93.9 | Very high | 123 Ų | 123 | 97.7 Ų | 97.7 | 54% | 0.535 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -65.5 | -51.7 | 175.1 | -175.7 | -173.1 | 173.1 | -164.1 | 0 | 111 | A132 D133 K138 K139 E140 | A132-K136 PolarHBondContact O-N 2.89Å; A132-K136 VanDerWaalsContact O-N 3.08Å; D133-K136 WeakPolarHBondContact O-CB 3.49Å; D133-K136 PolarHBondContact O-N 3.5Å; D133-K136 VanDerWaalsContact O-N 3.09Å; K136-K138 VanDerWaalsContact C-N 3.26Å; K136-K138 PolarHBondContact O-N 2.92Å; K136-K139 WeakPolarHBondContact O-CB 3.48Å; K136-K139 PolarHBondContact O-N 2.67Å; K136-E140 WeakPolarHBondContact CE-OE1 3.42Å; K136-E140 PolarHBondContact O-N 3.45Å |
| 137 | M | 92.7 | Very high | 93 | Very high | 93 Ų | 93 | 99.8 Ų | 99.8 | 46% | 0.458 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -60.9 | -34 | 178.5 | -64 | -55.7 | -87.1 | 0 | 0 | 112.3 | D133 E140 N141 | D133-M137 WeakPolarHBondContact O-CG 3.46Å; D133-M137 PolarHBondContact O-N 3.38Å; M137-E140 PolarHBondContact O-N 3.18Å; M137-N141 VanDerWaalsContact O-CB 3.28Å; M137-N141 WeakPolarHBondContact O-CB 3.45Å; M137-N141 PolarHBondContact O-N 3.44Å |
| 138 | K | 95.9 | Very high | 92.3 | Very high | 126 Ų | 126 | 99.9 Ų | 99.9 | 55% | 0.548 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -63.4 | -44.4 | 173.2 | -80.8 | 175.3 | 176 | 177.2 | 0 | 112.4 | L134 K136 N141 D142 | L134-K138 HydrophobicContact CD2-CD 3.9Å; L134-K138 VanDerWaalsContact CD2-CE 3.41Å; L134-K138 WeakPolarHBondContact O-CB 3.45Å; L134-K138 VanDerWaalsContact O-CG 3.25Å; L134-K138 WeakPolarHBondContact O-CG 3.38Å; L134-K138 PolarHBondContact O-N 3.16Å; L134-K138 VanDerWaalsContact O-N 3.09Å; K136-K138 VanDerWaalsContact C-N 3.26Å; K136-K138 PolarHBondContact O-N 2.92Å; K138-N141 PolarHBondContact O-N 3.03Å; K138-D142 VanDerWaalsContact O-CG 3.28Å; K138-D142 PolarHBondContact O-N 3.2Å |
| 139 | K | 93.2 | Very high | 91.5 | Very high | 143 Ų | 143 | 102.8 Ų | 102.8 | 62% | 0.622 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -62.4 | -43.3 | 176.5 | -69.7 | 173.8 | -179 | 178.6 | 0 | 111.3 | T135 K136 D142 I143 | T135-K139 WeakPolarHBondContact O-CG 3.4Å; T135-K139 PolarHBondContact O-N 3.31Å; K136-K139 WeakPolarHBondContact O-CB 3.48Å; K136-K139 PolarHBondContact O-N 2.67Å; K139-D142 PolarHBondContact O-N 2.85Å; K139-I143 WeakPolarHBondContact O-CG1 3.38Å; K139-I143 PolarHBondContact O-N 2.89Å |
| 140 | E | 92 | Very high | 90.4 | Very high | 77 Ų | 77 | 100.4 Ų | 100.4 | 36% | 0.36 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -63.4 | -43.4 | 176.8 | -70.6 | 173.6 | -176.6 | 0 | 0 | 111.8 | K136 M137 D142 I143 L144 | K136-E140 WeakPolarHBondContact CE-OE1 3.42Å; K136-E140 PolarHBondContact O-N 3.45Å; M137-E140 PolarHBondContact O-N 3.18Å; E140-D142 VanDerWaalsContact C-N 3.34Å; E140-D142 PolarHBondContact O-N 3.4Å; E140-I143 WeakPolarHBondContact O-CB 3.39Å; E140-I143 PolarHBondContact O-N 3.47Å; E140-I143 VanDerWaalsContact O-N 3.13Å; E140-L144 WeakPolarHBondContact O-CG 3.41Å; E140-L144 PolarHBondContact O-N 3.26Å |
| 141 | N | 90.5 | Very high | 89.2 | Confident | 83 Ų | 83 | 101.4 Ų | 101.4 | 44% | 0.444 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -62.5 | -39.6 | 174.9 | -166.2 | -15.4 | 0 | 0 | 0 | 111.9 | M137 K138 I143 L144 K145 | M137-N141 VanDerWaalsContact O-CB 3.28Å; M137-N141 WeakPolarHBondContact O-CB 3.45Å; M137-N141 PolarHBondContact O-N 3.44Å; K138-N141 PolarHBondContact O-N 3.03Å; N141-I143 VanDerWaalsContact C-N 3.28Å; N141-I143 PolarHBondContact O-N 3.49Å; N141-L144 PolarHBondContact O-N 3.06Å; N141-K145 WeakPolarHBondContact O-CG 3.39Å; N141-K145 PolarHBondContact O-N 3.16Å; N141-K145 VanDerWaalsContact OD1-CE 3.31Å; N141-K145 WeakPolarHBondContact OD1-CE 3.44Å |
| 142 | D | 91.2 | Very high | 88.1 | Confident | 78 Ų | 78 | 102.9 Ų | 102.9 | 42% | 0.417 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -67.5 | -26.5 | 175.1 | -70 | -18.8 | 0 | 0 | 0 | 113 | K138 K139 E140 K145 R146 | K138-D142 VanDerWaalsContact O-CG 3.28Å; K138-D142 PolarHBondContact O-N 3.2Å; K139-D142 PolarHBondContact O-N 2.85Å; E140-D142 VanDerWaalsContact C-N 3.34Å; E140-D142 PolarHBondContact O-N 3.4Å; D142-K145 IonicContact OD1-NZ 2.67Å; D142-R146 WeakPolarHBondContact O-CG 3.37Å; D142-R146 PolarHBondContact O-N 3.36Å; D142-R146 PolarHBondContact O-NE 2.96Å |
| 143 | I | 89.7 | Confident | 86.6 | Confident | 88 Ų | 88 | 103.4 Ų | 103.4 | 45% | 0.451 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -74.1 | -47.3 | 170.7 | -67.1 | 164.2 | 0 | 0 | 0 | 110 | K139 E140 N141 K145 R146 L147 | K139-I143 WeakPolarHBondContact O-CG1 3.38Å; K139-I143 PolarHBondContact O-N 2.89Å; E140-I143 WeakPolarHBondContact O-CB 3.39Å; E140-I143 PolarHBondContact O-N 3.47Å; E140-I143 VanDerWaalsContact O-N 3.13Å; N141-I143 VanDerWaalsContact C-N 3.28Å; N141-I143 PolarHBondContact O-N 3.49Å; I143-K145 VanDerWaalsContact C-N 3.34Å; I143-K145 PolarHBondContact O-N 3.03Å; I143-R146 WeakPolarHBondContact O-CB 3.37Å; I143-R146 PolarHBondContact O-N 2.97Å; I143-R146 VanDerWaalsContact O-N 3.14Å; I143-L147 HydrophobicContact CG2-CD1 4.19Å; I143-L147 HydrophobicContact CG2-CG 4.49Å; I143-L147 PolarHBondContact O-N 3.18Å |
| 144 | L | 88.6 | Confident | 85.1 | Confident | 103 Ų | 103 | 105.7 Ų | 105.7 | 54% | 0.539 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -60.2 | -41.7 | 179.1 | -72 | 172.6 | 0 | 0 | 0 | 112 | E140 N141 R146 L147 V148 | E140-L144 WeakPolarHBondContact O-CG 3.41Å; E140-L144 PolarHBondContact O-N 3.26Å; N141-L144 PolarHBondContact O-N 3.06Å; L144-R146 VanDerWaalsContact C-N 3.33Å; L144-R146 PolarHBondContact O-N 2.85Å; L144-L147 HydrophobicContact CD2-CD1 4.49Å; L144-L147 PolarHBondContact O-N 3.31Å; L144-V148 WeakPolarHBondContact O-CG2 3.41Å; L144-V148 PolarHBondContact O-N 3.38Å |
| 145 | K | 88.5 | Confident | 83.6 | Confident | 110 Ų | 110 | 103.4 Ų | 103.4 | 48% | 0.478 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -58 | -44.8 | 173.7 | -75.5 | 173.3 | -173.6 | 164.3 | 0 | 112.2 | N141 D142 I143 L147 V148 E149 | N141-K145 WeakPolarHBondContact O-CG 3.39Å; N141-K145 PolarHBondContact O-N 3.16Å; N141-K145 VanDerWaalsContact OD1-CE 3.31Å; N141-K145 WeakPolarHBondContact OD1-CE 3.44Å; D142-K145 IonicContact OD1-NZ 2.67Å; I143-K145 VanDerWaalsContact C-N 3.34Å; I143-K145 PolarHBondContact O-N 3.03Å; K145-L147 VanDerWaalsContact C-N 3.34Å; K145-L147 PolarHBondContact O-N 3.14Å; K145-V148 PolarHBondContact O-N 3.08Å; K145-E149 WeakPolarHBondContact O-CG 3.41Å; K145-E149 PolarHBondContact O-N 3Å |
| 146 | R | 83.5 | Confident | 82.1 | Confident | 153 Ų | 153 | 104.1 Ų | 104.1 | 58% | 0.577 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -63 | -38.7 | 176.3 | -78 | -178.1 | -94.8 | 176.8 | -11.5 | 112.2 | D142 I143 L144 E149 L150 | D142-R146 WeakPolarHBondContact O-CG 3.37Å; D142-R146 PolarHBondContact O-N 3.36Å; D142-R146 PolarHBondContact O-NE 2.96Å; I143-R146 WeakPolarHBondContact O-CB 3.37Å; I143-R146 PolarHBondContact O-N 2.97Å; I143-R146 VanDerWaalsContact O-N 3.14Å; L144-R146 VanDerWaalsContact C-N 3.33Å; L144-R146 PolarHBondContact O-N 2.85Å; R146-E149 PolarHBondContact O-N 3.44Å; R146-L150 WeakPolarHBondContact O-CG 3.26Å; R146-L150 PolarHBondContact O-N 3.05Å |
| 147 | L | 79.3 | Confident | 80.6 | Confident | 96 Ų | 96 | 104.6 Ų | 104.6 | 50% | 0.503 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -66.1 | -41.2 | 175.3 | -69.6 | 173.3 | 0 | 0 | 0 | 112.2 | I143 L144 K145 E149 L150 D151 | I143-L147 HydrophobicContact CG2-CD1 4.19Å; I143-L147 HydrophobicContact CG2-CG 4.49Å; I143-L147 PolarHBondContact O-N 3.18Å; L144-L147 HydrophobicContact CD2-CD1 4.49Å; L144-L147 PolarHBondContact O-N 3.31Å; K145-L147 VanDerWaalsContact C-N 3.34Å; K145-L147 PolarHBondContact O-N 3.14Å; L147-E149 VanDerWaalsContact C-N 3.31Å; L147-E149 PolarHBondContact O-N 3.2Å; L147-L150 HydrophobicContact CD2-CD1 4.48Å; L147-L150 PolarHBondContact O-N 3.44Å; L147-D151 PolarHBondContact O-N 3.37Å |
| 148 | V | 81.3 | Confident | 79.4 | Confident | 79 Ų | 79 | 104.1 Ų | 104.1 | 48% | 0.479 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -66.1 | -34.6 | 175 | 171.7 | 0 | 0 | 0 | 0 | 111.6 | L144 K145 D151 K152 | L144-V148 WeakPolarHBondContact O-CG2 3.41Å; L144-V148 PolarHBondContact O-N 3.38Å; K145-V148 PolarHBondContact O-N 3.08Å; V148-D151 PolarHBondContact O-N 3.43Å; V148-K152 WeakPolarHBondContact O-CG 3.34Å; V148-K152 PolarHBondContact O-N 2.84Å |
| 149 | E | 81.1 | Confident | 77.9 | Confident | 122 Ų | 122 | 102.8 Ų | 102.8 | 57% | 0.57 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -66.2 | -38.8 | 172.9 | -75.6 | 172.3 | -180 | 0 | 0 | 112 | K145 R146 L147 K152 T153 | K145-E149 WeakPolarHBondContact O-CG 3.41Å; K145-E149 PolarHBondContact O-N 3Å; R146-E149 PolarHBondContact O-N 3.44Å; L147-E149 VanDerWaalsContact C-N 3.31Å; L147-E149 PolarHBondContact O-N 3.2Å; E149-K152 PolarHBondContact O-N 3.31Å; E149-T153 PolarHBondContact O-N 3.17Å |
| 150 | L | 73 | Confident | 76.7 | Confident | 93 Ų | 93 | 99.1 Ų | 99.1 | 49% | 0.487 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -64.9 | -38.3 | 174.5 | -75.1 | 168.2 | 0 | 0 | 0 | 112.7 | R146 L147 K152 T153 | R146-L150 WeakPolarHBondContact O-CG 3.26Å; R146-L150 PolarHBondContact O-N 3.05Å; L147-L150 HydrophobicContact CD2-CD1 4.48Å; L147-L150 PolarHBondContact O-N 3.44Å; L150-K152 VanDerWaalsContact C-N 3.26Å; L150-K152 PolarHBondContact O-N 3.46Å; L150-T153 PolarHBondContact O-N 3.42Å; L150-T153 VanDerWaalsContact O-N 3.14Å; L150-T153 PolarHBondContact O-OG1 2.9Å |
| 151 | D | 73.2 | Confident | 75.6 | Confident | 136 Ų | 136 | 100 Ų | 100 | 73% | 0.727 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -63.8 | -30.8 | 176.8 | -170.4 | 62.5 | 0 | 0 | 0 | 112.6 | L147 V148 T153 | L147-D151 PolarHBondContact O-N 3.37Å; V148-D151 PolarHBondContact O-N 3.43Å; D151-T153 VanDerWaalsContact C-N 3.31Å |
| 152 | K | 73.6 | Confident | 74.6 | Confident | 162 Ų | 162 | 99 Ų | 99 | 70% | 0.704 | 54% | 0.539 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77.1 | -17.2 | 175.7 | -69.7 | 174.4 | -176.7 | 176.7 | 0 | 113.8 | V148 E149 L150 | V148-K152 WeakPolarHBondContact O-CG 3.34Å; V148-K152 PolarHBondContact O-N 2.84Å; E149-K152 PolarHBondContact O-N 3.31Å; L150-K152 VanDerWaalsContact C-N 3.26Å; L150-K152 PolarHBondContact O-N 3.46Å |
| 153 | T | 67.1 | Low | 73.7 | Confident | 66 Ų | 66 | 97.7 Ų | 97.7 | 41% | 0.405 | 53% | 0.532 | S | S | . | . | S | Bend | trans | -94.9 | 133.1 | 177.2 | 57 | 0 | 0 | 0 | 0 | 109 | E149 L150 D151 A155 | E149-T153 PolarHBondContact O-N 3.17Å; L150-T153 PolarHBondContact O-N 3.42Å; L150-T153 VanDerWaalsContact O-N 3.14Å; L150-T153 PolarHBondContact O-OG1 2.9Å; D151-T153 VanDerWaalsContact C-N 3.31Å; T153-A155 PolarHBondContact O-N 3.06Å; T153-A155 WeakPolarHBondContact OG1-CB 3.42Å |
| 154 | D | 64.9 | Low | 73 | Confident | 120 Ų | 120 | 102.5 Ų | 102.5 | 64% | 0.642 | 55% | 0.553 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.7 | 12.7 | 170 | -54 | -30.5 | 0 | 0 | 0 | 112.8 | L156 E157 S158 | D154-L156 PolarHBondContact O-N 3.37Å; D154-E157 HydrophobicContact CB-CB 4.31Å; D154-E157 WeakPolarHBondContact O-CB 3.31Å; D154-E157 PolarHBondContact O-N 2.92Å; D154-S158 PolarHBondContact O-N 3.29Å |
| 155 | A | 63.6 | Low | 72.6 | Confident | 45 Ų | 45 | 102.1 Ų | 102.1 | 37% | 0.372 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -55.8 | -36.2 | 173.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | T153 S158 C159 | T153-A155 PolarHBondContact O-N 3.06Å; T153-A155 WeakPolarHBondContact OG1-CB 3.42Å; A155-S158 PolarHBondContact O-N 2.93Å; A155-C159 PolarHBondContact O-N 3.3Å; A155-C159 PolarHBondContact O-SG 2.87Å |
| 156 | L | 64.9 | Low | 72.3 | Confident | 91 Ų | 91 | 103.5 Ų | 103.5 | 48% | 0.476 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -67.6 | -40.8 | 175.5 | -141.1 | 103.5 | 0 | 0 | 0 | 111.5 | D154 C159 I160 M176 | D154-L156 PolarHBondContact O-N 3.37Å; L156-C159 PolarHBondContact O-N 3.38Å; L156-I160 HydrophobicContact CD2-CD1 4Å; L156-I160 VanDerWaalsContact O-CG1 3.26Å; L156-I160 WeakPolarHBondContact O-CG1 3.43Å; L156-I160 PolarHBondContact O-N 3.33Å; L156-M176 HydrophobicContact CD2-CE 3.79Å |
| 157 | E | 65 | Low | 72.2 | Confident | 132 Ų | 132 | 99.2 Ų | 99.2 | 62% | 0.617 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -65.5 | -40.5 | 177.3 | -164.7 | 168.5 | -166.2 | 0 | 0 | 110.9 | D154 C159 I160 S161 | D154-E157 HydrophobicContact CB-CB 4.31Å; D154-E157 WeakPolarHBondContact O-CB 3.31Å; D154-E157 PolarHBondContact O-N 2.92Å; E157-C159 PolarHBondContact O-N 3.28Å; E157-I160 PolarHBondContact O-N 2.95Å; E157-S161 WeakPolarHBondContact O-CB 3.48Å; E157-S161 PolarHBondContact O-N 3.27Å; E157-S161 PolarHBondContact O-OG 2.91Å |
| 158 | S | 67.8 | Low | 72.3 | Confident | 83 Ų | 83 | 96.4 Ų | 96.4 | 58% | 0.58 | 55% | 0.55 | S | S | * | * | H | α-helix | trans | -60.9 | -44.3 | 172.3 | -178 | 0 | 0 | 0 | 0 | 112.2 | D154 A155 I160 S161 | D154-S158 PolarHBondContact O-N 3.29Å; A155-S158 PolarHBondContact O-N 2.93Å; S158-I160 VanDerWaalsContact C-N 3.31Å; S158-I160 PolarHBondContact O-N 3.44Å; S158-S161 PolarHBondContact O-N 2.84Å; S158-S161 PolarHBondContact O-OG 2.88Å |
| 159 | C | 64.6 | Low | 72.2 | Confident | 98 Ų | 98 | 95.6 Ų | 95.6 | 66% | 0.662 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -65.6 | -32.3 | 177 | -72.3 | 0 | 0 | 0 | 0 | 113.4 | A155 L156 E157 | A155-C159 PolarHBondContact O-N 3.3Å; A155-C159 PolarHBondContact O-SG 2.87Å; L156-C159 PolarHBondContact O-N 3.38Å; E157-C159 PolarHBondContact O-N 3.28Å |
| 160 | I | 68 | Low | 72.2 | Confident | 67 Ų | 67 | 97.1 Ų | 97.1 | 34% | 0.344 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -78.7 | -35.3 | 179 | -68.5 | 167 | 0 | 0 | 0 | 111 | L156 E157 S158 G162 I163 L169 | L156-I160 HydrophobicContact CD2-CD1 4Å; L156-I160 VanDerWaalsContact O-CG1 3.26Å; L156-I160 WeakPolarHBondContact O-CG1 3.43Å; L156-I160 PolarHBondContact O-N 3.33Å; E157-I160 PolarHBondContact O-N 2.95Å; S158-I160 VanDerWaalsContact C-N 3.31Å; S158-I160 PolarHBondContact O-N 3.44Å; I160-G162 PolarHBondContact O-N 3.48Å; I160-G162 VanDerWaalsContact O-N 3.14Å; I160-I163 PolarHBondContact O-N 3.39Å; I160-I163 VanDerWaalsContact O-N 3.07Å; I160-L169 HydrophobicContact CG2-CD1 3.6Å |
| 161 | S | 68.3 | Low | 72.7 | Confident | 94 Ų | 94 | 99.5 Ų | 99.5 | 66% | 0.657 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -62.5 | -20.8 | -176.7 | 66.1 | 0 | 0 | 0 | 0 | 114.9 | E157 S158 | E157-S161 WeakPolarHBondContact O-CB 3.48Å; E157-S161 PolarHBondContact O-N 3.27Å; E157-S161 PolarHBondContact O-OG 2.91Å; S158-S161 PolarHBondContact O-N 2.84Å; S158-S161 PolarHBondContact O-OG 2.88Å |
| 162 | G | 69.8 | Low | 73.1 | Confident | 62 Ų | 62 | 95.4 Ų | 95.4 | 64% | 0.639 | 54% | 0.536 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -87.2 | -0.8 | 176.2 | 0 | 0 | 0 | 0 | 0 | 115.2 | I160 E164 | I160-G162 PolarHBondContact O-N 3.48Å; I160-G162 VanDerWaalsContact O-N 3.14Å; G162-E164 PolarHBondContact O-N 2.94Å |
| 163 | I | 72.4 | Confident | 73.6 | Confident | 51 Ų | 51 | 90.7 Ų | 90.7 | 26% | 0.262 | 52% | 0.52 | S | S | . | . | trans | -89.7 | 96.4 | -179.5 | -54.7 | 175.8 | 0 | 0 | 0 | 109 | I160 D165 A168 L169 | I160-I163 PolarHBondContact O-N 3.39Å; I160-I163 VanDerWaalsContact O-N 3.07Å; I163-D165 WeakPolarHBondContact CG2-O 3.44Å; I163-A168 HydrophobicContact CG2-CB 3.73Å; I163-L169 HydrophobicContact CD1-CD1 4.41Å; I163-L169 HydrophobicContact CG2-CB 3.99Å | ||
| 164 | E | 74.1 | Confident | 74.6 | Confident | 189 Ų | 189 | 92 Ų | 92 | 88% | 0.883 | 52% | 0.522 | S | S | * | . | trans | -79 | -24.4 | 177.4 | -63.5 | -179.3 | 178.1 | 0 | 0 | 112.8 | G162 I166 | G162-E164 PolarHBondContact O-N 2.94Å; E164-I166 PolarHBondContact O-N 3.34Å | ||
| 165 | D | 80.8 | Confident | 75.6 | Confident | 95 Ų | 95 | 88.9 Ų | 88.9 | 51% | 0.508 | 51% | 0.507 | S | S | . | . | trans | -82.2 | 111.8 | 179 | 179.9 | 12.8 | 0 | 0 | 0 | 111.4 | I163 A167 A168 L169 | I163-D165 WeakPolarHBondContact CG2-O 3.44Å; D165-A167 PolarHBondContact O-N 3.31Å; D165-A167 VanDerWaalsContact OD1-CB 3.32Å; D165-A167 WeakPolarHBondContact OD1-CB 3.49Å; D165-A167 PolarHBondContact OD1-N 3.07Å; D165-A168 HydrophobicContact CB-CB 3.96Å; D165-A168 WeakPolarHBondContact O-CB 3.34Å; D165-A168 PolarHBondContact O-N 3.46Å; D165-A168 PolarHBondContact OD2-N 2.92Å; D165-L169 PolarHBondContact O-N 3.35Å | ||
| 166 | I | 81.1 | Confident | 76.7 | Confident | 140 Ų | 140 | 91.5 Ų | 91.5 | 72% | 0.718 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -55.1 | -34.1 | 175.8 | -62.1 | 173.5 | 0 | 0 | 0 | 111.2 | E164 K170 | E164-I166 PolarHBondContact O-N 3.34Å; I166-K170 VanDerWaalsContact O-CB 3.29Å; I166-K170 WeakPolarHBondContact O-CB 3.4Å; I166-K170 PolarHBondContact O-N 3.07Å |
| 167 | A | 82.5 | Confident | 77.8 | Confident | 62 Ų | 62 | 93.1 Ų | 93.1 | 51% | 0.512 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -68.1 | -43.6 | 177.8 | 0 | 0 | 0 | 0 | 0 | 111.5 | D165 K170 F171 | D165-A167 PolarHBondContact O-N 3.31Å; D165-A167 VanDerWaalsContact OD1-CB 3.32Å; D165-A167 WeakPolarHBondContact OD1-CB 3.49Å; D165-A167 PolarHBondContact OD1-N 3.07Å; A167-K170 PolarHBondContact O-N 3.08Å; A167-F171 WeakPolarHBondContact O-CB 3.38Å; A167-F171 PolarHBondContact O-N 2.93Å |
| 168 | A | 80.6 | Confident | 78.9 | Confident | 38 Ų | 38 | 94 Ų | 94 | 31% | 0.314 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -62.8 | -44.4 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | I163 D165 K170 F171 C172 | I163-A168 HydrophobicContact CG2-CB 3.73Å; D165-A168 HydrophobicContact CB-CB 3.96Å; D165-A168 WeakPolarHBondContact O-CB 3.34Å; D165-A168 PolarHBondContact O-N 3.46Å; D165-A168 PolarHBondContact OD2-N 2.92Å; A168-K170 PolarHBondContact O-N 3.29Å; A168-F171 PolarHBondContact O-N 3.39Å; A168-C172 PolarHBondContact O-N 3.05Å; A168-C172 PolarHBondContact O-SG 3.38Å; A168-C172 VanDerWaalsContact O-SG 3.33Å |
| 169 | L | 79.4 | Confident | 79.9 | Confident | 61 Ų | 61 | 95.5 Ų | 95.5 | 32% | 0.319 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -61.6 | -45.4 | 177.3 | -175.8 | 65 | 0 | 0 | 0 | 111.5 | I160 I163 D165 F171 C172 V173 | I160-L169 HydrophobicContact CG2-CD1 3.6Å; I163-L169 HydrophobicContact CD1-CD1 4.41Å; I163-L169 HydrophobicContact CG2-CB 3.99Å; D165-L169 PolarHBondContact O-N 3.35Å; L169-F171 VanDerWaalsContact C-N 3.32Å; L169-F171 PolarHBondContact O-N 2.94Å; L169-C172 PolarHBondContact O-N 3.33Å; L169-V173 WeakPolarHBondContact O-CG2 3.35Å; L169-V173 PolarHBondContact O-N 2.9Å |
| 170 | K | 82.5 | Confident | 81.1 | Confident | 154 Ų | 154 | 96.6 Ų | 96.6 | 67% | 0.67 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -61.1 | -41.1 | 176.9 | -171.5 | 178.8 | -179.4 | -179.9 | 0 | 111.6 | I166 A167 A168 E174 | I166-K170 VanDerWaalsContact O-CB 3.29Å; I166-K170 WeakPolarHBondContact O-CB 3.4Å; I166-K170 PolarHBondContact O-N 3.07Å; A167-K170 PolarHBondContact O-N 3.08Å; A168-K170 PolarHBondContact O-N 3.29Å; K170-E174 WeakPolarHBondContact O-CB 3.38Å; K170-E174 PolarHBondContact O-N 3.36Å |
| 171 | F | 83.3 | Confident | 82.2 | Confident | 144 Ų | 144 | 101.2 Ų | 101.2 | 63% | 0.632 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -62.9 | -47 | 175.2 | -179.1 | -97.9 | 0 | 0 | 0 | 111.9 | A167 A168 L169 V173 E174 V175 | A167-F171 WeakPolarHBondContact O-CB 3.38Å; A167-F171 PolarHBondContact O-N 2.93Å; A168-F171 PolarHBondContact O-N 3.39Å; L169-F171 VanDerWaalsContact C-N 3.32Å; L169-F171 PolarHBondContact O-N 2.94Å; F171-V173 PolarHBondContact O-N 3.49Å; F171-E174 PolarHBondContact O-N 3.45Å; F171-V175 HydrophobicContact CD1-CG2 4.2Å; F171-V175 HydrophobicContact CE1-CG2 3.81Å; F171-V175 HydrophobicContact CE2-CG2 4.31Å; F171-V175 HydrophobicContact CZ-CG2 3.88Å; F171-V175 WeakPolarHBondContact O-CG2 3.31Å; F171-V175 PolarHBondContact O-N 3.35Å |
| 172 | C | 81.7 | Confident | 83.2 | Confident | 50 Ų | 50 | 100.9 Ų | 100.9 | 34% | 0.338 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -57.8 | -47.2 | 176.5 | -71.9 | 0 | 0 | 0 | 0 | 112 | A168 L169 E174 V175 M176 | A168-C172 PolarHBondContact O-N 3.05Å; A168-C172 PolarHBondContact O-SG 3.38Å; A168-C172 VanDerWaalsContact O-SG 3.33Å; L169-C172 PolarHBondContact O-N 3.33Å; C172-E174 VanDerWaalsContact C-N 3.32Å; C172-E174 PolarHBondContact O-N 3.03Å; C172-V175 PolarHBondContact O-N 2.91Å; C172-M176 WeakPolarHBondContact O-CB 3.25Å; C172-M176 WeakPolarHBondContact O-CG 3.43Å; C172-M176 PolarHBondContact O-N 3.44Å |
| 173 | V | 84 | Confident | 84.2 | Confident | 62 Ų | 62 | 103.3 Ų | 103.3 | 38% | 0.376 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -61.3 | -40.4 | 177.2 | 171.5 | 0 | 0 | 0 | 0 | 111.4 | L169 F171 M176 K177 | L169-V173 WeakPolarHBondContact O-CG2 3.35Å; L169-V173 PolarHBondContact O-N 2.9Å; F171-V173 PolarHBondContact O-N 3.49Å; V173-M176 PolarHBondContact O-N 2.87Å; V173-K177 HydrophobicContact CG1-CD 4.15Å; V173-K177 HydrophobicContact CG1-CG 4.38Å; V173-K177 WeakPolarHBondContact O-CB 3.44Å; V173-K177 VanDerWaalsContact O-CG 3.31Å; V173-K177 WeakPolarHBondContact O-CG 3.37Å; V173-K177 PolarHBondContact O-N 3.08Å |
| 174 | E | 86.5 | Confident | 84.9 | Confident | 94 Ų | 94 | 106 Ų | 106 | 44% | 0.439 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -67.3 | -40.4 | 179.2 | -160.5 | 60.7 | -144.8 | 0 | 0 | 112.1 | K170 F171 C172 K177 R178 | K170-E174 WeakPolarHBondContact O-CB 3.38Å; K170-E174 PolarHBondContact O-N 3.36Å; F171-E174 PolarHBondContact O-N 3.45Å; C172-E174 VanDerWaalsContact C-N 3.32Å; C172-E174 PolarHBondContact O-N 3.03Å; E174-K177 PolarHBondContact O-N 2.67Å; E174-R178 PolarHBondContact O-N 3.31Å |
| 175 | V | 87.1 | Confident | 85.8 | Confident | 55 Ų | 55 | 99.9 Ų | 99.9 | 33% | 0.333 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -63 | -45.8 | 173.3 | 172.9 | 0 | 0 | 0 | 0 | 110.7 | F171 C172 R178 K179 | F171-V175 HydrophobicContact CD1-CG2 4.2Å; F171-V175 HydrophobicContact CE1-CG2 3.81Å; F171-V175 HydrophobicContact CE2-CG2 4.31Å; F171-V175 HydrophobicContact CZ-CG2 3.88Å; F171-V175 WeakPolarHBondContact O-CG2 3.31Å; F171-V175 PolarHBondContact O-N 3.35Å; C172-V175 PolarHBondContact O-N 2.91Å; V175-R178 PolarHBondContact O-N 3.05Å; V175-K179 WeakPolarHBondContact O-CG 3.28Å; V175-K179 PolarHBondContact O-N 3.26Å |
| 176 | M | 87 | Confident | 86.2 | Confident | 99 Ų | 99 | 98.6 Ų | 98.6 | 49% | 0.488 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -62.3 | -42.9 | 176.9 | -74.8 | 179.2 | 65.3 | 0 | 0 | 112.2 | L156 C172 V173 R178 K179 H180 | L156-M176 HydrophobicContact CD2-CE 3.79Å; C172-M176 WeakPolarHBondContact O-CB 3.25Å; C172-M176 WeakPolarHBondContact O-CG 3.43Å; C172-M176 PolarHBondContact O-N 3.44Å; V173-M176 PolarHBondContact O-N 2.87Å; M176-R178 PolarHBondContact O-N 3.09Å; M176-K179 PolarHBondContact O-N 3.36Å; M176-H180 VanDerWaalsContact O-CB 3.31Å; M176-H180 WeakPolarHBondContact O-CB 3.49Å; M176-H180 PolarHBondContact O-N 3.24Å |
| 177 | K | 87 | Confident | 86.7 | Confident | 126 Ų | 126 | 95.8 Ų | 95.8 | 55% | 0.548 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -60.4 | -44.4 | 175.6 | -79.6 | 177.6 | 178.9 | 178 | 0 | 112.1 | V173 E174 H180 K181 | V173-K177 HydrophobicContact CG1-CD 4.15Å; V173-K177 HydrophobicContact CG1-CG 4.38Å; V173-K177 WeakPolarHBondContact O-CB 3.44Å; V173-K177 VanDerWaalsContact O-CG 3.31Å; V173-K177 WeakPolarHBondContact O-CG 3.37Å; V173-K177 PolarHBondContact O-N 3.08Å; E174-K177 PolarHBondContact O-N 2.67Å; K177-H180 PolarHBondContact O-N 3.08Å; K177-K181 WeakPolarHBondContact O-CB 3.3Å; K177-K181 PolarHBondContact O-N 3.37Å |
| 178 | R | 89.5 | Confident | 87.1 | Confident | 151 Ų | 151 | 95.9 Ų | 95.9 | 57% | 0.57 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -61.3 | -46.7 | 175.9 | -170.4 | -178.4 | -60.4 | 149.9 | 4.7 | 111 | E174 V175 M176 K181 E182 | E174-R178 PolarHBondContact O-N 3.31Å; V175-R178 PolarHBondContact O-N 3.05Å; M176-R178 PolarHBondContact O-N 3.09Å; R178-K181 PolarHBondContact O-N 3.27Å; R178-E182 WeakPolarHBondContact O-CG 3.43Å; R178-E182 PolarHBondContact O-N 3.09Å |
| 179 | K | 88.6 | Confident | 87.6 | Confident | 113 Ų | 113 | 100.2 Ų | 100.2 | 49% | 0.491 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -64.2 | -40 | 177.8 | -75.8 | -72.8 | 164.2 | -154.5 | 0 | 112.9 | V175 M176 E182 L183 | V175-K179 WeakPolarHBondContact O-CG 3.28Å; V175-K179 PolarHBondContact O-N 3.26Å; M176-K179 PolarHBondContact O-N 3.36Å; K179-E182 WeakPolarHBondContact CD-OE2 3.48Å; K179-E182 WeakPolarHBondContact CE-OE2 3.15Å; K179-E182 IonicContact NZ-OE2 2.74Å; K179-E182 PolarHBondContact NZ-OE2 3.24Å; K179-E182 PolarHBondContact O-N 3.47Å; K179-L183 WeakPolarHBondContact O-CB 3.38Å; K179-L183 WeakPolarHBondContact O-CG 3.44Å; K179-L183 PolarHBondContact O-N 3.25Å |
| 180 | H | 88.6 | Confident | 88.2 | Confident | 122 Ų | 122 | 101.8 Ų | 101.8 | 57% | 0.565 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -61.8 | -44.7 | 174.5 | -177 | 70.4 | 0 | 0 | 0 | 110.9 | M176 K177 E182 L183 M184 | M176-H180 VanDerWaalsContact O-CB 3.31Å; M176-H180 WeakPolarHBondContact O-CB 3.49Å; M176-H180 PolarHBondContact O-N 3.24Å; K177-H180 PolarHBondContact O-N 3.08Å; H180-E182 PolarHBondContact O-N 2.9Å; H180-L183 PolarHBondContact O-N 2.93Å; H180-M184 WeakPolarHBondContact O-CB 3.46Å; H180-M184 VanDerWaalsContact O-CG 3.23Å; H180-M184 WeakPolarHBondContact O-CG 3.35Å; H180-M184 PolarHBondContact O-N 3.46Å |
| 181 | K | 90.6 | Very high | 88.6 | Confident | 163 Ų | 163 | 97.3 Ų | 97.3 | 71% | 0.709 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -61.4 | -43.2 | 175.5 | -171.1 | 177.9 | -179.5 | 179 | 0 | 112.4 | K177 R178 S185 | K177-K181 WeakPolarHBondContact O-CB 3.3Å; K177-K181 PolarHBondContact O-N 3.37Å; R178-K181 PolarHBondContact O-N 3.27Å; K181-S185 PolarHBondContact O-N 3.24Å; K181-S185 PolarHBondContact O-OG 3.4Å |
| 182 | E | 90.4 | Very high | 89.1 | Confident | 87 Ų | 87 | 95.1 Ų | 95.1 | 41% | 0.407 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -59.7 | -51.2 | 174.3 | -73.7 | 169.3 | -165 | 0 | 0 | 111.4 | R178 K179 H180 M184 S185 S186 | R178-E182 WeakPolarHBondContact O-CG 3.43Å; R178-E182 PolarHBondContact O-N 3.09Å; K179-E182 WeakPolarHBondContact CD-OE2 3.48Å; K179-E182 WeakPolarHBondContact CE-OE2 3.15Å; K179-E182 IonicContact NZ-OE2 2.74Å; K179-E182 PolarHBondContact NZ-OE2 3.24Å; K179-E182 PolarHBondContact O-N 3.47Å; H180-E182 PolarHBondContact O-N 2.9Å; E182-M184 PolarHBondContact O-N 3.18Å; E182-S185 PolarHBondContact O-N 2.99Å; E182-S185 PolarHBondContact O-OG 3.45Å; E182-S186 PolarHBondContact O-N 2.8Å |
| 183 | L | 91 | Very high | 89.7 | Confident | 114 Ų | 114 | 97.6 Ų | 97.6 | 60% | 0.597 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -61.5 | -42.7 | 179 | -77.3 | 168.3 | 0 | 0 | 0 | 112.4 | K179 H180 S185 S186 C187 | K179-L183 WeakPolarHBondContact O-CB 3.38Å; K179-L183 WeakPolarHBondContact O-CG 3.44Å; K179-L183 PolarHBondContact O-N 3.25Å; H180-L183 PolarHBondContact O-N 2.93Å; L183-S185 VanDerWaalsContact C-N 3.33Å; L183-S185 PolarHBondContact O-N 3.48Å; L183-S186 PolarHBondContact O-N 2.93Å; L183-C187 VanDerWaalsContact O-CB 3.3Å; L183-C187 WeakPolarHBondContact O-CB 3.39Å; L183-C187 PolarHBondContact O-N 3.49Å |
| 184 | M | 87.4 | Confident | 90 | Very high | 108 Ų | 108 | 97.7 Ų | 97.7 | 53% | 0.532 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -62.4 | -41.5 | 176.4 | -72.9 | -58.9 | -66.4 | 0 | 0 | 111.5 | H180 E182 S186 C187 S188 | H180-M184 WeakPolarHBondContact O-CB 3.46Å; H180-M184 VanDerWaalsContact O-CG 3.23Å; H180-M184 WeakPolarHBondContact O-CG 3.35Å; H180-M184 PolarHBondContact O-N 3.46Å; E182-M184 PolarHBondContact O-N 3.18Å; M184-S186 VanDerWaalsContact C-N 3.35Å; M184-C187 PolarHBondContact O-N 3.33Å; M184-S188 WeakPolarHBondContact O-CB 3.45Å; M184-S188 PolarHBondContact O-N 2.93Å |
| 185 | S | 91.6 | Very high | 90.4 | Very high | 59 Ų | 59 | 98.9 Ų | 98.9 | 41% | 0.413 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -65.9 | -37.1 | 174.7 | 75.5 | 0 | 0 | 0 | 0 | 112.6 | K181 E182 L183 K189 | K181-S185 PolarHBondContact O-N 3.24Å; K181-S185 PolarHBondContact O-OG 3.4Å; E182-S185 PolarHBondContact O-N 2.99Å; E182-S185 PolarHBondContact O-OG 3.45Å; L183-S185 VanDerWaalsContact C-N 3.33Å; L183-S185 PolarHBondContact O-N 3.48Å; S185-K189 WeakPolarHBondContact O-CG 3.37Å; S185-K189 PolarHBondContact O-N 3.2Å |
| 186 | S | 90.7 | Very high | 90.7 | Very high | 69 Ų | 69 | 103 Ų | 103 | 48% | 0.483 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -67.9 | -43.9 | 175.7 | -164.3 | 0 | 0 | 0 | 0 | 111.6 | E182 L183 M184 S188 K189 E190 | E182-S186 PolarHBondContact O-N 2.8Å; L183-S186 PolarHBondContact O-N 2.93Å; M184-S186 VanDerWaalsContact C-N 3.35Å; S186-S188 VanDerWaalsContact C-N 3.34Å; S186-S188 PolarHBondContact O-N 3.41Å; S186-K189 PolarHBondContact O-N 3.43Å; S186-E190 WeakPolarHBondContact O-CB 3.45Å; S186-E190 PolarHBondContact O-N 3.29Å |
| 187 | C | 90.8 | Very high | 91 | Very high | 81 Ų | 81 | 100.8 Ų | 100.8 | 55% | 0.547 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -63.4 | -39.7 | 178 | -170.7 | 0 | 0 | 0 | 0 | 111.5 | L183 M184 E190 A191 | L183-C187 VanDerWaalsContact O-CB 3.3Å; L183-C187 WeakPolarHBondContact O-CB 3.39Å; L183-C187 PolarHBondContact O-N 3.49Å; M184-C187 PolarHBondContact O-N 3.33Å; C187-E190 PolarHBondContact O-N 3.3Å; C187-A191 WeakPolarHBondContact O-CB 3.39Å; C187-A191 PolarHBondContact O-N 2.89Å |
| 188 | S | 90.8 | Very high | 91.3 | Very high | 64 Ų | 64 | 99.2 Ų | 99.2 | 45% | 0.448 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -60.7 | -45.1 | 173.3 | -168.6 | 0 | 0 | 0 | 0 | 112 | M184 S186 A191 E192 | M184-S188 WeakPolarHBondContact O-CB 3.45Å; M184-S188 PolarHBondContact O-N 2.93Å; S186-S188 VanDerWaalsContact C-N 3.34Å; S186-S188 PolarHBondContact O-N 3.41Å; S188-A191 PolarHBondContact O-N 3.4Å; S188-E192 WeakPolarHBondContact O-CG 3.45Å; S188-E192 PolarHBondContact O-N 2.89Å |
| 189 | K | 92.1 | Very high | 91.5 | Very high | 128 Ų | 128 | 95.4 Ų | 95.4 | 56% | 0.557 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -63.3 | -44.8 | 177 | -71.3 | 174.5 | -178.4 | -177.8 | 0 | 111.9 | S185 S186 A191 E192 E193 | S185-K189 WeakPolarHBondContact O-CG 3.37Å; S185-K189 PolarHBondContact O-N 3.2Å; S186-K189 PolarHBondContact O-N 3.43Å; K189-A191 VanDerWaalsContact C-N 3.32Å; K189-A191 PolarHBondContact O-N 3.13Å; K189-E192 WeakPolarHBondContact O-CB 3.41Å; K189-E192 PolarHBondContact O-N 3.31Å; K189-E193 WeakPolarHBondContact O-CG 3.23Å; K189-E193 PolarHBondContact O-N 3.4Å |
| 190 | E | 90.2 | Very high | 91.8 | Very high | 95 Ų | 95 | 94 Ų | 94 | 44% | 0.444 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -62.2 | -40.2 | 177.5 | -166.5 | 69.9 | -154.7 | 0 | 0 | 111.5 | S186 C187 E193 S194 | S186-E190 WeakPolarHBondContact O-CB 3.45Å; S186-E190 PolarHBondContact O-N 3.29Å; C187-E190 PolarHBondContact O-N 3.3Å; E190-E193 PolarHBondContact O-N 3.38Å; E190-S194 WeakPolarHBondContact O-CB 3.46Å; E190-S194 PolarHBondContact O-N 3.49Å |
| 191 | A | 92.6 | Very high | 92 | Very high | 59 Ų | 59 | 92.1 Ų | 92.1 | 49% | 0.488 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -64.6 | -41.6 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | C187 S188 K189 S194 L195 | C187-A191 WeakPolarHBondContact O-CB 3.39Å; C187-A191 PolarHBondContact O-N 2.89Å; S188-A191 PolarHBondContact O-N 3.4Å; K189-A191 VanDerWaalsContact C-N 3.32Å; K189-A191 PolarHBondContact O-N 3.13Å; A191-S194 PolarHBondContact O-N 3.04Å; A191-L195 WeakPolarHBondContact O-CB 3.48Å; A191-L195 PolarHBondContact O-N 3.44Å |
| 192 | E | 93 | Very high | 92.2 | Very high | 99 Ų | 99 | 87 Ų | 87 | 46% | 0.463 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -63.2 | -43.3 | 173.2 | -73.1 | 175.1 | -159.4 | 0 | 0 | 112.1 | S188 K189 L195 R196 | S188-E192 WeakPolarHBondContact O-CG 3.45Å; S188-E192 PolarHBondContact O-N 2.89Å; K189-E192 WeakPolarHBondContact O-CB 3.41Å; K189-E192 PolarHBondContact O-N 3.31Å; E192-L195 PolarHBondContact O-N 3.03Å; E192-R196 WeakPolarHBondContact O-CG 3.42Å; E192-R196 PolarHBondContact O-N 3.49Å; E192-R196 IonicContact OE2-NH1 3.66Å |
| 193 | E | 93.3 | Very high | 92.4 | Very high | 102 Ų | 102 | 88.2 Ų | 88.2 | 48% | 0.477 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -62.9 | -42.6 | 175.9 | -73.4 | 179.7 | -165.9 | 0 | 0 | 112 | K189 E190 L195 R196 A197 | K189-E193 WeakPolarHBondContact O-CG 3.23Å; K189-E193 PolarHBondContact O-N 3.4Å; E190-E193 PolarHBondContact O-N 3.38Å; E193-L195 PolarHBondContact O-N 2.91Å; E193-R196 PolarHBondContact O-N 3.22Å; E193-A197 WeakPolarHBondContact O-CB 3.45Å; E193-A197 PolarHBondContact O-N 2.92Å |
| 194 | S | 91.8 | Very high | 92.5 | Very high | 63 Ų | 63 | 85.9 Ų | 85.9 | 44% | 0.441 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -61.1 | -42.7 | 174.3 | -170.2 | 0 | 0 | 0 | 0 | 111.9 | E190 A191 A197 N198 | E190-S194 WeakPolarHBondContact O-CB 3.46Å; E190-S194 PolarHBondContact O-N 3.49Å; A191-S194 PolarHBondContact O-N 3.04Å; S194-A197 PolarHBondContact O-N 3.03Å; S194-N198 WeakPolarHBondContact O-CB 3.31Å; S194-N198 VanDerWaalsContact O-CG 3.31Å; S194-N198 PolarHBondContact O-N 3.46Å; S194-N198 PolarHBondContact O-ND2 3.34Å |
| 195 | L | 94.2 | Very high | 92.7 | Very high | 120 Ų | 120 | 89.2 Ų | 89.2 | 63% | 0.628 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -64.4 | -42.7 | 176.4 | -174.4 | 68.7 | 0 | 0 | 0 | 111.8 | A191 E192 E193 N198 S199 | A191-L195 WeakPolarHBondContact O-CB 3.48Å; A191-L195 PolarHBondContact O-N 3.44Å; E192-L195 PolarHBondContact O-N 3.03Å; E193-L195 PolarHBondContact O-N 2.91Å; L195-N198 PolarHBondContact O-N 3.2Å; L195-S199 WeakPolarHBondContact O-CB 3.49Å; L195-S199 PolarHBondContact O-N 2.7Å; L195-S199 PolarHBondContact O-OG 3.06Å |
| 196 | R | 94.6 | Very high | 92.8 | Very high | 141 Ų | 141 | 94.4 Ų | 94.4 | 53% | 0.532 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -59.7 | -48.7 | 174 | -75.2 | -172.1 | -75.2 | -108.3 | 2.4 | 111.1 | E192 E193 N198 S199 E200 | E192-R196 WeakPolarHBondContact O-CG 3.42Å; E192-R196 PolarHBondContact O-N 3.49Å; E192-R196 IonicContact OE2-NH1 3.66Å; E193-R196 PolarHBondContact O-N 3.22Å; R196-N198 PolarHBondContact O-N 3.04Å; R196-S199 PolarHBondContact O-N 3.47Å; R196-E200 PolarHBondContact O-N 3.26Å |
| 197 | A | 91.7 | Very high | 92.9 | Very high | 52 Ų | 52 | 95.3 Ų | 95.3 | 43% | 0.43 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -62.1 | -41.6 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | E193 S194 E200 L201 | E193-A197 WeakPolarHBondContact O-CB 3.45Å; E193-A197 PolarHBondContact O-N 2.92Å; S194-A197 PolarHBondContact O-N 3.03Å; A197-E200 PolarHBondContact O-N 3.5Å; A197-L201 WeakPolarHBondContact O-CG 3.31Å; A197-L201 PolarHBondContact O-N 2.97Å |
| 198 | N | 92.9 | Very high | 92.7 | Very high | 93 Ų | 93 | 94.9 Ų | 94.9 | 50% | 0.497 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -66 | -38.9 | 177.2 | -77.1 | -34.1 | 0 | 0 | 0 | 112.6 | S194 L195 R196 E200 L201 A202 | S194-N198 WeakPolarHBondContact O-CB 3.31Å; S194-N198 VanDerWaalsContact O-CG 3.31Å; S194-N198 PolarHBondContact O-N 3.46Å; S194-N198 PolarHBondContact O-ND2 3.34Å; L195-N198 PolarHBondContact O-N 3.2Å; R196-N198 PolarHBondContact O-N 3.04Å; N198-E200 VanDerWaalsContact C-N 3.34Å; N198-L201 PolarHBondContact O-N 2.85Å; N198-A202 WeakPolarHBondContact O-CB 3.41Å; N198-A202 PolarHBondContact O-N 3.48Å |
| 199 | S | 94.7 | Very high | 92.7 | Very high | 72 Ų | 72 | 94 Ų | 94 | 50% | 0.503 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -63.6 | -42 | 175.8 | -57.8 | 0 | 0 | 0 | 0 | 111.3 | L195 R196 A202 R203 | L195-S199 WeakPolarHBondContact O-CB 3.49Å; L195-S199 PolarHBondContact O-N 2.7Å; L195-S199 PolarHBondContact O-OG 3.06Å; R196-S199 PolarHBondContact O-N 3.47Å; S199-A202 WeakPolarHBondContact O-CB 3.49Å; S199-A202 PolarHBondContact O-N 2.87Å; S199-R203 PolarHBondContact O-N 3.39Å |
| 200 | E | 94.9 | Very high | 92.7 | Very high | 84 Ų | 84 | 90.7 Ų | 90.7 | 39% | 0.393 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -67.3 | -41.6 | 176.8 | -179 | 60.8 | -175.2 | 0 | 0 | 112.2 | R196 A197 N198 A202 R203 I204 | R196-E200 PolarHBondContact O-N 3.26Å; A197-E200 PolarHBondContact O-N 3.5Å; N198-E200 VanDerWaalsContact C-N 3.34Å; E200-A202 VanDerWaalsContact C-N 3.3Å; E200-A202 PolarHBondContact O-N 3.14Å; E200-R203 WeakPolarHBondContact O-CB 3.44Å; E200-R203 PolarHBondContact O-N 3.33Å; E200-R203 IonicContact OE1-CZ 2.75Å; E200-R203 IonicContact OE1-NE 3.68Å; E200-R203 PolarHBondContact OE1-NE 2.97Å; E200-R203 IonicContact OE1-NH2 3.86Å; E200-R203 PolarHBondContact OE1-NH2 3.42Å; E200-R203 IonicContact OE2-CZ 3.84Å; E200-R203 IonicContact OE2-NE 2.61Å; E200-R203 PolarHBondContact OE2-NE 3.26Å; E200-R203 IonicContact OE2-NH2 3.04Å; E200-I204 HydrophobicContact CG-CD1 4.06Å; E200-I204 WeakPolarHBondContact O-CG1 3.44Å; E200-I204 PolarHBondContact O-N 2.95Å |
| 201 | L | 92.5 | Very high | 92.5 | Very high | 81 Ų | 81 | 91.5 Ų | 91.5 | 42% | 0.424 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -60.6 | -38.7 | 172.7 | -76.9 | 173.8 | 0 | 0 | 0 | 112.2 | A197 N198 R205 | A197-L201 WeakPolarHBondContact O-CG 3.31Å; A197-L201 PolarHBondContact O-N 2.97Å; N198-L201 PolarHBondContact O-N 2.85Å; L201-R205 WeakPolarHBondContact O-CB 3.34Å; L201-R205 VanDerWaalsContact O-CG 3.22Å; L201-R205 WeakPolarHBondContact O-CG 3.46Å; L201-R205 PolarHBondContact O-N 3.33Å |
| 202 | A | 94.6 | Very high | 92.1 | Very high | 56 Ų | 56 | 97.3 Ų | 97.3 | 46% | 0.463 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -64.6 | -41.6 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | N198 S199 E200 R205 K206 | N198-A202 WeakPolarHBondContact O-CB 3.41Å; N198-A202 PolarHBondContact O-N 3.48Å; S199-A202 WeakPolarHBondContact O-CB 3.49Å; S199-A202 PolarHBondContact O-N 2.87Å; E200-A202 VanDerWaalsContact C-N 3.3Å; E200-A202 PolarHBondContact O-N 3.14Å; A202-R205 PolarHBondContact O-N 3.14Å; A202-K206 PolarHBondContact O-N 3.41Å |
| 203 | R | 94.7 | Very high | 91.7 | Very high | 113 Ų | 113 | 99.3 Ų | 99.3 | 43% | 0.426 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -59.5 | -53 | 173.9 | -172.1 | -173.4 | 71.8 | 84.9 | -0.4 | 111.4 | S199 E200 R205 K206 E207 | S199-R203 PolarHBondContact O-N 3.39Å; E200-R203 WeakPolarHBondContact O-CB 3.44Å; E200-R203 PolarHBondContact O-N 3.33Å; E200-R203 IonicContact OE1-CZ 2.75Å; E200-R203 IonicContact OE1-NE 3.68Å; E200-R203 PolarHBondContact OE1-NE 2.97Å; E200-R203 IonicContact OE1-NH2 3.86Å; E200-R203 PolarHBondContact OE1-NH2 3.42Å; E200-R203 IonicContact OE2-CZ 3.84Å; E200-R203 IonicContact OE2-NE 2.61Å; E200-R203 PolarHBondContact OE2-NE 3.26Å; E200-R203 IonicContact OE2-NH2 3.04Å; R203-R205 VanDerWaalsContact C-N 3.3Å; R203-R205 PolarHBondContact O-N 2.79Å; R203-K206 WeakPolarHBondContact O-CB 3.26Å; R203-K206 PolarHBondContact O-N 3.03Å; R203-K206 VanDerWaalsContact O-N 3.1Å; R203-E207 IonicContact CZ-OE1 3.76Å; R203-E207 IonicContact CZ-OE2 2.85Å; R203-E207 IonicContact NH1-OE1 3.82Å; R203-E207 PolarHBondContact NH1-OE1 2.75Å; R203-E207 IonicContact NH1-OE2 2.89Å; R203-E207 PolarHBondContact NH1-OE2 2.85Å; R203-E207 PolarHBondContact O-N 3.29Å |
| 204 | I | 92.5 | Very high | 91.1 | Very high | 64 Ų | 64 | 97 Ų | 97 | 33% | 0.328 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -60.9 | -38.4 | 179.5 | -68.6 | 170.1 | 0 | 0 | 0 | 111.3 | E200 E207 N208 | E200-I204 HydrophobicContact CG-CD1 4.06Å; E200-I204 WeakPolarHBondContact O-CG1 3.44Å; E200-I204 PolarHBondContact O-N 2.95Å; I204-E207 PolarHBondContact O-N 2.74Å; I204-N208 VanDerWaalsContact CG2-ND2 3.29Å; I204-N208 WeakPolarHBondContact CG2-ND2 3.37Å; I204-N208 WeakPolarHBondContact O-CB 3.44Å; I204-N208 PolarHBondContact O-N 3.06Å; I204-N208 PolarHBondContact O-ND2 3.34Å |
| 205 | R | 93.1 | Very high | 90.1 | Very high | 179 Ų | 179 | 101 Ų | 101 | 68% | 0.675 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -63.7 | -40.8 | 175.1 | -78.7 | 173.4 | 177.4 | 163.2 | 1 | 112.1 | L201 A202 R203 N208 A209 | L201-R205 WeakPolarHBondContact O-CB 3.34Å; L201-R205 VanDerWaalsContact O-CG 3.22Å; L201-R205 WeakPolarHBondContact O-CG 3.46Å; L201-R205 PolarHBondContact O-N 3.33Å; A202-R205 PolarHBondContact O-N 3.14Å; R203-R205 VanDerWaalsContact C-N 3.3Å; R203-R205 PolarHBondContact O-N 2.79Å; R205-N208 PolarHBondContact O-N 3.47Å; R205-A209 WeakPolarHBondContact O-CB 3.29Å; R205-A209 PolarHBondContact O-N 3.03Å |
| 206 | K | 93.4 | Very high | 88.8 | Confident | 167 Ų | 167 | 100.3 Ų | 100.3 | 73% | 0.726 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -64.1 | -44.1 | 175.7 | -172.1 | -179.6 | 179.1 | -178 | 0 | 111.6 | A202 R203 A209 A210 | A202-K206 PolarHBondContact O-N 3.41Å; R203-K206 WeakPolarHBondContact O-CB 3.26Å; R203-K206 PolarHBondContact O-N 3.03Å; R203-K206 VanDerWaalsContact O-N 3.1Å; K206-A209 PolarHBondContact O-N 2.78Å; K206-A210 PolarHBondContact O-N 3.48Å |
| 207 | E | 92.3 | Very high | 87 | Confident | 88 Ų | 88 | 96.3 Ų | 96.3 | 41% | 0.411 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -63.2 | -44 | 176 | -73.6 | 172 | -173.7 | 0 | 0 | 112 | R203 I204 A209 A210 M211 | R203-E207 IonicContact CZ-OE1 3.76Å; R203-E207 IonicContact CZ-OE2 2.85Å; R203-E207 IonicContact NH1-OE1 3.82Å; R203-E207 PolarHBondContact NH1-OE1 2.75Å; R203-E207 IonicContact NH1-OE2 2.89Å; R203-E207 PolarHBondContact NH1-OE2 2.85Å; R203-E207 PolarHBondContact O-N 3.29Å; I204-E207 PolarHBondContact O-N 2.74Å; E207-A209 VanDerWaalsContact C-N 3.33Å; E207-A209 PolarHBondContact O-N 3.28Å; E207-A210 PolarHBondContact O-N 3.45Å; E207-M211 WeakPolarHBondContact O-CG 3.35Å; E207-M211 PolarHBondContact O-N 2.89Å |
| 208 | N | 87.2 | Confident | 85 | Confident | 73 Ų | 73 | 101.1 Ų | 101.1 | 39% | 0.39 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -62.9 | -37.4 | 174.7 | -79.6 | -54.3 | 0 | 0 | 0 | 112.9 | I204 R205 M211 R212 | I204-N208 VanDerWaalsContact CG2-ND2 3.29Å; I204-N208 WeakPolarHBondContact CG2-ND2 3.37Å; I204-N208 WeakPolarHBondContact O-CB 3.44Å; I204-N208 PolarHBondContact O-N 3.06Å; I204-N208 PolarHBondContact O-ND2 3.34Å; R205-N208 PolarHBondContact O-N 3.47Å; N208-M211 VanDerWaalsContact OD1-CE 3.28Å; N208-M211 WeakPolarHBondContact OD1-CE 3.35Å; N208-R212 WeakPolarHBondContact O-CB 3.47Å; N208-R212 VanDerWaalsContact O-CG 3.29Å; N208-R212 WeakPolarHBondContact O-CG 3.46Å; N208-R212 PolarHBondContact O-N 2.96Å |
| 209 | A | 91.5 | Very high | 83 | Confident | 46 Ų | 46 | 101.4 Ų | 101.4 | 38% | 0.38 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -65.5 | -43 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111.5 | R205 K206 E207 R212 Q213 | R205-A209 WeakPolarHBondContact O-CB 3.29Å; R205-A209 PolarHBondContact O-N 3.03Å; K206-A209 PolarHBondContact O-N 2.78Å; E207-A209 VanDerWaalsContact C-N 3.33Å; E207-A209 PolarHBondContact O-N 3.28Å; A209-R212 PolarHBondContact O-N 3.01Å; A209-Q213 WeakPolarHBondContact O-CG 3.48Å; A209-Q213 PolarHBondContact O-N 3.27Å |
| 210 | A | 90.6 | Very high | 80.8 | Confident | 58 Ų | 58 | 106.4 Ų | 106.4 | 48% | 0.479 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -63.4 | -43.6 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | K206 E207 R212 Q213 G214 | K206-A210 PolarHBondContact O-N 3.48Å; E207-A210 PolarHBondContact O-N 3.45Å; A210-R212 VanDerWaalsContact C-N 3.31Å; A210-R212 PolarHBondContact O-N 2.84Å; A210-Q213 PolarHBondContact O-N 3.38Å; A210-G214 PolarHBondContact O-N 3.38Å |
| 211 | M | 85.8 | Confident | 78.5 | Confident | 112 Ų | 112 | 112.1 Ų | 112.1 | 55% | 0.552 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -60.9 | -39.7 | 175 | -73.8 | -171.8 | -72.9 | 0 | 0 | 112.1 | E207 N208 G214 L215 | E207-M211 WeakPolarHBondContact O-CG 3.35Å; E207-M211 PolarHBondContact O-N 2.89Å; N208-M211 VanDerWaalsContact OD1-CE 3.28Å; N208-M211 WeakPolarHBondContact OD1-CE 3.35Å; M211-G214 PolarHBondContact O-N 2.89Å; M211-L215 WeakPolarHBondContact O-CG 3.32Å; M211-L215 PolarHBondContact O-N 2.98Å |
| 212 | R | 85.8 | Confident | 76.3 | Confident | 181 Ų | 181 | 113.3 Ų | 113.3 | 68% | 0.683 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -66.6 | -39.8 | 176.1 | -75.2 | 173.8 | 179 | -88.2 | -1.5 | 112.6 | N208 A209 A210 G214 L215 T216 | N208-R212 WeakPolarHBondContact O-CB 3.47Å; N208-R212 VanDerWaalsContact O-CG 3.29Å; N208-R212 WeakPolarHBondContact O-CG 3.46Å; N208-R212 PolarHBondContact O-N 2.96Å; A209-R212 PolarHBondContact O-N 3.01Å; A210-R212 VanDerWaalsContact C-N 3.31Å; A210-R212 PolarHBondContact O-N 2.84Å; R212-G214 VanDerWaalsContact C-N 3.32Å; R212-G214 PolarHBondContact O-N 3.5Å; R212-L215 PolarHBondContact O-N 3.41Å; R212-T216 PolarHBondContact O-N 3.48Å; R212-T216 PolarHBondContact O-OG1 3.02Å |
| 213 | Q | 84.3 | Confident | 74.1 | Confident | 140 Ų | 140 | 116 Ų | 116 | 65% | 0.654 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -64.1 | -37.5 | 176 | -73.8 | 175.6 | -3.7 | 0 | 0 | 112.1 | A209 A210 L215 T216 G217 | A209-Q213 WeakPolarHBondContact O-CG 3.48Å; A209-Q213 PolarHBondContact O-N 3.27Å; A210-Q213 PolarHBondContact O-N 3.38Å; Q213-L215 VanDerWaalsContact C-N 3.27Å; Q213-L215 PolarHBondContact O-N 3.29Å; Q213-T216 PolarHBondContact O-N 3.31Å; Q213-T216 PolarHBondContact O-OG1 2.96Å; Q213-G217 PolarHBondContact O-N 3.32Å |
| 214 | G | 79.9 | Confident | 72 | Confident | 54 Ų | 54 | 118.5 Ų | 118.5 | 56% | 0.557 | 64% | 0.643 | S | S | * | * | H | α-helix | trans | -64.6 | -28.4 | 174.2 | 0 | 0 | 0 | 0 | 0 | 113.9 | A210 M211 R212 | A210-G214 PolarHBondContact O-N 3.38Å; M211-G214 PolarHBondContact O-N 2.89Å; R212-G214 VanDerWaalsContact C-N 3.32Å; R212-G214 PolarHBondContact O-N 3.5Å |
| 215 | L | 71 | Confident | 69.8 | Low | 147 Ų | 147 | 120.4 Ų | 120.4 | 77% | 0.77 | 66% | 0.663 | S | S | * | * | H | α-helix | trans | -83.7 | -22.6 | 177.7 | -70.4 | 169.2 | 0 | 0 | 0 | 113.5 | M211 R212 Q213 | M211-L215 WeakPolarHBondContact O-CG 3.32Å; M211-L215 PolarHBondContact O-N 2.98Å; R212-L215 PolarHBondContact O-N 3.41Å; Q213-L215 VanDerWaalsContact C-N 3.27Å; Q213-L215 PolarHBondContact O-N 3.29Å |
| 216 | T | 66.2 | Low | 67.6 | Low | 105 Ų | 105 | 117.7 Ų | 117.7 | 64% | 0.644 | 67% | 0.671 | S | S | * | * | H | α-helix | trans | -94 | -4.8 | 179.1 | 53.5 | 0 | 0 | 0 | 0 | 113.7 | R212 Q213 D218 | R212-T216 PolarHBondContact O-N 3.48Å; R212-T216 PolarHBondContact O-OG1 3.02Å; Q213-T216 PolarHBondContact O-N 3.31Å; Q213-T216 PolarHBondContact O-OG1 2.96Å; T216-D218 PolarHBondContact O-N 3.2Å |
| 217 | G | 56.5 | Low | 65.7 | Low | 58 Ų | 58 | 119.2 Ų | 119.2 | 60% | 0.598 | 68% | 0.678 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.9 | -15.1 | -175.6 | 0 | 0 | 0 | 0 | 0 | 115.8 | Q213 | Q213-G217 PolarHBondContact O-N 3.32Š|
| 218 | D | 51.4 | Low | 63.2 | Low | 152 Ų | 152 | 120.1 Ų | 120.1 | 81% | 0.813 | 69% | 0.691 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -112.6 | 15 | -172 | -68.7 | -25.5 | 0 | 0 | 0 | 114.1 | T216 | T216-D218 PolarHBondContact O-N 3.2Š|
| 219 | S | 51.2 | Low | 61.5 | Low | 99 Ų | 99 | 126.3 Ų | 126.3 | 69% | 0.692 | 72% | 0.718 | S | S | * | * | S | Bend | trans | -120.9 | 91 | 175.7 | -71.4 | 0 | 0 | 0 | 0 | 111.8 | ||
| 220 | E | 47.8 | Very low | 59.3 | Low | 177 Ų | 177 | 131.8 Ų | 131.8 | 83% | 0.827 | 74% | 0.735 | S | S | * | * | trans | 48.5 | 106.7 | 138.9 | -61.2 | -173.2 | 151.8 | 0 | 0 | 117.7 | S222 | E220-S222 PolarHBondContact O-N 3.41Š| ||
| 221 | E | 45.7 | Very low | 57.3 | Low | 205 Ų | 205 | 138.3 Ų | 138.3 | 96% | 0.958 | 76% | 0.756 | S | S | * | * | trans | -37.4 | 104.2 | 142.2 | -61.5 | 179.9 | 136.3 | 0 | 0 | 111.8 | ||||
| 222 | S | 46.6 | Very low | 55.2 | Low | 106 Ų | 106 | 138 Ų | 138 | 74% | 0.741 | 76% | 0.76 | S | S | * | * | trans | -152 | 105 | 143.8 | 65.5 | 0 | 0 | 0 | 0 | 110.8 | E220 | E220-S222 PolarHBondContact O-N 3.41Š| ||
| 223 | S | 48.3 | Very low | 53.7 | Low | 112 Ų | 112 | 136.1 Ų | 136.1 | 78% | 0.783 | 77% | 0.769 | S | S | * | * | trans | 2.2 | 122.2 | 143.6 | -51.6 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 224 | I | 51.2 | Low | 51.9 | Low | 165 Ų | 165 | 137.7 Ų | 137.7 | 85% | 0.846 | 78% | 0.776 | S | S | * | * | -174.8 | 123.8 | 109.8 | -87.3 | 150 | 0 | 0 | 0 | 109.9 | |||||
| 225 | S | 45.6 | Very low | 50 | Low | 105 Ų | 105 | 143.6 Ų | 143.6 | 73% | 0.734 | 79% | 0.79 | S | S | * | * | trans | -38 | 127 | 167.2 | 166.6 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 226 | S | 47.8 | Very low | 48.7 | Very low | 122 Ų | 122 | 142.2 Ų | 142.2 | 85% | 0.853 | 79% | 0.789 | S | S | * | * | trans | -153.1 | 127.2 | 141.4 | -76.5 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 227 | K | 53 | Low | 47.6 | Very low | 198 Ų | 198 | 141.4 Ų | 141.4 | 86% | 0.861 | 79% | 0.793 | S | S | * | * | trans | -71.6 | 148.2 | -165.3 | -153.3 | 174.4 | -175.2 | -178.3 | 0 | 112.3 | ||||
| 228 | P | 40.8 | Very low | 47.1 | Very low | 108 Ų | 108 | 148 Ų | 148 | 70% | 0.701 | 81% | 0.809 | S | S | * | * | trans | -86.9 | 136.2 | 173 | 33.4 | -29 | 0 | 0 | 0 | 111.2 | Q230 | P228-Q230 PolarHBondContact O-N 3.45Š| ||
| 229 | E | 51.1 | Low | 46.9 | Very low | 202 Ų | 202 | 145.4 Ų | 145.4 | 94% | 0.944 | 80% | 0.802 | S | S | * | * | trans | -77.2 | 113.6 | 161.5 | -82.2 | 178.4 | 151.2 | 0 | 0 | 108.8 | ||||
| 230 | Q | 45.5 | Very low | 46.8 | Very low | 161 Ų | 161 | 149.4 Ų | 149.4 | 75% | 0.752 | 81% | 0.812 | S | S | * | * | trans | -91.3 | 116 | 164 | -74.6 | 177.6 | -70.3 | 0 | 0 | 108.1 | P228 T232 | P228-Q230 PolarHBondContact O-N 3.45Å; Q230-T232 HydrophobicContact CB-CG2 4.46Å; Q230-T232 PolarHBondContact O-N 2.95Å | ||
| 231 | E | 46.8 | Very low | 46.8 | Very low | 195 Ų | 195 | 145.7 Ų | 145.7 | 91% | 0.911 | 81% | 0.812 | S | S | * | * | trans | -84.6 | 98.2 | 153.1 | -88.4 | -175.8 | 150 | 0 | 0 | 107.8 | ||||
| 232 | T | 42.1 | Very low | 46.8 | Very low | 105 Ų | 105 | 141 Ų | 141 | 64% | 0.644 | 81% | 0.808 | S | S | * | * | trans | -96.8 | 116.5 | 161.8 | 45.8 | 0 | 0 | 0 | 0 | 107.7 | Q230 | Q230-T232 HydrophobicContact CB-CG2 4.46Å; Q230-T232 PolarHBondContact O-N 2.95Å | ||
| 233 | V | 54.4 | Low | 46.6 | Very low | 143 Ų | 143 | 139.5 Ų | 139.5 | 87% | 0.867 | 81% | 0.81 | S | S | * | * | trans | -107.7 | 104.6 | 162.5 | 179.1 | 0 | 0 | 0 | 0 | 106.6 | ||||
| 234 | E | 47 | Very low | 46.5 | Very low | 173 Ų | 173 | 140.4 Ų | 140.4 | 81% | 0.808 | 81% | 0.813 | S | S | * | * | trans | -87.5 | 131.1 | 165.5 | -69.8 | -176.9 | 153.8 | 0 | 0 | 109 | ||||
| 235 | E | 40.4 | Very low | 46.4 | Very low | 178 Ų | 178 | 137.8 Ų | 137.8 | 83% | 0.832 | 81% | 0.809 | S | S | * | * | trans | 32.9 | 155.5 | 136.4 | -72.7 | -142.1 | 156.5 | 0 | 0 | 121.7 | ||||
| 236 | P | 43.6 | Very low | 46.5 | Very low | 117 Ų | 117 | 138 Ų | 138 | 76% | 0.76 | 81% | 0.811 | S | S | * | * | cis | -144.4 | 170.5 | 34.3 | 34.8 | -11.1 | 0 | 0 | 0 | 117.4 | ||||
| 237 | A | 42.5 | Very low | 46.4 | Very low | 89 Ų | 89 | 136.7 Ų | 136.7 | 74% | 0.736 | 81% | 0.807 | S | S | * | * | trans | -66.6 | 136.5 | 168 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 238 | E | 46.2 | Very low | 46.2 | Very low | 197 Ų | 197 | 134.5 Ų | 134.5 | 92% | 0.921 | 81% | 0.81 | S | S | * | * | trans | -154 | 152.7 | 145.8 | -115.7 | 174.4 | -166.5 | 0 | 0 | 111.9 | ||||
| 239 | S | 47.2 | Very low | 46.3 | Very low | 97 Ų | 97 | 132.5 Ų | 132.5 | 68% | 0.678 | 81% | 0.809 | S | S | * | * | trans | -81.4 | 161.9 | -155 | 56.8 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 240 | M | 49.8 | Very low | 46.3 | Very low | 183 Ų | 183 | 133.4 Ų | 133.4 | 90% | 0.901 | 81% | 0.81 | S | S | * | * | trans | 74.4 | 109.3 | 143.6 | -60.5 | -110.4 | 156.4 | 0 | 0 | 119.9 | ||||
| 241 | A | 47.9 | Very low | 46.1 | Very low | 98 Ų | 98 | 129.2 Ų | 129.2 | 81% | 0.81 | 81% | 0.81 | S | S | * | * | 151.2 | 122.4 | 113.4 | 0 | 0 | 0 | 0 | 0 | 114.1 | |||||
| 242 | A | 45.8 | Very low | 46.2 | Very low | 106 Ų | 106 | 129.8 Ų | 129.8 | 88% | 0.876 | 80% | 0.804 | S | S | * | * | trans | 26.4 | 129.4 | 146.3 | 0 | 0 | 0 | 0 | 0 | 123.1 | ||||
| 243 | G | 42 | Very low | 46.6 | Very low | 76 Ų | 76 | 134.4 Ų | 134.4 | 78% | 0.784 | 81% | 0.81 | S | S | * | * | 103.7 | 116.6 | 127.1 | 0 | 0 | 0 | 0 | 0 | 117.9 | |||||
| 244 | P | 46.4 | Very low | 45.9 | Very low | 131 Ų | 131 | 135.7 Ų | 135.7 | 85% | 0.851 | 81% | 0.812 | S | S | * | * | trans | -104.8 | 152.3 | -170.7 | 38.2 | -30.4 | 0 | 0 | 0 | 114.2 | ||||
| 245 | S | 49.4 | Very low | 46 | Very low | 109 Ų | 109 | 132.3 Ų | 132.3 | 76% | 0.762 | 81% | 0.813 | S | S | * | * | trans | -160.3 | 114.3 | 157.5 | 47.8 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 246 | S | 47.7 | Very low | 46.2 | Very low | 110 Ų | 110 | 135.5 Ų | 135.5 | 77% | 0.769 | 82% | 0.818 | S | S | * | * | trans | 50.1 | 120 | 139.1 | 64.9 | 0 | 0 | 0 | 0 | 122.5 | ||||
| 247 | A | 44.7 | Very low | 46.6 | Very low | 94 Ų | 94 | 141.6 Ų | 141.6 | 78% | 0.777 | 83% | 0.826 | S | S | * | * | 68.4 | 105.1 | 127.2 | 0 | 0 | 0 | 0 | 0 | 120.2 | |||||
| 248 | T | 49.2 | Very low | 46.8 | Very low | 152 Ų | 152 | 147.3 Ų | 147.3 | 93% | 0.933 | 83% | 0.834 | S | S | * | * | trans | -167.4 | 128.6 | 138.4 | 26.7 | 0 | 0 | 0 | 0 | 104.5 | ||||
| 249 | G | 42.1 | Very low | 47.1 | Very low | 66 Ų | 66 | 147.9 Ų | 147.9 | 68% | 0.68 | 83% | 0.833 | S | S | * | * | 105.7 | 120.4 | 50.1 | 0 | 0 | 0 | 0 | 0 | 108.2 | |||||
| 250 | K | 51.9 | Low | 47.4 | Very low | 221 Ų | 221 | 154.4 Ų | 154.4 | 96% | 0.961 | 84% | 0.843 | S | S | * | * | trans | 93.5 | 120.1 | 163.6 | -53 | 171.6 | -178.5 | 176.7 | 0 | 116.5 | ||||
| 251 | G | 40.2 | Very low | 46.9 | Very low | 73 Ų | 73 | 151.8 Ų | 151.8 | 75% | 0.753 | 84% | 0.839 | S | S | * | * | trans | -98 | -161.1 | -172.8 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 252 | R | 49.5 | Very low | 46.9 | Very low | 207 Ų | 207 | 155 Ų | 155 | 78% | 0.781 | 84% | 0.841 | S | S | * | * | trans | -176.7 | 131.4 | 155.6 | -108.1 | 171.8 | 169.5 | -156.1 | -1 | 111.6 | ||||
| 253 | R | 50.9 | Low | 47.1 | Very low | 203 Ų | 203 | 154.7 Ų | 154.7 | 77% | 0.766 | 83% | 0.833 | S | S | * | * | trans | 78.7 | 96.5 | 141.1 | -65.7 | 173.5 | 179.2 | -175 | -3.2 | 119.3 | ||||
| 254 | N | 39.6 | Very low | 46.7 | Very low | 169 Ų | 169 | 158.1 Ų | 158.1 | 90% | 0.904 | 83% | 0.833 | S | S | * | * | trans | -64.5 | 130.1 | 153.4 | -76.9 | -28.4 | 0 | 0 | 0 | 111.6 | ||||
| 255 | A | 49 | Very low | 46.8 | Very low | 102 Ų | 102 | 159.1 Ų | 159.1 | 84% | 0.843 | 83% | 0.831 | S | S | * | * | trans | -121.6 | 98.7 | 160.7 | 0 | 0 | 0 | 0 | 0 | 109.4 | R257 | A255-R257 PolarHBondContact O-N 3.27Š| ||
| 256 | R | 45.5 | Very low | 46.4 | Very low | 246 Ų | 246 | 161.4 Ų | 161.4 | 93% | 0.928 | 83% | 0.834 | S | S | * | * | trans | -65.9 | 118.4 | 169.8 | -90.1 | 173.8 | 155.8 | -177.5 | -5.8 | 109.6 | ||||
| 257 | R | 50.9 | Low | 46.6 | Very low | 245 Ų | 245 | 163.4 Ų | 163.4 | 93% | 0.925 | 83% | 0.832 | S | S | * | * | trans | -121 | 117 | 155.6 | -100.8 | -177.3 | 155 | -162.5 | -5.7 | 110 | A255 | A255-R257 PolarHBondContact O-N 3.27Š| ||
| 258 | K | 48.1 | Very low | 46.5 | Very low | 209 Ų | 209 | 167.1 Ų | 167.1 | 91% | 0.909 | 83% | 0.833 | S | S | * | * | P | Polyproline II helix | trans | -58.4 | 124.7 | -177.3 | -67.2 | 168.6 | 174.9 | 175 | 0 | 111 | ||
| 259 | K | 52.3 | Low | 46.4 | Very low | 209 Ų | 209 | 169.3 Ų | 169.3 | 91% | 0.909 | 83% | 0.825 | S | S | * | * | P | Polyproline II helix | trans | -96.8 | 123.8 | 157.8 | -80.6 | -179.8 | 176.6 | 177.9 | 0 | 108.2 | ||
| 260 | R | 53 | Low | 46.7 | Very low | 234 Ų | 234 | 173.8 Ų | 173.8 | 88% | 0.883 | 83% | 0.828 | S | S | * | * | P | Polyproline II helix | trans | -77.3 | 148.3 | 169.8 | -80 | -179.5 | 160.7 | -150 | -3.2 | 109.7 | ||
| 261 | P | 38.8 | Very low | 46.8 | Very low | 127 Ų | 127 | 170.3 Ų | 170.3 | 83% | 0.825 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -78.8 | 134 | 178.3 | 31.1 | -29.7 | 0 | 0 | 0 | 110.2 | ||
| 262 | I | 48.4 | Very low | 47.6 | Very low | 165 Ų | 165 | 177.4 Ų | 177.4 | 85% | 0.846 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -97.9 | 121.2 | 167.2 | -62.4 | 175.3 | 0 | 0 | 0 | 106.4 | ||
| 263 | S | 50 | Low | 47.3 | Very low | 101 Ų | 101 | 174.8 Ų | 174.8 | 71% | 0.706 | 83% | 0.825 | S | S | * | * | P | Polyproline II helix | trans | -64 | 137.2 | 177.7 | 44.3 | 0 | 0 | 0 | 0 | 112 | L265 | S263-L265 PolarHBondContact O-N 3.33Š|
| 264 | N | 34.2 | Very low | 47.7 | Very low | 148 Ų | 148 | 172.4 Ų | 172.4 | 79% | 0.791 | 83% | 0.827 | S | S | * | * | P | Polyproline II helix | trans | -56.2 | 126 | 164.9 | -77.4 | -25.4 | 0 | 0 | 0 | 110.4 | ||
| 265 | L | 48.2 | Very low | 48.5 | Very low | 152 Ų | 152 | 173.3 Ų | 173.3 | 80% | 0.796 | 83% | 0.826 | S | S | * | * | trans | -130.8 | 104.9 | 152.2 | -86.8 | 165.6 | 0 | 0 | 0 | 105.8 | S263 E267 | S263-L265 PolarHBondContact O-N 3.33Å; L265-E267 PolarHBondContact O-N 2.91Å | ||
| 266 | D | 40.6 | Very low | 48.3 | Very low | 156 Ų | 156 | 176.3 Ų | 176.3 | 83% | 0.834 | 83% | 0.828 | S | S | * | * | trans | -64.9 | 106.4 | 165.3 | -64.4 | -56.2 | 0 | 0 | 0 | 107.4 | ||||
| 267 | E | 50.9 | Low | 48.8 | Very low | 153 Ų | 153 | 172.6 Ų | 172.6 | 72% | 0.715 | 83% | 0.827 | S | S | * | * | trans | -110.9 | 107.1 | 166.1 | -85.6 | -171.8 | 163.9 | 0 | 0 | 109.1 | L265 Y269 | L265-E267 PolarHBondContact O-N 2.91Å; E267-Y269 PolarHBondContact O-N 3.07Å | ||
| 268 | E | 43.4 | Very low | 48.7 | Very low | 171 Ų | 171 | 169.2 Ų | 169.2 | 80% | 0.799 | 82% | 0.821 | S | S | * | * | trans | -64.8 | 101.9 | 175.1 | -167.8 | 171.1 | -148.5 | 0 | 0 | 109.8 | H270 | E268-H270 PolarHBondContact O-N 3.14Š| ||
| 269 | Y | 47 | Very low | 48.6 | Very low | 199 Ų | 199 | 164.5 Ų | 164.5 | 78% | 0.78 | 82% | 0.815 | S | S | * | * | trans | -87.8 | 96.9 | 172.7 | -101.7 | -96 | 0 | 0 | 0 | 110.1 | E267 L271 | E267-Y269 PolarHBondContact O-N 3.07Å; Y269-L271 PolarHBondContact O-N 2.75Å | ||
| 270 | H | 47.2 | Very low | 48.3 | Very low | 159 Ų | 159 | 162.4 Ų | 162.4 | 74% | 0.736 | 81% | 0.814 | S | S | * | * | trans | -74.5 | 101.5 | 160.7 | -85.6 | -65.1 | 0 | 0 | 0 | 109.6 | E268 | E268-H270 PolarHBondContact O-N 3.14Š| ||
| 271 | L | 55.3 | Low | 48 | Very low | 148 Ų | 148 | 156 Ų | 156 | 78% | 0.775 | 80% | 0.803 | S | S | * | * | trans | -83.9 | 110.4 | 162 | -83.4 | 156.1 | 0 | 0 | 0 | 107.8 | Y269 | Y269-L271 PolarHBondContact O-N 2.75Š| ||
| 272 | R | 56 | Low | 47.8 | Very low | 222 Ų | 222 | 159.9 Ų | 159.9 | 84% | 0.838 | 81% | 0.806 | S | S | * | * | trans | -80.8 | 125.4 | 162.5 | -71.9 | -175.3 | 177.2 | -157.2 | -1.9 | 107.5 | D274 | R272-D274 PolarHBondContact O-N 3.4Š| ||
| 273 | D | 43.1 | Very low | 48 | Very low | 152 Ų | 152 | 161.2 Ų | 161.2 | 81% | 0.813 | 81% | 0.809 | S | S | * | * | trans | -69.8 | 114.6 | 165.7 | -62.3 | -51.8 | 0 | 0 | 0 | 107.4 | ||||
| 274 | D | 60.6 | Low | 47.7 | Very low | 153 Ų | 153 | 160 Ų | 160 | 82% | 0.818 | 81% | 0.812 | S | S | * | * | trans | -115.7 | 116.7 | 164.7 | -76.8 | -52.4 | 0 | 0 | 0 | 107.5 | R272 | R272-D274 PolarHBondContact O-N 3.4Š| ||
| 275 | E | 55.8 | Low | 47.8 | Very low | 188 Ų | 188 | 162.5 Ų | 162.5 | 88% | 0.879 | 82% | 0.817 | S | S | * | * | trans | -66.9 | 155.3 | -179.1 | -62.4 | -179.4 | 136.2 | 0 | 0 | 111.4 | ||||
| 276 | D | 45.2 | Very low | 47.3 | Very low | 165 Ų | 165 | 160 Ų | 160 | 88% | 0.882 | 81% | 0.812 | S | S | * | * | trans | -53.9 | 131.1 | 176.4 | -58.9 | -70.3 | 0 | 0 | 0 | 112.2 | ||||
| 277 | D | 55.6 | Low | 46.9 | Very low | 168 Ų | 168 | 160.4 Ų | 160.4 | 90% | 0.898 | 81% | 0.811 | S | S | * | * | trans | -144.5 | 135.4 | 150.3 | -132.4 | -21.5 | 0 | 0 | 0 | 112.1 | ||||
| 278 | E | 49.1 | Very low | 46.7 | Very low | 174 Ų | 174 | 158.9 Ų | 158.9 | 81% | 0.813 | 81% | 0.812 | S | S | * | * | trans | -74 | 161 | -176.1 | -76.5 | -154.7 | 131.3 | 0 | 0 | 112.5 | ||||
| 279 | S | 46 | Very low | 46.4 | Very low | 111 Ų | 111 | 158.1 Ų | 158.1 | 78% | 0.776 | 81% | 0.813 | S | S | * | * | trans | 73.2 | 102.4 | 156 | 51 | 0 | 0 | 0 | 0 | 119.8 | ||||
| 280 | D | 46.4 | Very low | 46 | Very low | 165 Ų | 165 | 160.6 Ų | 160.6 | 88% | 0.882 | 82% | 0.821 | S | S | * | * | -166.5 | 149.9 | 117.1 | -121.2 | -10.7 | 0 | 0 | 0 | 112.6 | |||||
| 281 | P | 45.2 | Very low | 45.8 | Very low | 100 Ų | 100 | 158 Ų | 158 | 65% | 0.649 | 82% | 0.82 | S | S | * | * | trans | -94.9 | 141 | -175 | 35.3 | -27.6 | 0 | 0 | 0 | 113.1 | ||||
| 282 | F | 36.5 | Very low | 44.8 | Very low | 207 Ų | 207 | 154.3 Ų | 154.3 | 91% | 0.908 | 82% | 0.818 | S | S | * | * | trans | 68.4 | 88.3 | 162.6 | -84.7 | -95.6 | 0 | 0 | 0 | 117.9 | ||||
| 283 | E | 52.1 | Low | 44.3 | Very low | 193 Ų | 193 | 150.8 Ų | 150.8 | 90% | 0.902 | 82% | 0.821 | S | S | * | * | trans | -110.6 | 126 | 149.5 | -78.3 | -166.5 | 148.7 | 0 | 0 | 110.3 | ||||
| 284 | G | 43.5 | Very low | 44 | Very low | 75 Ų | 75 | 147.6 Ų | 147.6 | 77% | 0.773 | 82% | 0.824 | S | S | * | * | trans | -65.9 | 142.9 | -175.1 | 0 | 0 | 0 | 0 | 0 | 113.5 | S286 | G284-S286 PolarHBondContact O-N 3.24Š| ||
| 285 | F | 36 | Very low | 43 | Very low | 201 Ų | 201 | 144.9 Ų | 144.9 | 88% | 0.882 | 82% | 0.823 | S | S | * | * | trans | -64.9 | 113.8 | 173.2 | -83.4 | -93.3 | 0 | 0 | 0 | 111.1 | ||||
| 286 | S | 36.9 | Very low | 42.3 | Very low | 101 Ų | 101 | 147.7 Ų | 147.7 | 71% | 0.706 | 83% | 0.825 | S | S | * | * | trans | -88.4 | 107.4 | 167.2 | 168.3 | 0 | 0 | 0 | 0 | 109.3 | G284 | G284-S286 PolarHBondContact O-N 3.24Š| ||
| 287 | M | 32.8 | Very low | 42 | Very low | 164 Ų | 164 | 144.5 Ų | 144.5 | 81% | 0.808 | 82% | 0.822 | S | S | * | * | trans | -95.2 | 107.5 | 166.2 | -83.5 | -171.6 | 68.3 | 0 | 0 | 109.4 | ||||
| 288 | T | 46.2 | Very low | 41.3 | Very low | 120 Ų | 120 | 143.3 Ų | 143.3 | 74% | 0.736 | 82% | 0.815 | S | S | * | * | trans | -97.4 | 105.7 | 166.1 | 37.5 | 0 | 0 | 0 | 0 | 109.4 | R290 | T288-R290 PolarHBondContact O-N 2.98Š| ||
| 289 | L | 37.9 | Very low | 40.8 | Very low | 155 Ų | 155 | 146.6 Ų | 146.6 | 81% | 0.812 | 82% | 0.82 | S | S | * | * | trans | -77.3 | 112.5 | 166.1 | -79.4 | 160.7 | 0 | 0 | 0 | 108.3 | S291 | L289-S291 PolarHBondContact O-N 3.43Š| ||
| 290 | R | 39.5 | Very low | 40.7 | Very low | 252 Ų | 252 | 150.2 Ų | 150.2 | 95% | 0.951 | 82% | 0.817 | S | S | * | * | trans | -77.6 | 94.4 | 172.7 | -77.7 | -177.2 | 177.1 | -128.4 | 1.7 | 109.6 | T288 | T288-R290 PolarHBondContact O-N 2.98Š| ||
| 291 | S | 41.3 | Very low | 40.5 | Very low | 104 Ų | 104 | 147 Ų | 147 | 73% | 0.727 | 81% | 0.814 | S | S | * | * | trans | -102.9 | 131.1 | 149.6 | 64.6 | 0 | 0 | 0 | 0 | 108.2 | L289 | L289-S291 PolarHBondContact O-N 3.43Š| ||
| 292 | G | 36.1 | Very low | 40.2 | Very low | 71 Ų | 71 | 151.6 Ų | 151.6 | 73% | 0.732 | 82% | 0.824 | S | S | * | * | S | Bend | trans | -55.8 | 161 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||
| 293 | V | 44.5 | Very low | 40.4 | Very low | 148 Ų | 148 | 146.7 Ų | 146.7 | 90% | 0.897 | 82% | 0.816 | S | S | * | * | S | Bend | trans | 88.3 | 112 | -173.2 | -161.8 | 0 | 0 | 0 | 0 | 112.7 | ||
| 294 | G | 36.3 | Very low | 39.9 | Very low | 85 Ų | 85 | 142.6 Ų | 142.6 | 88% | 0.876 | 81% | 0.808 | S | S | * | * | trans | -60 | 140.3 | -162.4 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 295 | A | 40 | Very low | 39.8 | Very low | 95 Ų | 95 | 146 Ų | 146 | 79% | 0.785 | 81% | 0.809 | S | S | * | * | trans | -132 | 124.4 | 170.1 | 0 | 0 | 0 | 0 | 0 | 110 | A297 | A295-A297 PolarHBondContact O-N 3.4Š| ||
| 296 | R | 41 | Very low | 40 | Very low | 248 Ų | 248 | 141.1 Ų | 141.1 | 94% | 0.936 | 81% | 0.805 | S | S | * | * | trans | -56.5 | 124.2 | 164.4 | -91.3 | 172.9 | 161.7 | 167.4 | -5.9 | 108.7 | L298 | R296-L298 PolarHBondContact O-N 3.46Å; R296-L298 VanDerWaalsContact O-N 3.08Å | ||
| 297 | A | 39.1 | Very low | 40.1 | Very low | 98 Ų | 98 | 145.5 Ų | 145.5 | 81% | 0.81 | 81% | 0.814 | S | S | * | * | trans | -65.1 | 106.5 | 173.2 | 0 | 0 | 0 | 0 | 0 | 110.4 | A295 | A295-A297 PolarHBondContact O-N 3.4Š| ||
| 298 | L | 39.9 | Very low | 40.7 | Very low | 142 Ų | 142 | 149.1 Ų | 149.1 | 74% | 0.743 | 82% | 0.819 | S | S | * | * | trans | -81.3 | 108.7 | 161.7 | -81.6 | 165.2 | 0 | 0 | 0 | 107.7 | R296 Y300 | R296-L298 PolarHBondContact O-N 3.46Å; R296-L298 VanDerWaalsContact O-N 3.08Å; L298-Y300 HydrophobicContact CB-CD2 4.37Å; L298-Y300 HydrophobicContact CB-CE2 4.31Å; L298-Y300 PolarHBondContact O-N 3.44Å | ||
| 299 | R | 38.8 | Very low | 40.7 | Very low | 244 Ų | 244 | 149.3 Ų | 149.3 | 92% | 0.921 | 82% | 0.822 | S | S | * | * | trans | -75.7 | 112.2 | 168.5 | -64.4 | -171.9 | -157.9 | -167.6 | 5 | 108.3 | ||||
| 300 | Y | 44 | Very low | 41.4 | Very low | 186 Ų | 186 | 151.8 Ų | 151.8 | 73% | 0.729 | 83% | 0.827 | S | S | * | * | trans | -102.6 | 112.9 | 161.2 | -85.2 | -85.3 | 0 | 0 | 0 | 108.3 | L298 | L298-Y300 HydrophobicContact CB-CD2 4.37Å; L298-Y300 HydrophobicContact CB-CE2 4.31Å; L298-Y300 PolarHBondContact O-N 3.44Å | ||
| 301 | A | 43.4 | Very low | 42 | Very low | 97 Ų | 97 | 149.6 Ų | 149.6 | 80% | 0.802 | 82% | 0.824 | S | S | * | * | trans | -85.5 | 110.7 | 165.4 | 0 | 0 | 0 | 0 | 0 | 107.8 | S303 | A301-S303 PolarHBondContact O-N 2.96Š| ||
| 302 | F | 37.9 | Very low | 42.8 | Very low | 197 Ų | 197 | 149.5 Ų | 149.5 | 86% | 0.864 | 83% | 0.83 | S | S | * | * | trans | -77.9 | 97.9 | 160.5 | -84.1 | -87 | 0 | 0 | 0 | 107.2 | S304 | F302-S304 PolarHBondContact O-N 2.95Š| ||
| 303 | S | 41.8 | Very low | 43.9 | Very low | 105 Ų | 105 | 157.7 Ų | 157.7 | 73% | 0.734 | 84% | 0.839 | S | S | * | * | trans | -81.8 | 91.5 | 170.3 | -171.6 | 0 | 0 | 0 | 0 | 108.5 | A301 D305 | A301-S303 PolarHBondContact O-N 2.96Å; S303-D305 VanDerWaalsContact C-N 3.28Å; S303-D305 PolarHBondContact O-N 3.06Å | ||
| 304 | S | 40.5 | Very low | 44.2 | Very low | 107 Ų | 107 | 162.3 Ų | 162.3 | 75% | 0.748 | 84% | 0.84 | S | S | * | * | trans | -88.5 | 70.3 | 163.9 | 50.7 | 0 | 0 | 0 | 0 | 108.7 | F302 | F302-S304 PolarHBondContact O-N 2.95Š| ||
| 305 | D | 42.9 | Very low | 45.1 | Very low | 146 Ų | 146 | 171.9 Ų | 171.9 | 78% | 0.781 | 86% | 0.857 | S | S | * | * | trans | -174.2 | 148.3 | 160.6 | -95.9 | -35.1 | 0 | 0 | 0 | 111.3 | S303 | S303-D305 VanDerWaalsContact C-N 3.28Å; S303-D305 PolarHBondContact O-N 3.06Å | ||
| 306 | A | 39.2 | Very low | 45.3 | Very low | 98 Ų | 98 | 175.8 Ų | 175.8 | 81% | 0.81 | 86% | 0.861 | S | S | * | * | trans | 89 | 67.2 | 167 | 0 | 0 | 0 | 0 | 0 | 119.6 | ||||
| 307 | Q | 39 | Very low | 45.5 | Very low | 193 Ų | 193 | 171.9 Ų | 171.9 | 90% | 0.902 | 86% | 0.857 | S | S | * | * | trans | -116.9 | 93.9 | 139.7 | -84.4 | -172.4 | -8 | 0 | 0 | 110.5 | ||||
| 308 | R | 45.1 | Very low | 45.9 | Very low | 240 Ų | 240 | 176.1 Ų | 176.1 | 91% | 0.906 | 86% | 0.86 | S | S | * | * | trans | -139.6 | 105.2 | 150.4 | -93.9 | -168.9 | 172 | -140.8 | -0.5 | 109.2 | K310 | R308-K310 PolarHBondContact O-N 3.49Š| ||
| 309 | P | 47.4 | Very low | 46.2 | Very low | 124 Ų | 124 | 178.1 Ų | 178.1 | 81% | 0.805 | 87% | 0.866 | S | S | * | * | trans | -71.9 | 124.9 | 172.8 | 27.2 | -29.1 | 0 | 0 | 0 | 109.7 | K311 | P309-K311 PolarHBondContact O-N 3.18Š| ||
| 310 | K | 51 | Low | 46.7 | Very low | 207 Ų | 207 | 173.9 Ų | 173.9 | 90% | 0.9 | 86% | 0.863 | S | S | * | * | trans | -62.9 | 121.9 | 171.5 | -70.4 | -179.7 | 178.5 | 176.2 | 0 | 109.1 | R308 A312 | R308-K310 PolarHBondContact O-N 3.49Å; K310-A312 PolarHBondContact O-N 2.86Å; K310-A312 VanDerWaalsContact O-N 3.16Å | ||
| 311 | K | 53.7 | Low | 46.9 | Very low | 206 Ų | 206 | 173.1 Ų | 173.1 | 90% | 0.896 | 87% | 0.872 | S | S | * | * | trans | -65.2 | 107 | 167.1 | -69.6 | -178.9 | 179.6 | -179.2 | 0 | 108.7 | P309 R313 | P309-K311 PolarHBondContact O-N 3.18Å; K311-R313 PolarHBondContact O-N 3.36Å | ||
| 312 | A | 57.3 | Low | 47.1 | Very low | 102 Ų | 102 | 178.6 Ų | 178.6 | 84% | 0.843 | 88% | 0.877 | S | S | * | * | P | Polyproline II helix | trans | -73 | 117.7 | 162.8 | 0 | 0 | 0 | 0 | 0 | 108.4 | K310 | K310-A312 PolarHBondContact O-N 2.86Å; K310-A312 VanDerWaalsContact O-N 3.16Å |
| 313 | R | 59.8 | Low | 47.9 | Very low | 244 Ų | 244 | 177.2 Ų | 177.2 | 92% | 0.921 | 88% | 0.878 | S | S | * | * | P | Polyproline II helix | trans | -94.1 | 126.5 | 176.8 | -160.2 | 177.1 | 160.8 | -166.3 | -6.7 | 107.6 | K311 | K311-R313 PolarHBondContact O-N 3.36Š|
| 314 | R | 50.5 | Low | 48.4 | Very low | 245 Ų | 245 | 183.2 Ų | 183.2 | 93% | 0.925 | 89% | 0.89 | S | S | * | * | P | Polyproline II helix | trans | -54.7 | 134.8 | 175.7 | -75.1 | 174.7 | 161.1 | -175.4 | -6.7 | 112.1 | ||
| 315 | K | 53.9 | Low | 49.1 | Very low | 286 Ų | 286 | 190.1 Ų | 190.1 | 100% | 1.243 | 90% | 0.903 | S | S | * | * | trans | -138.4 | 0 | 137.8 | -99.4 | -171.1 | 177.3 | -176.4 | 0 | 107 |
Retrieved 315 of 315 residues in 212.9 ms
(Link to these results)