| 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 | 48.4 | Very low | 75.3 | Confident | 206 Ų | 206 | 97.7 Ų | 97.7 | 100% | 1.015 | 53% | 0.528 | S | S | * | . | 0 | 139.7 | 0 | -76.2 | 166.9 | -171 | 0 | 0 | 105.8 | E3 | M1-E3 PolarHBondContact O-N 2.87Å; M1-E3 VanDerWaalsContact O-N 3.08Å | |||
| 2 | A | 51.8 | Low | 76.2 | Confident | 52 Ų | 52 | 95.9 Ų | 95.9 | 43% | 0.43 | 52% | 0.518 | S | S | . | . | trans | -64.7 | 112.2 | 169.8 | 0 | 0 | 0 | 0 | 0 | 106.1 | F117 | A2-F117 HydrophobicContact CB-CD2 4.1Å; A2-F117 WeakPolarHBondContact O-CD2 3.29Å; A2-F117 WeakPolarHBondContact O-CE2 3.48Å | ||
| 3 | E | 62 | Low | 77.3 | Confident | 144 Ų | 144 | 96.5 Ų | 96.5 | 67% | 0.673 | 52% | 0.515 | S | S | * | . | trans | -102.3 | 126 | 179.1 | -76.8 | 174.5 | -171.1 | 0 | 0 | 107 | M1 G5 | M1-E3 PolarHBondContact O-N 2.87Å; M1-E3 VanDerWaalsContact O-N 3.08Å; E3-G5 PolarHBondContact O-N 3.1Å | ||
| 4 | L | 72.6 | Confident | 78.3 | Confident | 56 Ų | 56 | 92.9 Ų | 92.9 | 29% | 0.293 | 50% | 0.498 | S | S | . | . | trans | -69.9 | 12.5 | 178.8 | -70.2 | 165.6 | 0 | 0 | 0 | 112.9 | L6 V14 V114 F117 | L4-L6 HydrophobicContact CB-CD1 4.23Å; L4-L6 HydrophobicContact CB-CG 4.18Å; L4-L6 PolarHBondContact O-N 3.05Å; L4-V14 HydrophobicContact CD1-CG1 3.81Å; L4-V114 HydrophobicContact CD2-CG2 4.06Å; L4-F117 HydrophobicContact CD1-CD1 3.65Å; L4-F117 HydrophobicContact CD1-CE1 3.62Å; L4-F117 HydrophobicContact CD1-CG 4.23Å; L4-F117 HydrophobicContact CD1-CZ 4.19Å; L4-F117 HydrophobicContact CG-CD1 4.16Å; L4-F117 HydrophobicContact CG-CE1 4.36Å; L4-F117 HydrophobicContact CG-CG 4.24Å | ||
| 5 | G | 77.1 | Confident | 79 | Confident | 75 Ų | 75 | 87.6 Ų | 87.6 | 77% | 0.773 | 47% | 0.47 | S | S | * | . | S | Bend | trans | 67.3 | 16.5 | -174.3 | 0 | 0 | 0 | 0 | 0 | 114.1 | E3 | E3-G5 PolarHBondContact O-N 3.1Š|
| 6 | L | 83.1 | Confident | 79.7 | Confident | 76 Ų | 76 | 87.3 Ų | 87.3 | 40% | 0.398 | 47% | 0.468 | S | S | . | . | trans | -99.6 | 157.1 | -178.3 | -61.7 | 178.9 | 0 | 0 | 0 | 111.4 | L4 H10 Q11 V14 | L4-L6 HydrophobicContact CB-CD1 4.23Å; L4-L6 HydrophobicContact CB-CG 4.18Å; L4-L6 PolarHBondContact O-N 3.05Å; L6-H10 HydrophobicContact CB-CB 4.21Å; L6-H10 HydrophobicContact CD1-CB 4.44Å; L6-Q11 HydrophobicContact CB-CB 4.47Å; L6-V14 HydrophobicContact CD1-CG2 3.79Å | ||
| 7 | N | 87.8 | Confident | 80.5 | Confident | 85 Ų | 85 | 86.4 Ų | 86.4 | 46% | 0.455 | 46% | 0.457 | S | S | . | . | trans | -66.9 | 159.4 | 169.4 | 72.5 | 32.8 | 0 | 0 | 0 | 110.9 | H9 H10 Q11 | N7-H9 VanDerWaalsContact C-N 3.28Å; N7-H9 PolarHBondContact O-N 2.78Å; N7-H9 PolarHBondContact OD1-N 3.48Å; N7-H10 PolarHBondContact ND2-CE1 2.85Å; N7-H10 VanDerWaalsContact ND2-CE1 3.33Å; N7-H10 PolarHBondContact ND2-ND1 3.27Å; N7-H10 VanDerWaalsContact ND2-ND1 3.17Å; N7-H10 PolarHBondContact O-N 3.18Å; N7-H10 VanDerWaalsContact O-N 3.15Å; N7-H10 VanDerWaalsContact OD1-CB 3.28Å; N7-H10 WeakPolarHBondContact OD1-CB 3.48Å; N7-H10 PolarHBondContact OD1-N 2.75Å; N7-H10 PolarHBondContact OD1-ND1 3.05Å; N7-Q11 WeakPolarHBondContact O-CB 3.42Å; N7-Q11 PolarHBondContact O-N 3.16Å | ||
| 8 | E | 85 | Confident | 81.1 | Confident | 134 Ų | 134 | 83 Ų | 83 | 63% | 0.626 | 44% | 0.439 | S | S | * | . | H | α-helix | trans | -55.8 | -40.3 | -175.2 | -173.5 | -178.5 | 180 | 0 | 0 | 113 | Q11 N12 | E8-Q11 PolarHBondContact O-N 3.36Å; E8-N12 WeakPolarHBondContact O-CB 3.35Å; E8-N12 VanDerWaalsContact O-CG 3.31Å; E8-N12 PolarHBondContact O-N 3.17Å; E8-N12 PolarHBondContact O-ND2 2.99Å; E8-N12 VanDerWaalsContact O-ND2 3.08Å |
| 9 | H | 85 | Confident | 81.6 | Confident | 120 Ų | 120 | 85.8 Ų | 85.8 | 56% | 0.556 | 44% | 0.442 | S | S | * | . | H | α-helix | trans | -62.5 | -51 | 177.6 | 175.6 | -94.5 | 0 | 0 | 0 | 111.8 | N7 Q11 N12 E13 | N7-H9 VanDerWaalsContact C-N 3.28Å; N7-H9 PolarHBondContact O-N 2.78Å; N7-H9 PolarHBondContact OD1-N 3.48Å; H9-Q11 VanDerWaalsContact C-N 3.33Å; H9-Q11 PolarHBondContact O-N 2.8Å; H9-N12 PolarHBondContact O-N 2.75Å; H9-E13 PolarHBondContact O-N 3.15Å |
| 10 | H | 86.9 | Confident | 82.2 | Confident | 95 Ų | 95 | 86.3 Ų | 86.3 | 44% | 0.44 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -68.4 | -33.5 | 179.2 | -63.5 | 159.4 | 0 | 0 | 0 | 111.9 | L6 N7 E13 V14 | L6-H10 HydrophobicContact CB-CB 4.21Å; L6-H10 HydrophobicContact CD1-CB 4.44Å; N7-H10 PolarHBondContact ND2-CE1 2.85Å; N7-H10 VanDerWaalsContact ND2-CE1 3.33Å; N7-H10 PolarHBondContact ND2-ND1 3.27Å; N7-H10 VanDerWaalsContact ND2-ND1 3.17Å; N7-H10 PolarHBondContact O-N 3.18Å; N7-H10 VanDerWaalsContact O-N 3.15Å; N7-H10 VanDerWaalsContact OD1-CB 3.28Å; N7-H10 WeakPolarHBondContact OD1-CB 3.48Å; N7-H10 PolarHBondContact OD1-N 2.75Å; N7-H10 PolarHBondContact OD1-ND1 3.05Å; H10-E13 PolarHBondContact O-N 3.21Å; H10-V14 VanDerWaalsContact O-CG2 3.28Å; H10-V14 WeakPolarHBondContact O-CG2 3.47Å; H10-V14 PolarHBondContact O-N 2.83Å |
| 11 | Q | 88.4 | Confident | 82.7 | Confident | 32 Ų | 32 | 83.6 Ų | 83.6 | 15% | 0.15 | 43% | 0.432 | C | S | . | . | H | α-helix | trans | -63 | -43.4 | 173.3 | -173.9 | 167.9 | -3.1 | 0 | 0 | 111 | L6 N7 E8 H9 V14 I15 F117 | L6-Q11 HydrophobicContact CB-CB 4.47Å; N7-Q11 WeakPolarHBondContact O-CB 3.42Å; N7-Q11 PolarHBondContact O-N 3.16Å; E8-Q11 PolarHBondContact O-N 3.36Å; H9-Q11 VanDerWaalsContact C-N 3.33Å; H9-Q11 PolarHBondContact O-N 2.8Å; Q11-V14 PolarHBondContact O-N 2.79Å; Q11-I15 HydrophobicContact CG-CD1 4.19Å; Q11-I15 VanDerWaalsContact O-CG1 3.25Å; Q11-I15 WeakPolarHBondContact O-CG1 3.26Å; Q11-I15 PolarHBondContact O-N 3.42Å; Q11-F117 HydrophobicContact CG-CZ 4.21Å |
| 12 | N | 86.9 | Confident | 84.7 | Confident | 76 Ų | 76 | 79.4 Ų | 79.4 | 41% | 0.406 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -62.5 | -42.3 | 174.3 | -75.8 | -38.2 | 0 | 0 | 0 | 112.4 | E8 H9 V14 I15 N16 | E8-N12 WeakPolarHBondContact O-CB 3.35Å; E8-N12 VanDerWaalsContact O-CG 3.31Å; E8-N12 PolarHBondContact O-N 3.17Å; E8-N12 PolarHBondContact O-ND2 2.99Å; E8-N12 VanDerWaalsContact O-ND2 3.08Å; H9-N12 PolarHBondContact O-N 2.75Å; N12-V14 PolarHBondContact O-N 3.34Å; N12-I15 PolarHBondContact O-N 2.82Å; N12-N16 VanDerWaalsContact O-CG 3.29Å; N12-N16 PolarHBondContact O-N 3.19Å; N12-N16 PolarHBondContact O-ND2 3.42Å |
| 13 | E | 90 | Very high | 86.6 | Confident | 104 Ų | 104 | 81 Ų | 81 | 49% | 0.486 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -62.6 | -41.4 | 175.3 | -72.5 | -55.9 | 120.3 | 0 | 0 | 112.4 | H9 H10 N16 Y17 | H9-E13 PolarHBondContact O-N 3.15Å; H10-E13 PolarHBondContact O-N 3.21Å; E13-N16 WeakPolarHBondContact O-CB 3.3Å; E13-N16 PolarHBondContact O-N 3.5Å; E13-Y17 PolarHBondContact O-N 2.95Å |
| 14 | V | 90.8 | Very high | 88 | Confident | 46 Ų | 46 | 78.2 Ų | 78.2 | 28% | 0.279 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -64.3 | -41 | 174.9 | 171.6 | 0 | 0 | 0 | 0 | 111.3 | L4 L6 H10 Q11 N12 N16 Y17 M18 | L4-V14 HydrophobicContact CD1-CG1 3.81Å; L6-V14 HydrophobicContact CD1-CG2 3.79Å; H10-V14 VanDerWaalsContact O-CG2 3.28Å; H10-V14 WeakPolarHBondContact O-CG2 3.47Å; H10-V14 PolarHBondContact O-N 2.83Å; Q11-V14 PolarHBondContact O-N 2.79Å; N12-V14 PolarHBondContact O-N 3.34Å; V14-N16 PolarHBondContact O-N 2.81Å; V14-Y17 PolarHBondContact O-N 2.84Å; V14-M18 HydrophobicContact CG1-CE 3.73Å; V14-M18 WeakPolarHBondContact O-CG 3.29Å; V14-M18 PolarHBondContact O-N 2.8Å |
| 15 | I | 90 | Very high | 89 | Confident | 13 Ų | 13 | 81.4 Ų | 81.4 | 7% | 0.067 | 41% | 0.407 | C | S | . | . | H | α-helix | trans | -60.2 | -44.5 | 173.8 | -69.2 | 163.7 | 0 | 0 | 0 | 111.1 | Q11 N12 Y17 M18 R19 F117 E121 | Q11-I15 HydrophobicContact CG-CD1 4.19Å; Q11-I15 VanDerWaalsContact O-CG1 3.25Å; Q11-I15 WeakPolarHBondContact O-CG1 3.26Å; Q11-I15 PolarHBondContact O-N 3.42Å; N12-I15 PolarHBondContact O-N 2.82Å; I15-Y17 PolarHBondContact O-N 3.35Å; I15-M18 HydrophobicContact CG1-CE 4.22Å; I15-M18 PolarHBondContact O-N 3.39Å; I15-R19 WeakPolarHBondContact O-CG 3.39Å; I15-R19 PolarHBondContact O-N 2.8Å; I15-F117 HydrophobicContact CD1-CZ 4.11Å; I15-F117 HydrophobicContact CG1-CE1 3.89Å; I15-F117 HydrophobicContact CG1-CZ 3.98Å; I15-E121 HydrophobicContact CD1-CG 4.45Å; I15-E121 HydrophobicContact CG1-CG 4.3Å |
| 16 | N | 90 | Very high | 89.7 | Confident | 82 Ų | 82 | 79.4 Ų | 79.4 | 44% | 0.439 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -60 | -46.5 | 177.6 | -72.3 | -26.6 | 0 | 0 | 0 | 111.4 | N12 E13 V14 R19 F20 | N12-N16 VanDerWaalsContact O-CG 3.29Å; N12-N16 PolarHBondContact O-N 3.19Å; N12-N16 PolarHBondContact O-ND2 3.42Å; E13-N16 WeakPolarHBondContact O-CB 3.3Å; E13-N16 PolarHBondContact O-N 3.5Å; V14-N16 PolarHBondContact O-N 2.81Å; N16-R19 PolarHBondContact O-N 3.47Å; N16-F20 PolarHBondContact O-N 3.03Å |
| 17 | Y | 93.6 | Very high | 90.2 | Very high | 73 Ų | 73 | 80.2 Ų | 80.2 | 29% | 0.286 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -63 | -43.2 | 176.2 | 175.1 | -97.3 | 0 | 0 | 0 | 112.1 | E13 V14 I15 R19 F20 A21 N80 L83 | E13-Y17 PolarHBondContact O-N 2.95Å; V14-Y17 PolarHBondContact O-N 2.84Å; I15-Y17 PolarHBondContact O-N 3.35Å; Y17-R19 PolarHBondContact O-N 2.91Å; Y17-F20 HydrophobicContact CD2-CD1 4.4Å; Y17-F20 HydrophobicContact CE2-CD1 4.42Å; Y17-F20 WeakPolarHBondContact O-CB 3.39Å; Y17-F20 PolarHBondContact O-N 3.32Å; Y17-A21 HydrophobicContact CE1-CB 4.42Å; Y17-A21 WeakPolarHBondContact O-CB 3.23Å; Y17-A21 PolarHBondContact O-N 2.84Å; Y17-N80 PolarHBondContact OH-OD1 2.86Å; Y17-L83 HydrophobicContact CD1-CD2 4.49Å; Y17-L83 HydrophobicContact CD2-CD2 3.82Å; Y17-L83 HydrophobicContact CE2-CD2 3.81Å; Y17-L83 HydrophobicContact CG-CD2 4.16Å |
| 18 | M | 90.9 | Very high | 90.4 | Very high | 25 Ų | 25 | 79.2 Ų | 79.2 | 12% | 0.123 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -61.8 | -40.9 | 176.5 | -78.4 | -171.4 | -71.9 | 0 | 0 | 112.6 | V14 I15 F20 A21 R22 V114 F117 E118 | V14-M18 HydrophobicContact CG1-CE 3.73Å; V14-M18 WeakPolarHBondContact O-CG 3.29Å; V14-M18 PolarHBondContact O-N 2.8Å; I15-M18 HydrophobicContact CG1-CE 4.22Å; I15-M18 PolarHBondContact O-N 3.39Å; M18-F20 VanDerWaalsContact C-N 3.34Å; M18-F20 PolarHBondContact O-N 3.09Å; M18-A21 PolarHBondContact O-N 2.86Å; M18-R22 VanDerWaalsContact O-CB 3.28Å; M18-R22 WeakPolarHBondContact O-CB 3.13Å; M18-R22 PolarHBondContact O-N 3.3Å; M18-V114 HydrophobicContact SD-CG1 4.42Å; M18-F117 HydrophobicContact CE-CD1 3.34Å; M18-F117 HydrophobicContact CE-CE1 3.23Å; M18-F117 HydrophobicContact SD-CD1 4.1Å; M18-E118 HydrophobicContact SD-CB 4.26Å |
| 19 | R | 90.6 | Very high | 90.8 | Very high | 136 Ų | 136 | 78 Ų | 78 | 51% | 0.513 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -61.9 | -43.2 | 174.7 | -71.9 | 175.9 | -174.8 | 172 | 4.6 | 111.5 | I15 N16 Y17 S23 | I15-R19 WeakPolarHBondContact O-CG 3.39Å; I15-R19 PolarHBondContact O-N 2.8Å; N16-R19 PolarHBondContact O-N 3.47Å; Y17-R19 PolarHBondContact O-N 2.91Å; R19-S23 WeakPolarHBondContact O-CB 3.31Å; R19-S23 PolarHBondContact O-N 3.35Å |
| 20 | F | 92.8 | Very high | 91.3 | Very high | 95 Ų | 95 | 79 Ų | 79 | 42% | 0.417 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -59.9 | -51.6 | 174.2 | 165.9 | -93.9 | 0 | 0 | 0 | 111.6 | N16 Y17 M18 R22 S23 K24 T79 | N16-F20 PolarHBondContact O-N 3.03Å; Y17-F20 HydrophobicContact CD2-CD1 4.4Å; Y17-F20 HydrophobicContact CE2-CD1 4.42Å; Y17-F20 WeakPolarHBondContact O-CB 3.39Å; Y17-F20 PolarHBondContact O-N 3.32Å; M18-F20 VanDerWaalsContact C-N 3.34Å; M18-F20 PolarHBondContact O-N 3.09Å; F20-R22 VanDerWaalsContact C-N 3.32Å; F20-R22 PolarHBondContact O-N 2.91Å; F20-S23 PolarHBondContact O-N 2.92Å; F20-K24 HydrophobicContact CD2-CG 4.44Å; F20-K24 HydrophobicContact CE1-CG 4.1Å; F20-K24 HydrophobicContact CE2-CD 4.43Å; F20-K24 HydrophobicContact CE2-CG 4.01Å; F20-K24 HydrophobicContact CZ-CD 4.33Å; F20-K24 HydrophobicContact CZ-CG 3.82Å; F20-K24 WeakPolarHBondContact O-CG 3.45Å; F20-K24 PolarHBondContact O-N 2.84Å; F20-T79 HydrophobicContact CE1-CG2 3.98Å; F20-T79 HydrophobicContact CZ-CG2 4.49Å |
| 21 | A | 92.5 | Very high | 91.7 | Very high | 30 Ų | 30 | 76.4 Ų | 76.4 | 25% | 0.248 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -60.3 | -41.7 | -179.7 | 0 | 0 | 0 | 0 | 0 | 111.5 | Y17 M18 K24 R25 | Y17-A21 HydrophobicContact CE1-CB 4.42Å; Y17-A21 WeakPolarHBondContact O-CB 3.23Å; Y17-A21 PolarHBondContact O-N 2.84Å; M18-A21 PolarHBondContact O-N 2.86Å; A21-K24 PolarHBondContact O-N 3.46Å; A21-R25 WeakPolarHBondContact O-CB 3.24Å; A21-R25 PolarHBondContact O-N 3.42Å |
| 22 | R | 90.8 | Very high | 92.1 | Very high | 118 Ų | 118 | 76.4 Ų | 76.4 | 45% | 0.445 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -63.3 | -44.6 | 174.8 | -178.8 | 175.9 | 179.3 | -145.6 | 2.7 | 112.5 | M18 F20 K24 R25 G26 I122 | M18-R22 VanDerWaalsContact O-CB 3.28Å; M18-R22 WeakPolarHBondContact O-CB 3.13Å; M18-R22 PolarHBondContact O-N 3.3Å; F20-R22 VanDerWaalsContact C-N 3.32Å; F20-R22 PolarHBondContact O-N 2.91Å; R22-K24 VanDerWaalsContact C-N 3.29Å; R22-K24 PolarHBondContact O-N 3.24Å; R22-R25 PolarHBondContact O-N 2.87Å; R22-G26 PolarHBondContact O-N 3.46Å; R22-I122 VanDerWaalsContact CZ-CD1 3.47Å; R22-I122 VanDerWaalsContact NH1-CG1 3.3Å |
| 23 | S | 91.1 | Very high | 92.5 | Very high | 87 Ų | 87 | 77.9 Ų | 77.9 | 61% | 0.608 | 38% | 0.381 | S | S | * | . | H | α-helix | trans | -61.7 | -40.4 | 176.9 | -174.2 | 0 | 0 | 0 | 0 | 111.4 | R19 F20 G26 L27 | R19-S23 WeakPolarHBondContact O-CB 3.31Å; R19-S23 PolarHBondContact O-N 3.35Å; F20-S23 PolarHBondContact O-N 2.92Å; S23-G26 PolarHBondContact O-N 3.4Å; S23-L27 PolarHBondContact O-N 3.33Å; S23-L27 VanDerWaalsContact O-N 3.08Å |
| 24 | K | 92.4 | Very high | 92.8 | Very high | 85 Ų | 85 | 75.8 Ų | 75.8 | 37% | 0.37 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -63 | -51 | 174.6 | -73.6 | -71.3 | -173.8 | 172.8 | 0 | 111.2 | F20 A21 R22 G26 L27 R28 | F20-K24 HydrophobicContact CD2-CG 4.44Å; F20-K24 HydrophobicContact CE1-CG 4.1Å; F20-K24 HydrophobicContact CE2-CD 4.43Å; F20-K24 HydrophobicContact CE2-CG 4.01Å; F20-K24 HydrophobicContact CZ-CD 4.33Å; F20-K24 HydrophobicContact CZ-CG 3.82Å; F20-K24 WeakPolarHBondContact O-CG 3.45Å; F20-K24 PolarHBondContact O-N 2.84Å; A21-K24 PolarHBondContact O-N 3.46Å; R22-K24 VanDerWaalsContact C-N 3.29Å; R22-K24 PolarHBondContact O-N 3.24Å; K24-G26 VanDerWaalsContact C-N 3.27Å; K24-G26 PolarHBondContact O-N 2.89Å; K24-L27 WeakPolarHBondContact O-CB 3.29Å; K24-L27 PolarHBondContact O-N 3.39Å; K24-R28 WeakPolarHBondContact O-CG 3.21Å; K24-R28 PolarHBondContact O-N 2.81Å |
| 25 | R | 92.9 | Very high | 93 | Very high | 123 Ų | 123 | 74.7 Ų | 74.7 | 46% | 0.464 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -51.9 | -45.6 | 174.7 | -176.2 | 171.5 | 62.9 | -143 | -1.6 | 111.9 | A21 R22 L27 R28 L29 E118 | A21-R25 WeakPolarHBondContact O-CB 3.24Å; A21-R25 PolarHBondContact O-N 3.42Å; R22-R25 PolarHBondContact O-N 2.87Å; R25-L27 PolarHBondContact O-N 3.34Å; R25-R28 PolarHBondContact O-N 3.28Å; R25-L29 WeakPolarHBondContact O-CG 3.36Å; R25-L29 PolarHBondContact O-N 2.93Å; R25-E118 IonicContact CZ-OE1 2.79Å; R25-E118 IonicContact NH1-OE1 3.91Å; R25-E118 IonicContact NH1-OE2 3.56Å; R25-E118 IonicContact NH2-OE1 3.98Å; R25-E118 PolarHBondContact NH2-OE1 3.47Å; R25-E118 IonicContact NH2-OE2 3.53Å |
| 26 | G | 92.8 | Very high | 93.2 | Very high | 33 Ų | 33 | 78.1 Ų | 78.1 | 34% | 0.34 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -63.5 | -37.8 | 177.3 | 0 | 0 | 0 | 0 | 0 | 114 | R22 S23 K24 K30 | R22-G26 PolarHBondContact O-N 3.46Å; S23-G26 PolarHBondContact O-N 3.4Å; K24-G26 VanDerWaalsContact C-N 3.27Å; K24-G26 PolarHBondContact O-N 2.89Å; G26-K30 WeakPolarHBondContact O-CG 3.24Å; G26-K30 PolarHBondContact O-N 3.47Å |
| 27 | L | 92.3 | Very high | 93.5 | Very high | 92 Ų | 92 | 78.2 Ų | 78.2 | 48% | 0.482 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -65.4 | -41.5 | 174.2 | -180 | 63.3 | 0 | 0 | 0 | 111.3 | S23 K24 R25 K30 T31 | S23-L27 PolarHBondContact O-N 3.33Å; S23-L27 VanDerWaalsContact O-N 3.08Å; K24-L27 WeakPolarHBondContact O-CB 3.29Å; K24-L27 PolarHBondContact O-N 3.39Å; R25-L27 PolarHBondContact O-N 3.34Å; L27-K30 WeakPolarHBondContact O-CB 3.35Å; L27-K30 PolarHBondContact O-N 3.43Å; L27-T31 PolarHBondContact O-N 2.92Å; L27-T31 PolarHBondContact O-OG1 3.07Å |
| 28 | R | 92.3 | Very high | 93.5 | Very high | 65 Ų | 65 | 79.2 Ų | 79.2 | 25% | 0.245 | 40% | 0.395 | C | S | . | . | H | α-helix | trans | -69 | -39.5 | -177.9 | -63 | -60.4 | -175.3 | -177.8 | 11.6 | 113.5 | K24 R25 K30 T31 V32 E68 E72 | K24-R28 WeakPolarHBondContact O-CG 3.21Å; K24-R28 PolarHBondContact O-N 2.81Å; R25-R28 PolarHBondContact O-N 3.28Å; R28-K30 VanDerWaalsContact C-N 3.26Å; R28-K30 PolarHBondContact O-N 3.34Å; R28-T31 WeakPolarHBondContact O-CB 3.48Å; R28-T31 PolarHBondContact O-N 2.92Å; R28-T31 VanDerWaalsContact O-N 3.13Å; R28-V32 PolarHBondContact O-N 3.3Å; R28-E68 IonicContact NH1-OE1 2.79Å; R28-E68 PolarHBondContact NH1-OE1 3.02Å; R28-E72 HydrophobicContact CB-CG 4.4Å; R28-E72 HydrophobicContact CG-CG 3.76Å; R28-E72 WeakPolarHBondContact CG-OE1 3.26Å; R28-E72 IonicContact CZ-OE2 2.68Å; R28-E72 IonicContact NE-OE1 2.82Å; R28-E72 IonicContact NE-OE2 3.22Å; R28-E72 PolarHBondContact NE-OE2 2.99Å; R28-E72 IonicContact NH2-OE2 3.06Å; R28-E72 PolarHBondContact NH2-OE2 2.9Å |
| 29 | L | 94.3 | Very high | 93.7 | Very high | 108 Ų | 108 | 79.4 Ų | 79.4 | 57% | 0.565 | 40% | 0.396 | S | S | * | . | H | α-helix | trans | -58.2 | -42 | 171.6 | -69 | 175.1 | 0 | 0 | 0 | 111.1 | R25 T31 V32 D33 | R25-L29 WeakPolarHBondContact O-CG 3.36Å; R25-L29 PolarHBondContact O-N 2.93Å; L29-T31 PolarHBondContact O-N 2.89Å; L29-V32 PolarHBondContact O-N 3.39Å; L29-D33 PolarHBondContact O-N 3.47Å |
| 30 | K | 95.9 | Very high | 93.8 | Very high | 141 Ų | 141 | 78.4 Ų | 78.4 | 61% | 0.613 | 40% | 0.395 | S | S | * | . | H | α-helix | trans | -63.6 | -39.6 | 174.4 | -68.7 | 176.9 | -179.9 | -175.4 | 0 | 112.8 | G26 L27 R28 V32 D33 S34 | G26-K30 WeakPolarHBondContact O-CG 3.24Å; G26-K30 PolarHBondContact O-N 3.47Å; L27-K30 WeakPolarHBondContact O-CB 3.35Å; L27-K30 PolarHBondContact O-N 3.43Å; R28-K30 VanDerWaalsContact C-N 3.26Å; R28-K30 PolarHBondContact O-N 3.34Å; K30-V32 VanDerWaalsContact C-N 3.32Å; K30-D33 PolarHBondContact O-N 3.48Å; K30-S34 WeakPolarHBondContact O-CB 3.46Å; K30-S34 PolarHBondContact O-N 3.24Å; K30-S34 PolarHBondContact O-OG 3.43Å |
| 31 | T | 94.7 | Very high | 93.8 | Very high | 41 Ų | 41 | 80 Ų | 80 | 25% | 0.252 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -61 | -43.7 | 175.7 | -56.6 | 0 | 0 | 0 | 0 | 111.1 | L27 R28 L29 S34 C35 E68 | L27-T31 PolarHBondContact O-N 2.92Å; L27-T31 PolarHBondContact O-OG1 3.07Å; R28-T31 WeakPolarHBondContact O-CB 3.48Å; R28-T31 PolarHBondContact O-N 2.92Å; R28-T31 VanDerWaalsContact O-N 3.13Å; L29-T31 PolarHBondContact O-N 2.89Å; T31-S34 WeakPolarHBondContact O-CB 3.33Å; T31-S34 PolarHBondContact O-N 3.39Å; T31-C35 PolarHBondContact O-N 3.11Å; T31-C35 PolarHBondContact O-SG 2.88Å; T31-E68 HydrophobicContact CG2-CG 3.91Å |
| 32 | V | 96.3 | Very high | 93.7 | Very high | 31 Ų | 31 | 81.9 Ų | 81.9 | 19% | 0.188 | 42% | 0.416 | C | S | . | . | H | α-helix | trans | -60.8 | -50.6 | 174.3 | 174.8 | 0 | 0 | 0 | 0 | 110.2 | R28 L29 K30 S34 C35 F36 V65 V69 | R28-V32 PolarHBondContact O-N 3.3Å; L29-V32 PolarHBondContact O-N 3.39Å; K30-V32 VanDerWaalsContact C-N 3.32Å; V32-S34 PolarHBondContact O-N 3.42Å; V32-C35 WeakPolarHBondContact O-CB 3.35Å; V32-C35 PolarHBondContact O-N 2.91Å; V32-F36 HydrophobicContact CG1-CD2 4.13Å; V32-F36 HydrophobicContact CG1-CE2 3.81Å; V32-F36 VanDerWaalsContact O-CD2 3.32Å; V32-F36 WeakPolarHBondContact O-CD2 3.35Å; V32-F36 PolarHBondContact O-N 2.87Å; V32-V65 HydrophobicContact CG1-CG1 4.24Å; V32-V69 HydrophobicContact CG2-CG2 4.48Å |
| 33 | D | 95.9 | Very high | 93.6 | Very high | 108 Ų | 108 | 84 Ų | 84 | 58% | 0.578 | 42% | 0.424 | S | S | * | . | H | α-helix | trans | -55.6 | -40.3 | 177.5 | -68.5 | -27.1 | 0 | 0 | 0 | 112 | L29 K30 F36 Q37 | L29-D33 PolarHBondContact O-N 3.47Å; K30-D33 PolarHBondContact O-N 3.48Å; D33-F36 PolarHBondContact O-N 3.01Å; D33-Q37 PolarHBondContact O-N 3.2Å |
| 34 | S | 95.6 | Very high | 93.4 | Very high | 60 Ų | 60 | 83.7 Ų | 83.7 | 42% | 0.42 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -61.5 | -41.8 | 174.3 | -71.3 | 0 | 0 | 0 | 0 | 112.2 | K30 T31 V32 F36 Q37 D38 | K30-S34 WeakPolarHBondContact O-CB 3.46Å; K30-S34 PolarHBondContact O-N 3.24Å; K30-S34 PolarHBondContact O-OG 3.43Å; T31-S34 WeakPolarHBondContact O-CB 3.33Å; T31-S34 PolarHBondContact O-N 3.39Å; V32-S34 PolarHBondContact O-N 3.42Å; S34-F36 VanDerWaalsContact C-N 3.28Å; S34-F36 PolarHBondContact O-N 3.49Å; S34-Q37 PolarHBondContact O-N 2.9Å; S34-Q37 VanDerWaalsContact O-N 3.09Å; S34-D38 WeakPolarHBondContact O-CB 3.4Å; S34-D38 PolarHBondContact O-N 3.33Å |
| 35 | C | 94.7 | Very high | 93.2 | Very high | 22 Ų | 22 | 84.9 Ų | 84.9 | 15% | 0.149 | 43% | 0.429 | C | S | . | . | H | α-helix | trans | -58.1 | -40.1 | 175.6 | -62.4 | 0 | 0 | 0 | 0 | 112.6 | T31 V32 L39 V64 V65 | T31-C35 PolarHBondContact O-N 3.11Å; T31-C35 PolarHBondContact O-SG 2.88Å; V32-C35 WeakPolarHBondContact O-CB 3.35Å; V32-C35 PolarHBondContact O-N 2.91Å; C35-L39 WeakPolarHBondContact O-CB 3.33Å; C35-L39 PolarHBondContact O-N 2.76Å; C35-L39 VanDerWaalsContact O-N 3.15Å; C35-V64 HydrophobicContact CB-CG1 4.32Å; C35-V65 HydrophobicContact CB-CG2 4.3Å |
| 36 | F | 95.8 | Very high | 92.9 | Very high | 85 Ų | 85 | 85.2 Ų | 85.2 | 37% | 0.373 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -69.1 | -38.8 | 175.7 | -77.5 | -97.2 | 0 | 0 | 0 | 111.9 | V32 D33 S34 K40 L61 V65 | V32-F36 HydrophobicContact CG1-CD2 4.13Å; V32-F36 HydrophobicContact CG1-CE2 3.81Å; V32-F36 VanDerWaalsContact O-CD2 3.32Å; V32-F36 WeakPolarHBondContact O-CD2 3.35Å; V32-F36 PolarHBondContact O-N 2.87Å; D33-F36 PolarHBondContact O-N 3.01Å; S34-F36 VanDerWaalsContact C-N 3.28Å; S34-F36 PolarHBondContact O-N 3.49Å; F36-K40 WeakPolarHBondContact O-CG 3.46Å; F36-K40 PolarHBondContact O-N 3.36Å; F36-L61 HydrophobicContact CD1-CD1 4.26Å; F36-L61 HydrophobicContact CD1-CD2 3.42Å; F36-L61 VanDerWaalsContact CD1-CD2 3.42Å; F36-L61 HydrophobicContact CD1-CG 4.31Å; F36-L61 HydrophobicContact CD2-CD1 4.4Å; F36-L61 HydrophobicContact CE1-CD1 4.4Å; F36-L61 HydrophobicContact CE1-CD2 3.27Å; F36-L61 HydrophobicContact CE1-CG 4.08Å; F36-L61 HydrophobicContact CG-CD1 4.25Å; F36-L61 HydrophobicContact CG-CD2 4.24Å; F36-L61 HydrophobicContact CZ-CD2 3.97Å; F36-L61 HydrophobicContact CZ-CG 4.31Å; F36-V65 HydrophobicContact CD2-CG2 4.25Å; F36-V65 HydrophobicContact CE2-CG1 4.46Å; F36-V65 HydrophobicContact CE2-CG2 3.6Å; F36-V65 HydrophobicContact CZ-CG2 4.11Å |
| 37 | Q | 95.4 | Very high | 92.5 | Very high | 85 Ų | 85 | 93.2 Ų | 93.2 | 40% | 0.397 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -68.2 | -44.6 | 178.7 | -170.5 | 59.9 | 24.8 | 0 | 0 | 111.6 | D33 S34 L39 K40 E41 | D33-Q37 PolarHBondContact O-N 3.2Å; S34-Q37 PolarHBondContact O-N 2.9Å; S34-Q37 VanDerWaalsContact O-N 3.09Å; Q37-L39 VanDerWaalsContact C-N 3.28Å; Q37-L39 PolarHBondContact O-N 3.25Å; Q37-K40 WeakPolarHBondContact O-CB 3.45Å; Q37-K40 PolarHBondContact O-N 3.16Å; Q37-K40 VanDerWaalsContact O-N 3.09Å; Q37-E41 WeakPolarHBondContact CG-OE1 3.36Å; Q37-E41 PolarHBondContact NE2-OE1 2.98Å; Q37-E41 WeakPolarHBondContact O-CG 3.48Å; Q37-E41 PolarHBondContact O-N 3.4Å |
| 38 | D | 94.3 | Very high | 92.5 | Very high | 94 Ų | 94 | 94.2 Ų | 94.2 | 50% | 0.503 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -59.6 | -39.8 | 176.5 | -66.7 | -15.4 | 0 | 0 | 0 | 110.9 | S34 S42 | S34-D38 WeakPolarHBondContact O-CB 3.4Å; S34-D38 PolarHBondContact O-N 3.33Å; D38-S42 WeakPolarHBondContact O-CB 3.45Å; D38-S42 PolarHBondContact O-N 3.3Å; D38-S42 PolarHBondContact O-OG 2.66Å |
| 39 | L | 94 | Very high | 92.5 | Very high | 29 Ų | 29 | 94.5 Ų | 94.5 | 15% | 0.152 | 48% | 0.477 | C | S | . | . | H | α-helix | trans | -64.5 | -45.7 | 174 | -170.8 | 86.1 | 0 | 0 | 0 | 111.8 | C35 Q37 E41 S42 R43 L44 V57 L61 | C35-L39 WeakPolarHBondContact O-CB 3.33Å; C35-L39 PolarHBondContact O-N 2.76Å; C35-L39 VanDerWaalsContact O-N 3.15Å; Q37-L39 VanDerWaalsContact C-N 3.28Å; Q37-L39 PolarHBondContact O-N 3.25Å; L39-E41 VanDerWaalsContact C-N 3.3Å; L39-E41 PolarHBondContact O-N 3.47Å; L39-S42 PolarHBondContact O-N 2.75Å; L39-R43 HydrophobicContact CD1-CB 4.27Å; L39-R43 HydrophobicContact CD1-CG 3.99Å; L39-R43 HydrophobicContact CG-CB 4.37Å; L39-R43 WeakPolarHBondContact O-CB 3.49Å; L39-R43 PolarHBondContact O-N 2.87Å; L39-L44 PolarHBondContact O-N 3.5Å; L39-V57 HydrophobicContact CD1-CG1 4.15Å; L39-V57 HydrophobicContact CD2-CG1 3.65Å; L39-V57 HydrophobicContact CG-CG1 4.07Å; L39-L61 HydrophobicContact CB-CD1 4.34Å; L39-L61 HydrophobicContact CD1-CB 4.41Å; L39-L61 HydrophobicContact CD2-CB 3.75Å; L39-L61 HydrophobicContact CD2-CD1 4.07Å; L39-L61 HydrophobicContact CD2-CD2 3.58Å; L39-L61 HydrophobicContact CD2-CG 3.98Å |
| 40 | K | 92.6 | Very high | 92.5 | Very high | 114 Ų | 114 | 92.9 Ų | 92.9 | 50% | 0.496 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -58.8 | -44.7 | 178.1 | -75 | 172.1 | -176.4 | 176 | 0 | 111.3 | F36 Q37 L44 | F36-K40 WeakPolarHBondContact O-CG 3.46Å; F36-K40 PolarHBondContact O-N 3.36Å; Q37-K40 WeakPolarHBondContact O-CB 3.45Å; Q37-K40 PolarHBondContact O-N 3.16Å; Q37-K40 VanDerWaalsContact O-N 3.09Å; K40-L44 HydrophobicContact CG-CD1 4Å; K40-L44 PolarHBondContact O-N 2.83Å |
| 41 | E | 92.9 | Very high | 92.5 | Very high | 128 Ų | 128 | 92.8 Ų | 92.8 | 60% | 0.598 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -73.1 | -29 | -178 | -68.7 | 178 | -168.8 | 0 | 0 | 113.2 | Q37 L39 V45 | Q37-E41 WeakPolarHBondContact CG-OE1 3.36Å; Q37-E41 PolarHBondContact NE2-OE1 2.98Å; Q37-E41 WeakPolarHBondContact O-CG 3.48Å; Q37-E41 PolarHBondContact O-N 3.4Å; L39-E41 VanDerWaalsContact C-N 3.3Å; L39-E41 PolarHBondContact O-N 3.47Å; E41-V45 WeakPolarHBondContact O-CG2 3.46Å |
| 42 | S | 91.6 | Very high | 92.5 | Very high | 71 Ų | 71 | 97 Ų | 97 | 50% | 0.497 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -100.1 | -28.6 | -174.6 | 64 | 0 | 0 | 0 | 0 | 115.5 | D38 L39 | D38-S42 WeakPolarHBondContact O-CB 3.45Å; D38-S42 PolarHBondContact O-N 3.3Å; D38-S42 PolarHBondContact O-OG 2.66Å; L39-S42 PolarHBondContact O-N 2.75Å |
| 43 | R | 87.2 | Confident | 92.4 | Very high | 162 Ų | 162 | 99.3 Ų | 99.3 | 61% | 0.611 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -120.8 | -25.5 | -171.6 | -66.6 | -75.9 | -173 | -111 | 2.1 | 113.6 | L39 V45 V57 | L39-R43 HydrophobicContact CD1-CB 4.27Å; L39-R43 HydrophobicContact CD1-CG 3.99Å; L39-R43 HydrophobicContact CG-CB 4.37Å; L39-R43 WeakPolarHBondContact O-CB 3.49Å; L39-R43 PolarHBondContact O-N 2.87Å; R43-V45 PolarHBondContact O-N 2.82Å; R43-V57 HydrophobicContact CB-CG2 4.29Å |
| 44 | L | 87.6 | Confident | 92.3 | Very high | 81 Ų | 81 | 97 Ų | 97 | 42% | 0.424 | 50% | 0.496 | S | S | . | . | trans | -101.3 | 52.9 | -179.9 | -66.6 | 168.8 | 0 | 0 | 0 | 111.8 | L39 K40 F49 | L39-L44 PolarHBondContact O-N 3.5Å; K40-L44 HydrophobicContact CG-CD1 4Å; K40-L44 PolarHBondContact O-N 2.83Å; L44-F49 HydrophobicContact CD2-CD2 4.45Å; L44-F49 HydrophobicContact CD2-CE1 4.39Å; L44-F49 HydrophobicContact CD2-CE2 3.86Å; L44-F49 HydrophobicContact CD2-CZ 3.86Å | ||
| 45 | V | 88.6 | Confident | 92.3 | Very high | 109 Ų | 109 | 96.6 Ų | 96.6 | 66% | 0.661 | 49% | 0.494 | S | S | * | . | trans | -97.7 | -22 | -177.4 | -170.9 | 0 | 0 | 0 | 0 | 112.3 | E41 R43 | E41-V45 WeakPolarHBondContact O-CG2 3.46Å; R43-V45 PolarHBondContact O-N 2.82Å | ||
| 46 | E | 86.7 | Confident | 92.3 | Very high | 130 Ų | 130 | 102.5 Ų | 102.5 | 61% | 0.607 | 52% | 0.519 | S | S | * | . | S | Bend | trans | -86.7 | 152.1 | -176.7 | -58.6 | -176.1 | -167.1 | 0 | 0 | 112.1 | F49 | E46-F49 HydrophobicContact CB-CE1 4.27Å; E46-F49 HydrophobicContact CB-CE2 4.32Å; E46-F49 HydrophobicContact CB-CZ 3.87Å; E46-F49 WeakPolarHBondContact O-CE2 3.15Å |
| 47 | E | 84.2 | Confident | 92.2 | Very high | 201 Ų | 201 | 99.7 Ų | 99.7 | 94% | 0.939 | 51% | 0.509 | S | S | * | . | S | Bend | trans | -79.6 | -21 | -178.6 | -68.5 | -175.2 | 170.8 | 0 | 0 | 113.4 | ||
| 48 | T | 91.3 | Very high | 92.2 | Very high | 113 Ų | 113 | 100.4 Ų | 100.4 | 69% | 0.693 | 52% | 0.515 | S | S | * | . | trans | -134.9 | 134.1 | -177.6 | 53.7 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 49 | F | 92.9 | Very high | 92.3 | Very high | 71 Ų | 71 | 100.8 Ų | 100.8 | 31% | 0.311 | 52% | 0.517 | S | S | . | . | trans | -126.7 | 146 | 176.2 | -67.2 | -86.6 | 0 | 0 | 0 | 111.2 | L44 E46 E53 V54 | L44-F49 HydrophobicContact CD2-CD2 4.45Å; L44-F49 HydrophobicContact CD2-CE1 4.39Å; L44-F49 HydrophobicContact CD2-CE2 3.86Å; L44-F49 HydrophobicContact CD2-CZ 3.86Å; E46-F49 HydrophobicContact CB-CE1 4.27Å; E46-F49 HydrophobicContact CB-CE2 4.32Å; E46-F49 HydrophobicContact CB-CZ 3.87Å; E46-F49 WeakPolarHBondContact O-CE2 3.15Å; F49-E53 HydrophobicContact CD1-CB 4.38Å; F49-V54 HydrophobicContact CB-CG2 3.55Å; F49-V54 HydrophobicContact CG-CG2 4.23Å | ||
| 50 | T | 94.8 | Very high | 92.3 | Very high | 74 Ų | 74 | 101.1 Ų | 101.1 | 45% | 0.454 | 53% | 0.527 | S | S | . | . | trans | -79.1 | 161.2 | 166.2 | 67.1 | 0 | 0 | 0 | 0 | 111 | D52 E53 V54 | T50-D52 VanDerWaalsContact C-N 3.25Å; T50-D52 PolarHBondContact O-N 2.77Å; T50-E53 WeakPolarHBondContact CB-OE2 3.32Å; T50-E53 WeakPolarHBondContact CG2-OE2 3.36Å; T50-E53 PolarHBondContact N-OE2 3.09Å; T50-E53 PolarHBondContact O-N 3.4Å; T50-E53 VanDerWaalsContact OG1-CG 3.23Å; T50-E53 WeakPolarHBondContact OG1-CG 3.23Å; T50-E53 PolarHBondContact OG1-N 2.8Å; T50-E53 PolarHBondContact OG1-OE2 3.4Å; T50-V54 WeakPolarHBondContact O-CG2 3.18Å; T50-V54 PolarHBondContact O-N 3.14Å; T50-V54 VanDerWaalsContact O-N 3.09Å | ||
| 51 | I | 94.9 | Very high | 92.5 | Very high | 139 Ų | 139 | 96.5 Ų | 96.5 | 71% | 0.713 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -61.9 | -37.1 | 178.9 | -63.7 | 170.7 | 0 | 0 | 0 | 111.1 | S55 | I51-S55 WeakPolarHBondContact O-CB 3.43Å; I51-S55 PolarHBondContact O-N 3.13Å; I51-S55 PolarHBondContact O-OG 3.39Å |
| 52 | D | 96.1 | Very high | 92.7 | Very high | 129 Ų | 129 | 96.5 Ų | 96.5 | 69% | 0.69 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -68.1 | -43 | -178.8 | -64.7 | -27.5 | 0 | 0 | 0 | 111.1 | T50 S55 E56 | T50-D52 VanDerWaalsContact C-N 3.25Å; T50-D52 PolarHBondContact O-N 2.77Å; D52-S55 WeakPolarHBondContact O-CB 3.49Å; D52-S55 PolarHBondContact O-N 3.48Å; D52-E56 PolarHBondContact O-N 3.1Å |
| 53 | E | 93.3 | Very high | 92.9 | Very high | 80 Ų | 80 | 96 Ų | 96 | 37% | 0.374 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -63.4 | -45.1 | 176 | -71.2 | 159.1 | 161.8 | 0 | 0 | 111.8 | F49 T50 S55 E56 V57 | F49-E53 HydrophobicContact CD1-CB 4.38Å; T50-E53 WeakPolarHBondContact CB-OE2 3.32Å; T50-E53 WeakPolarHBondContact CG2-OE2 3.36Å; T50-E53 PolarHBondContact N-OE2 3.09Å; T50-E53 PolarHBondContact O-N 3.4Å; T50-E53 VanDerWaalsContact OG1-CG 3.23Å; T50-E53 WeakPolarHBondContact OG1-CG 3.23Å; T50-E53 PolarHBondContact OG1-N 2.8Å; T50-E53 PolarHBondContact OG1-OE2 3.4Å; E53-S55 VanDerWaalsContact C-N 3.28Å; E53-S55 PolarHBondContact O-N 3.45Å; E53-E56 PolarHBondContact O-N 2.83Å; E53-V57 WeakPolarHBondContact O-CB 3.27Å; E53-V57 VanDerWaalsContact O-CG2 3.27Å; E53-V57 WeakPolarHBondContact O-CG2 3.21Å; E53-V57 PolarHBondContact O-N 3.35Å |
| 54 | V | 94.2 | Very high | 93.3 | Very high | 60 Ų | 60 | 92.2 Ų | 92.2 | 36% | 0.364 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -61.7 | -40.5 | 175.8 | 176.2 | 0 | 0 | 0 | 0 | 110.7 | F49 T50 V57 L58 | F49-V54 HydrophobicContact CB-CG2 3.55Å; F49-V54 HydrophobicContact CG-CG2 4.23Å; T50-V54 WeakPolarHBondContact O-CG2 3.18Å; T50-V54 PolarHBondContact O-N 3.14Å; T50-V54 VanDerWaalsContact O-N 3.09Å; V54-V57 PolarHBondContact O-N 2.87Å; V54-L58 HydrophobicContact CG1-CD1 4.03Å; V54-L58 HydrophobicContact CG1-CG 4.37Å; V54-L58 WeakPolarHBondContact O-CB 3.46Å; V54-L58 VanDerWaalsContact O-CG 3.3Å; V54-L58 WeakPolarHBondContact O-CG 3.32Å; V54-L58 PolarHBondContact O-N 2.9Å |
| 55 | S | 95.5 | Very high | 93.8 | Very high | 52 Ų | 52 | 89.6 Ų | 89.6 | 36% | 0.364 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -64.3 | -42.4 | 178.2 | -59.8 | 0 | 0 | 0 | 0 | 111.7 | I51 D52 E53 L58 N59 | I51-S55 WeakPolarHBondContact O-CB 3.43Å; I51-S55 PolarHBondContact O-N 3.13Å; I51-S55 PolarHBondContact O-OG 3.39Å; D52-S55 WeakPolarHBondContact O-CB 3.49Å; D52-S55 PolarHBondContact O-N 3.48Å; E53-S55 VanDerWaalsContact C-N 3.28Å; E53-S55 PolarHBondContact O-N 3.45Å; S55-L58 PolarHBondContact O-N 3.34Å; S55-N59 WeakPolarHBondContact O-CB 3.27Å; S55-N59 PolarHBondContact O-N 2.86Å; S55-N59 PolarHBondContact O-ND2 3.5Å; S55-N59 VanDerWaalsContact O-ND2 3.09Å |
| 56 | E | 94.5 | Very high | 94.2 | Very high | 146 Ų | 146 | 89.8 Ų | 89.8 | 68% | 0.682 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -63.4 | -44.7 | 175.5 | -171.7 | 179.1 | 175 | 0 | 0 | 111.8 | D52 E53 L58 N59 G60 | D52-E56 PolarHBondContact O-N 3.1Å; E53-E56 PolarHBondContact O-N 2.83Å; E56-L58 VanDerWaalsContact C-N 3.35Å; E56-L58 PolarHBondContact O-N 3.19Å; E56-N59 PolarHBondContact O-N 2.91Å; E56-G60 PolarHBondContact O-N 3.49Å |
| 57 | V | 94.2 | Very high | 94.7 | Very high | 25 Ų | 25 | 87.1 Ų | 87.1 | 15% | 0.152 | 48% | 0.479 | C | S | . | . | H | α-helix | trans | -59.9 | -44.1 | 177.1 | 168.7 | 0 | 0 | 0 | 0 | 111.3 | L39 R43 E53 V54 G60 L61 | L39-V57 HydrophobicContact CD1-CG1 4.15Å; L39-V57 HydrophobicContact CD2-CG1 3.65Å; L39-V57 HydrophobicContact CG-CG1 4.07Å; R43-V57 HydrophobicContact CB-CG2 4.29Å; E53-V57 WeakPolarHBondContact O-CB 3.27Å; E53-V57 VanDerWaalsContact O-CG2 3.27Å; E53-V57 WeakPolarHBondContact O-CG2 3.21Å; E53-V57 PolarHBondContact O-N 3.35Å; V54-V57 PolarHBondContact O-N 2.87Å; V57-G60 PolarHBondContact O-N 2.87Å; V57-L61 WeakPolarHBondContact O-CB 3.45Å; V57-L61 PolarHBondContact O-N 2.82Å |
| 58 | L | 95.3 | Very high | 95.2 | Very high | 101 Ų | 101 | 80 Ų | 80 | 53% | 0.529 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -67 | -42.4 | 177.5 | -71.4 | 175.6 | 0 | 0 | 0 | 112.4 | V54 S55 E56 G60 L61 Q62 | V54-L58 HydrophobicContact CG1-CD1 4.03Å; V54-L58 HydrophobicContact CG1-CG 4.37Å; V54-L58 WeakPolarHBondContact O-CB 3.46Å; V54-L58 VanDerWaalsContact O-CG 3.3Å; V54-L58 WeakPolarHBondContact O-CG 3.32Å; V54-L58 PolarHBondContact O-N 2.9Å; S55-L58 PolarHBondContact O-N 3.34Å; E56-L58 VanDerWaalsContact C-N 3.35Å; E56-L58 PolarHBondContact O-N 3.19Å; L58-G60 VanDerWaalsContact C-N 3.35Å; L58-L61 PolarHBondContact O-N 3.34Å; L58-Q62 WeakPolarHBondContact O-CB 3.29Å; L58-Q62 PolarHBondContact O-N 2.9Å |
| 59 | N | 96.3 | Very high | 95.4 | Very high | 102 Ų | 102 | 77.8 Ų | 77.8 | 55% | 0.545 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -63.9 | -41 | 177 | -72 | -28.6 | 0 | 0 | 0 | 111.6 | S55 E56 Q62 A63 | S55-N59 WeakPolarHBondContact O-CB 3.27Å; S55-N59 PolarHBondContact O-N 2.86Å; S55-N59 PolarHBondContact O-ND2 3.5Å; S55-N59 VanDerWaalsContact O-ND2 3.09Å; E56-N59 PolarHBondContact O-N 2.91Å; N59-Q62 PolarHBondContact O-N 2.91Å; N59-A63 PolarHBondContact O-N 3.33Å |
| 60 | G | 94.5 | Very high | 95.6 | Very high | 36 Ų | 36 | 79.1 Ų | 79.1 | 37% | 0.371 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -62.5 | -46.3 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | E56 V57 L58 Q62 A63 V64 | E56-G60 PolarHBondContact O-N 3.49Å; V57-G60 PolarHBondContact O-N 2.87Å; L58-G60 VanDerWaalsContact C-N 3.35Å; G60-Q62 PolarHBondContact O-N 3.3Å; G60-A63 PolarHBondContact O-N 2.91Å; G60-V64 WeakPolarHBondContact O-CG2 3.29Å; G60-V64 PolarHBondContact O-N 2.9Å; G60-V64 VanDerWaalsContact O-N 3.12Å |
| 61 | L | 95.7 | Very high | 95.6 | Very high | 16 Ų | 16 | 78 Ų | 78 | 8% | 0.084 | 44% | 0.435 | C | S | . | . | H | α-helix | trans | -61.7 | -43.7 | 175.6 | -179.5 | 60.6 | 0 | 0 | 0 | 112 | F36 L39 V57 L58 A63 V64 V65 | F36-L61 HydrophobicContact CD1-CD1 4.26Å; F36-L61 HydrophobicContact CD1-CD2 3.42Å; F36-L61 VanDerWaalsContact CD1-CD2 3.42Å; F36-L61 HydrophobicContact CD1-CG 4.31Å; F36-L61 HydrophobicContact CD2-CD1 4.4Å; F36-L61 HydrophobicContact CE1-CD1 4.4Å; F36-L61 HydrophobicContact CE1-CD2 3.27Å; F36-L61 HydrophobicContact CE1-CG 4.08Å; F36-L61 HydrophobicContact CG-CD1 4.25Å; F36-L61 HydrophobicContact CG-CD2 4.24Å; F36-L61 HydrophobicContact CZ-CD2 3.97Å; F36-L61 HydrophobicContact CZ-CG 4.31Å; L39-L61 HydrophobicContact CB-CD1 4.34Å; L39-L61 HydrophobicContact CD1-CB 4.41Å; L39-L61 HydrophobicContact CD2-CB 3.75Å; L39-L61 HydrophobicContact CD2-CD1 4.07Å; L39-L61 HydrophobicContact CD2-CD2 3.58Å; L39-L61 HydrophobicContact CD2-CG 3.98Å; V57-L61 WeakPolarHBondContact O-CB 3.45Å; V57-L61 PolarHBondContact O-N 2.82Å; L58-L61 PolarHBondContact O-N 3.34Å; L61-A63 VanDerWaalsContact C-N 3.31Å; L61-A63 PolarHBondContact O-N 3.29Å; L61-V64 PolarHBondContact O-N 3.44Å; L61-V65 HydrophobicContact CD1-CG2 3.81Å; L61-V65 HydrophobicContact CG-CG2 4.24Å; L61-V65 WeakPolarHBondContact O-CB 3.44Å; L61-V65 WeakPolarHBondContact O-CG2 3.45Å; L61-V65 PolarHBondContact O-N 3.49Å |
| 62 | Q | 96.8 | Very high | 95.5 | Very high | 128 Ų | 128 | 73.1 Ų | 73.1 | 60% | 0.598 | 41% | 0.409 | S | S | * | . | H | α-helix | trans | -57.5 | -45.3 | 176.4 | 180 | -177.9 | -13.5 | 0 | 0 | 111.1 | L58 N59 G60 H66 | L58-Q62 WeakPolarHBondContact O-CB 3.29Å; L58-Q62 PolarHBondContact O-N 2.9Å; N59-Q62 PolarHBondContact O-N 2.91Å; G60-Q62 PolarHBondContact O-N 3.3Å; Q62-H66 WeakPolarHBondContact O-CB 3.4Å; Q62-H66 PolarHBondContact O-N 2.95Å |
| 63 | A | 96.8 | Very high | 95.4 | Very high | 62 Ų | 62 | 72.6 Ų | 72.6 | 51% | 0.512 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -62.3 | -44 | 179.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | N59 G60 L61 S67 | N59-A63 PolarHBondContact O-N 3.33Å; G60-A63 PolarHBondContact O-N 2.91Å; L61-A63 VanDerWaalsContact C-N 3.31Å; L61-A63 PolarHBondContact O-N 3.29Å; A63-S67 WeakPolarHBondContact O-CB 3.43Å; A63-S67 PolarHBondContact O-N 3.37Å |
| 64 | V | 96.2 | Very high | 95.5 | Very high | 81 Ų | 81 | 72.1 Ų | 72.1 | 49% | 0.491 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -65.5 | -49.7 | 178.8 | 174.6 | 0 | 0 | 0 | 0 | 111.2 | C35 G60 L61 H66 S67 E68 | C35-V64 HydrophobicContact CB-CG1 4.32Å; G60-V64 WeakPolarHBondContact O-CG2 3.29Å; G60-V64 PolarHBondContact O-N 2.9Å; G60-V64 VanDerWaalsContact O-N 3.12Å; L61-V64 PolarHBondContact O-N 3.44Å; V64-H66 PolarHBondContact O-N 3.01Å; V64-S67 PolarHBondContact O-N 2.94Å; V64-E68 PolarHBondContact O-N 2.94Å |
| 65 | V | 96.9 | Very high | 95.5 | Very high | 26 Ų | 26 | 72 Ų | 72 | 16% | 0.158 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -64.4 | -41.6 | -179.8 | 173.7 | 0 | 0 | 0 | 0 | 110.9 | V32 C35 F36 L61 S67 E68 V69 | V32-V65 HydrophobicContact CG1-CG1 4.24Å; C35-V65 HydrophobicContact CB-CG2 4.3Å; F36-V65 HydrophobicContact CD2-CG2 4.25Å; F36-V65 HydrophobicContact CE2-CG1 4.46Å; F36-V65 HydrophobicContact CE2-CG2 3.6Å; F36-V65 HydrophobicContact CZ-CG2 4.11Å; L61-V65 HydrophobicContact CD1-CG2 3.81Å; L61-V65 HydrophobicContact CG-CG2 4.24Å; L61-V65 WeakPolarHBondContact O-CB 3.44Å; L61-V65 WeakPolarHBondContact O-CG2 3.45Å; L61-V65 PolarHBondContact O-N 3.49Å; V65-S67 VanDerWaalsContact C-N 3.33Å; V65-S67 PolarHBondContact O-N 2.98Å; V65-E68 PolarHBondContact O-N 3.44Å; V65-V69 HydrophobicContact CG1-CG2 4.28Å; V65-V69 WeakPolarHBondContact O-CB 3.39Å; V65-V69 VanDerWaalsContact O-CG2 3.3Å; V65-V69 WeakPolarHBondContact O-CG2 3.39Å; V65-V69 PolarHBondContact O-N 2.91Å |
| 66 | H | 97.4 | Very high | 95.4 | Very high | 114 Ų | 114 | 72.2 Ų | 72.2 | 53% | 0.528 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -58.9 | -46.1 | 175.6 | -176.2 | -75 | 0 | 0 | 0 | 111.2 | Q62 V64 E68 V69 E70 | Q62-H66 WeakPolarHBondContact O-CB 3.4Å; Q62-H66 PolarHBondContact O-N 2.95Å; V64-H66 PolarHBondContact O-N 3.01Å; H66-E68 PolarHBondContact O-N 3.12Å; H66-V69 PolarHBondContact O-N 2.9Å; H66-E70 IonicContact CE1-OE2 3.41Å; H66-E70 PolarHBondContact CE1-OE2 3.4Å; H66-E70 IonicContact ND1-OE2 3.52Å; H66-E70 VanDerWaalsContact O-CB 3.28Å; H66-E70 WeakPolarHBondContact O-CB 3.47Å; H66-E70 PolarHBondContact O-N 3.21Å |
| 67 | S | 96.4 | Very high | 95.4 | Very high | 74 Ų | 74 | 67.7 Ų | 67.7 | 52% | 0.517 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -62.3 | -41.8 | 179.1 | -175.6 | 0 | 0 | 0 | 0 | 112.5 | A63 V64 V65 S71 | A63-S67 WeakPolarHBondContact O-CB 3.43Å; A63-S67 PolarHBondContact O-N 3.37Å; V64-S67 PolarHBondContact O-N 2.94Å; V65-S67 VanDerWaalsContact C-N 3.33Å; V65-S67 PolarHBondContact O-N 2.98Å; S67-S71 VanDerWaalsContact O-CB 3.27Å; S67-S71 WeakPolarHBondContact O-CB 3.28Å; S67-S71 PolarHBondContact O-N 2.91Å |
| 68 | E | 95.1 | Very high | 95.6 | Very high | 50 Ų | 50 | 74 Ų | 74 | 23% | 0.234 | 41% | 0.411 | C | S | . | . | H | α-helix | trans | -67.1 | -42.9 | 177.5 | -174.6 | 61.2 | -156.7 | 0 | 0 | 111.6 | R28 T31 V64 V65 H66 S71 E72 | R28-E68 IonicContact NH1-OE1 2.79Å; R28-E68 PolarHBondContact NH1-OE1 3.02Å; T31-E68 HydrophobicContact CG2-CG 3.91Å; V64-E68 PolarHBondContact O-N 2.94Å; V65-E68 PolarHBondContact O-N 3.44Å; H66-E68 PolarHBondContact O-N 3.12Å; E68-S71 PolarHBondContact O-N 3.42Å; E68-E72 PolarHBondContact O-N 3.02Å |
| 69 | V | 95.8 | Very high | 95.6 | Very high | 67 Ų | 67 | 71.7 Ų | 71.7 | 41% | 0.406 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -64.5 | -46.2 | 177.6 | 171.9 | 0 | 0 | 0 | 0 | 111.1 | V32 V65 H66 S71 E72 L73 | V32-V69 HydrophobicContact CG2-CG2 4.48Å; V65-V69 HydrophobicContact CG1-CG2 4.28Å; V65-V69 WeakPolarHBondContact O-CB 3.39Å; V65-V69 VanDerWaalsContact O-CG2 3.3Å; V65-V69 WeakPolarHBondContact O-CG2 3.39Å; V65-V69 PolarHBondContact O-N 2.91Å; H66-V69 PolarHBondContact O-N 2.9Å; V69-S71 PolarHBondContact O-N 3.44Å; V69-E72 PolarHBondContact O-N 3.41Å; V69-L73 HydrophobicContact CG1-CD1 4.11Å; V69-L73 HydrophobicContact CG1-CG 4.38Å; V69-L73 WeakPolarHBondContact O-CG 3.39Å; V69-L73 PolarHBondContact O-N 3.4Å |
| 70 | E | 96.4 | Very high | 95.5 | Very high | 100 Ų | 100 | 69.7 Ų | 69.7 | 47% | 0.467 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -59.7 | -47.1 | 177.7 | -178.5 | 175.7 | -172.5 | 0 | 0 | 111.5 | H66 E72 L73 I74 | H66-E70 IonicContact CE1-OE2 3.41Å; H66-E70 PolarHBondContact CE1-OE2 3.4Å; H66-E70 IonicContact ND1-OE2 3.52Å; H66-E70 VanDerWaalsContact O-CB 3.28Å; H66-E70 WeakPolarHBondContact O-CB 3.47Å; H66-E70 PolarHBondContact O-N 3.21Å; E70-E72 VanDerWaalsContact C-N 3.27Å; E70-E72 PolarHBondContact O-N 2.97Å; E70-L73 PolarHBondContact O-N 2.77Å; E70-I74 HydrophobicContact CG-CD1 4.09Å; E70-I74 WeakPolarHBondContact O-CG1 3.23Å; E70-I74 PolarHBondContact O-N 2.85Å |
| 71 | S | 94.7 | Very high | 95.5 | Very high | 51 Ų | 51 | 72.6 Ų | 72.6 | 36% | 0.357 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -56.5 | -42 | 175.3 | -177.7 | 0 | 0 | 0 | 0 | 111.7 | S67 E68 V69 N75 | S67-S71 VanDerWaalsContact O-CB 3.27Å; S67-S71 WeakPolarHBondContact O-CB 3.28Å; S67-S71 PolarHBondContact O-N 2.91Å; E68-S71 PolarHBondContact O-N 3.42Å; V69-S71 PolarHBondContact O-N 3.44Å; S71-N75 WeakPolarHBondContact O-CB 3.22Å; S71-N75 VanDerWaalsContact O-CG 3.26Å; S71-N75 PolarHBondContact O-N 2.82Å; S71-N75 PolarHBondContact O-ND2 2.7Å |
| 72 | E | 93.5 | Very high | 95.5 | Very high | 35 Ų | 35 | 75.9 Ų | 75.9 | 16% | 0.164 | 42% | 0.418 | C | S | . | . | H | α-helix | trans | -71.3 | -38.4 | 178.5 | -179 | 60 | 179 | 0 | 0 | 113.7 | R28 E68 V69 E70 I74 N75 T76 | R28-E72 HydrophobicContact CB-CG 4.4Å; R28-E72 HydrophobicContact CG-CG 3.76Å; R28-E72 WeakPolarHBondContact CG-OE1 3.26Å; R28-E72 IonicContact CZ-OE2 2.68Å; R28-E72 IonicContact NE-OE1 2.82Å; R28-E72 IonicContact NE-OE2 3.22Å; R28-E72 PolarHBondContact NE-OE2 2.99Å; R28-E72 IonicContact NH2-OE2 3.06Å; R28-E72 PolarHBondContact NH2-OE2 2.9Å; E68-E72 PolarHBondContact O-N 3.02Å; V69-E72 PolarHBondContact O-N 3.41Å; E70-E72 VanDerWaalsContact C-N 3.27Å; E70-E72 PolarHBondContact O-N 2.97Å; E72-I74 VanDerWaalsContact C-N 3.3Å; E72-I74 PolarHBondContact O-N 2.75Å; E72-N75 PolarHBondContact O-N 2.99Å; E72-T76 WeakPolarHBondContact O-CB 3.36Å; E72-T76 PolarHBondContact O-N 3.42Å; E72-T76 PolarHBondContact O-OG1 3.21Å |
| 73 | L | 94.2 | Very high | 95.4 | Very high | 118 Ų | 118 | 72.5 Ų | 72.5 | 62% | 0.618 | 40% | 0.404 | S | S | * | . | H | α-helix | trans | -61.4 | -42.3 | 175.5 | -70.1 | 175.2 | 0 | 0 | 0 | 110.9 | V69 E70 T76 A77 | V69-L73 HydrophobicContact CG1-CD1 4.11Å; V69-L73 HydrophobicContact CG1-CG 4.38Å; V69-L73 WeakPolarHBondContact O-CG 3.39Å; V69-L73 PolarHBondContact O-N 3.4Å; E70-L73 PolarHBondContact O-N 2.77Å; L73-T76 PolarHBondContact O-N 3.48Å; L73-A77 PolarHBondContact O-N 2.82Å; L73-A77 VanDerWaalsContact O-N 3.1Å |
| 74 | I | 95.4 | Very high | 95.3 | Very high | 70 Ų | 70 | 73 Ų | 73 | 36% | 0.359 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -61.9 | -47.7 | 174.2 | -67.9 | 168.5 | 0 | 0 | 0 | 110.8 | E70 E72 T76 A77 Y78 | E70-I74 HydrophobicContact CG-CD1 4.09Å; E70-I74 WeakPolarHBondContact O-CG1 3.23Å; E70-I74 PolarHBondContact O-N 2.85Å; E72-I74 VanDerWaalsContact C-N 3.3Å; E72-I74 PolarHBondContact O-N 2.75Å; I74-T76 VanDerWaalsContact C-N 3.27Å; I74-T76 PolarHBondContact O-N 2.8Å; I74-A77 WeakPolarHBondContact O-CB 3.5Å; I74-A77 PolarHBondContact O-N 3.22Å; I74-Y78 HydrophobicContact CG2-CD2 3.89Å; I74-Y78 HydrophobicContact CG2-CE1 4.17Å; I74-Y78 HydrophobicContact CG2-CE2 3.33Å; I74-Y78 VanDerWaalsContact CG2-CZ 3.49Å; I74-Y78 PolarHBondContact O-N 2.79Å |
| 75 | N | 94.3 | Very high | 95.2 | Very high | 59 Ų | 59 | 77.8 Ų | 77.8 | 32% | 0.316 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -62.1 | -35.3 | 178.8 | -76.7 | -42.6 | 0 | 0 | 0 | 112.6 | S71 E72 Y78 T79 | S71-N75 WeakPolarHBondContact O-CB 3.22Å; S71-N75 VanDerWaalsContact O-CG 3.26Å; S71-N75 PolarHBondContact O-N 2.82Å; S71-N75 PolarHBondContact O-ND2 2.7Å; E72-N75 PolarHBondContact O-N 2.99Å; N75-Y78 PolarHBondContact O-N 2.92Å; N75-T79 WeakPolarHBondContact O-CB 3.38Å; N75-T79 PolarHBondContact O-N 3.41Å; N75-T79 PolarHBondContact O-OG1 2.85Å |
| 76 | T | 94.1 | Very high | 95 | Very high | 56 Ų | 56 | 81.7 Ų | 81.7 | 34% | 0.344 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -63.2 | -46.7 | 174.7 | -60.4 | 0 | 0 | 0 | 0 | 110.5 | E72 L73 I74 Y78 T79 N80 | E72-T76 WeakPolarHBondContact O-CB 3.36Å; E72-T76 PolarHBondContact O-N 3.42Å; E72-T76 PolarHBondContact O-OG1 3.21Å; L73-T76 PolarHBondContact O-N 3.48Å; I74-T76 VanDerWaalsContact C-N 3.27Å; I74-T76 PolarHBondContact O-N 2.8Å; T76-Y78 PolarHBondContact O-N 3.32Å; T76-T79 PolarHBondContact O-N 2.87Å; T76-N80 PolarHBondContact O-N 3.48Å; T76-N80 PolarHBondContact O-OD1 3.33Å |
| 77 | A | 94.4 | Very high | 94.7 | Very high | 50 Ų | 50 | 80.1 Ų | 80.1 | 41% | 0.413 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -59.5 | -47 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | L73 I74 T79 N80 V81 | L73-A77 PolarHBondContact O-N 2.82Å; L73-A77 VanDerWaalsContact O-N 3.1Å; I74-A77 WeakPolarHBondContact O-CB 3.5Å; I74-A77 PolarHBondContact O-N 3.22Å; A77-T79 PolarHBondContact O-N 2.87Å; A77-N80 PolarHBondContact O-N 3.25Å; A77-V81 WeakPolarHBondContact O-CG2 3.4Å; A77-V81 PolarHBondContact O-N 3.41Å |
| 78 | Y | 97.1 | Very high | 94.6 | Very high | 157 Ų | 157 | 80 Ų | 80 | 62% | 0.616 | 41% | 0.409 | S | S | * | . | H | α-helix | trans | -62.8 | -39.9 | 177.8 | -66.3 | -16.1 | 0 | 0 | 0 | 113.1 | I74 N75 T76 N80 V81 L82 | I74-Y78 HydrophobicContact CG2-CD2 3.89Å; I74-Y78 HydrophobicContact CG2-CE1 4.17Å; I74-Y78 HydrophobicContact CG2-CE2 3.33Å; I74-Y78 VanDerWaalsContact CG2-CZ 3.49Å; I74-Y78 PolarHBondContact O-N 2.79Å; N75-Y78 PolarHBondContact O-N 2.92Å; T76-Y78 PolarHBondContact O-N 3.32Å; Y78-N80 VanDerWaalsContact C-N 3.31Å; Y78-N80 PolarHBondContact O-N 2.81Å; Y78-V81 PolarHBondContact O-N 2.92Å; Y78-L82 WeakPolarHBondContact O-CB 3.47Å; Y78-L82 PolarHBondContact O-N 3.46Å |
| 79 | T | 95.4 | Very high | 94.3 | Very high | 54 Ų | 54 | 80.4 Ų | 80.4 | 33% | 0.331 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -62.4 | -41.6 | 176.1 | -59 | 0 | 0 | 0 | 0 | 111 | F20 N75 T76 A77 L82 L83 | F20-T79 HydrophobicContact CE1-CG2 3.98Å; F20-T79 HydrophobicContact CZ-CG2 4.49Å; N75-T79 WeakPolarHBondContact O-CB 3.38Å; N75-T79 PolarHBondContact O-N 3.41Å; N75-T79 PolarHBondContact O-OG1 2.85Å; T76-T79 PolarHBondContact O-N 2.87Å; A77-T79 PolarHBondContact O-N 2.87Å; T79-L82 PolarHBondContact O-N 3.49Å; T79-L83 PolarHBondContact O-N 3.4Å |
| 80 | N | 93.9 | Very high | 94 | Very high | 60 Ų | 60 | 82.9 Ų | 82.9 | 32% | 0.321 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -69.3 | -41.2 | 179.1 | -65.6 | -5.7 | 0 | 0 | 0 | 111.9 | Y17 T76 A77 Y78 L82 L83 L84 | Y17-N80 PolarHBondContact OH-OD1 2.86Å; T76-N80 PolarHBondContact O-N 3.48Å; T76-N80 PolarHBondContact O-OD1 3.33Å; A77-N80 PolarHBondContact O-N 3.25Å; Y78-N80 VanDerWaalsContact C-N 3.31Å; Y78-N80 PolarHBondContact O-N 2.81Å; N80-L82 VanDerWaalsContact C-N 3.28Å; N80-L82 PolarHBondContact O-N 2.89Å; N80-L83 WeakPolarHBondContact O-CB 3.47Å; N80-L83 PolarHBondContact O-N 3.46Å; N80-L84 WeakPolarHBondContact O-CG 3.5Å; N80-L84 PolarHBondContact O-N 3.49Å |
| 81 | V | 96 | Very high | 93.6 | Very high | 96 Ų | 96 | 78.5 Ų | 78.5 | 58% | 0.582 | 41% | 0.408 | S | S | * | . | H | α-helix | trans | -61.3 | -39.2 | 173.4 | 171.4 | 0 | 0 | 0 | 0 | 111 | A77 Y78 L84 R85 | A77-V81 WeakPolarHBondContact O-CG2 3.4Å; A77-V81 PolarHBondContact O-N 3.41Å; Y78-V81 PolarHBondContact O-N 2.92Å; V81-L84 PolarHBondContact O-N 3.35Å; V81-R85 WeakPolarHBondContact O-CB 3.41Å; V81-R85 PolarHBondContact O-N 3.33Å |
| 82 | L | 95.1 | Very high | 93.2 | Very high | 85 Ų | 85 | 82.7 Ų | 82.7 | 45% | 0.445 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -65 | -41.4 | 176.4 | -174.3 | 63.6 | 0 | 0 | 0 | 111.8 | Y78 T79 N80 R85 Q86 | Y78-L82 WeakPolarHBondContact O-CB 3.47Å; Y78-L82 PolarHBondContact O-N 3.46Å; T79-L82 PolarHBondContact O-N 3.49Å; N80-L82 VanDerWaalsContact C-N 3.28Å; N80-L82 PolarHBondContact O-N 2.89Å; L82-R85 PolarHBondContact O-N 2.84Å; L82-Q86 WeakPolarHBondContact O-CG 3.31Å; L82-Q86 PolarHBondContact O-N 2.82Å |
| 83 | L | 94.6 | Very high | 92.8 | Very high | 57 Ų | 57 | 88.9 Ų | 88.9 | 30% | 0.298 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -60.3 | -48.9 | 173.8 | 178.5 | 63.8 | 0 | 0 | 0 | 111.1 | Y17 T79 N80 R85 Q86 L87 | Y17-L83 HydrophobicContact CD1-CD2 4.49Å; Y17-L83 HydrophobicContact CD2-CD2 3.82Å; Y17-L83 HydrophobicContact CE2-CD2 3.81Å; Y17-L83 HydrophobicContact CG-CD2 4.16Å; T79-L83 PolarHBondContact O-N 3.4Å; N80-L83 WeakPolarHBondContact O-CB 3.47Å; N80-L83 PolarHBondContact O-N 3.46Å; L83-R85 VanDerWaalsContact C-N 3.32Å; L83-R85 PolarHBondContact O-N 2.92Å; L83-Q86 WeakPolarHBondContact O-CB 3.37Å; L83-Q86 PolarHBondContact O-N 3.4Å; L83-Q86 VanDerWaalsContact O-N 3.1Å; L83-L87 HydrophobicContact CG-CD1 4.33Å; L83-L87 WeakPolarHBondContact O-CG 3.48Å; L83-L87 PolarHBondContact O-N 3.21Å |
| 84 | L | 94.2 | Very high | 92.4 | Very high | 72 Ų | 72 | 92.2 Ų | 92.2 | 38% | 0.377 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -58.3 | -43.4 | 176.7 | -71.1 | 175.2 | 0 | 0 | 0 | 111.8 | N80 V81 Q86 L87 F88 | N80-L84 WeakPolarHBondContact O-CG 3.5Å; N80-L84 PolarHBondContact O-N 3.49Å; V81-L84 PolarHBondContact O-N 3.35Å; L84-Q86 VanDerWaalsContact C-N 3.31Å; L84-Q86 PolarHBondContact O-N 3.27Å; L84-L87 PolarHBondContact O-N 3.39Å; L84-F88 HydrophobicContact CB-CE2 4.2Å; L84-F88 HydrophobicContact CD2-CZ 4.47Å; L84-F88 WeakPolarHBondContact O-CD2 3.24Å; L84-F88 VanDerWaalsContact O-CG 3.31Å; L84-F88 WeakPolarHBondContact O-CG 3.37Å; L84-F88 PolarHBondContact O-N 2.85Å |
| 85 | R | 94.9 | Very high | 91.9 | Very high | 182 Ų | 182 | 99.1 Ų | 99.1 | 69% | 0.687 | 48% | 0.476 | S | S | * | . | H | α-helix | trans | -58 | -43.2 | 175 | -179.6 | -173 | 170.4 | -164.2 | -2 | 111.8 | V81 L82 L83 A89 | V81-R85 WeakPolarHBondContact O-CB 3.41Å; V81-R85 PolarHBondContact O-N 3.33Å; L82-R85 PolarHBondContact O-N 2.84Å; L83-R85 VanDerWaalsContact C-N 3.32Å; L83-R85 PolarHBondContact O-N 2.92Å; R85-A89 WeakPolarHBondContact O-CB 3.43Å; R85-A89 PolarHBondContact O-N 3.39Å |
| 86 | Q | 92.1 | Very high | 91.6 | Very high | 108 Ų | 108 | 101.3 Ų | 101.3 | 51% | 0.505 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -65.1 | -41.4 | 178.2 | -71.1 | 175.5 | 12.4 | 0 | 0 | 111.7 | L82 L83 L84 Q90 | L82-Q86 WeakPolarHBondContact O-CG 3.31Å; L82-Q86 PolarHBondContact O-N 2.82Å; L83-Q86 WeakPolarHBondContact O-CB 3.37Å; L83-Q86 PolarHBondContact O-N 3.4Å; L83-Q86 VanDerWaalsContact O-N 3.1Å; L84-Q86 VanDerWaalsContact C-N 3.31Å; L84-Q86 PolarHBondContact O-N 3.27Å; Q86-Q90 WeakPolarHBondContact O-CG 3.41Å; Q86-Q90 PolarHBondContact O-N 2.86Å |
| 87 | L | 92.2 | Very high | 91.3 | Very high | 81 Ų | 81 | 108.1 Ų | 108.1 | 42% | 0.424 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -64.8 | -44.8 | 176.4 | -66.7 | 174.9 | 0 | 0 | 0 | 111.7 | L83 L84 Q90 A91 | L83-L87 HydrophobicContact CG-CD1 4.33Å; L83-L87 WeakPolarHBondContact O-CG 3.48Å; L83-L87 PolarHBondContact O-N 3.21Å; L84-L87 PolarHBondContact O-N 3.39Å; L87-Q90 PolarHBondContact O-N 2.86Å; L87-A91 PolarHBondContact O-N 2.89Å |
| 88 | F | 92.5 | Very high | 91 | Very high | 73 Ų | 73 | 110.3 Ų | 110.3 | 32% | 0.32 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -66.8 | -38.6 | 178 | -64.4 | -28.6 | 0 | 0 | 0 | 112.6 | L84 Q90 A91 E92 L98 | L84-F88 HydrophobicContact CB-CE2 4.2Å; L84-F88 HydrophobicContact CD2-CZ 4.47Å; L84-F88 WeakPolarHBondContact O-CD2 3.24Å; L84-F88 VanDerWaalsContact O-CG 3.31Å; L84-F88 WeakPolarHBondContact O-CG 3.37Å; L84-F88 PolarHBondContact O-N 2.85Å; F88-Q90 VanDerWaalsContact C-N 3.26Å; F88-Q90 PolarHBondContact O-N 2.89Å; F88-A91 PolarHBondContact O-N 2.9Å; F88-A91 VanDerWaalsContact O-N 3.14Å; F88-E92 WeakPolarHBondContact O-CB 3.29Å; F88-E92 WeakPolarHBondContact O-CG 3.45Å; F88-E92 PolarHBondContact O-N 3.24Å; F88-L98 HydrophobicContact CD1-CB 4.17Å; F88-L98 HydrophobicContact CD1-CD1 4.17Å; F88-L98 HydrophobicContact CE1-CB 3.89Å; F88-L98 HydrophobicContact CE1-CD1 4.37Å |
| 89 | A | 90 | Very high | 90.5 | Very high | 57 Ų | 57 | 111.8 Ų | 111.8 | 47% | 0.471 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -60.8 | -37.1 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | R85 K93 | R85-A89 WeakPolarHBondContact O-CB 3.43Å; R85-A89 PolarHBondContact O-N 3.39Å; A89-K93 PolarHBondContact O-N 3.41Å |
| 90 | Q | 88.4 | Confident | 90.1 | Very high | 119 Ų | 119 | 113.6 Ų | 113.6 | 56% | 0.556 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -68.3 | -46.7 | 172.7 | -68.1 | 178.9 | 45.7 | 0 | 0 | 111 | Q86 L87 F88 E92 K93 | Q86-Q90 WeakPolarHBondContact O-CG 3.41Å; Q86-Q90 PolarHBondContact O-N 2.86Å; L87-Q90 PolarHBondContact O-N 2.86Å; F88-Q90 VanDerWaalsContact C-N 3.26Å; F88-Q90 PolarHBondContact O-N 2.89Å; Q90-E92 PolarHBondContact O-N 2.86Å; Q90-K93 WeakPolarHBondContact O-CB 3.16Å; Q90-K93 PolarHBondContact O-N 3.13Å |
| 91 | A | 88.9 | Confident | 89.8 | Confident | 9 Ų | 9 | 114.9 Ų | 114.9 | 7% | 0.074 | 55% | 0.547 | C | S | . | . | H | α-helix | trans | -59.7 | -42.9 | 179.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | L87 F88 K93 W94 Y95 L96 L98 | L87-A91 PolarHBondContact O-N 2.89Å; F88-A91 PolarHBondContact O-N 2.9Å; F88-A91 VanDerWaalsContact O-N 3.14Å; A91-K93 VanDerWaalsContact C-N 3.32Å; A91-K93 PolarHBondContact O-N 3.5Å; A91-W94 CarbonylContact O-C 3.58Å; A91-W94 WeakPolarHBondContact O-CA 3.13Å; A91-W94 PolarHBondContact O-N 2.76Å; A91-Y95 PolarHBondContact O-N 3.45Å; A91-Y95 VanDerWaalsContact O-N 3.11Å; A91-L96 HydrophobicContact CB-CB 4.13Å; A91-L96 PolarHBondContact O-N 3.1Å; A91-L98 HydrophobicContact CB-CD1 3.56Å; A91-L98 HydrophobicContact CB-CG 3.81Å |
| 92 | E | 85.4 | Confident | 89.4 | Confident | 139 Ų | 139 | 116.5 Ų | 116.5 | 65% | 0.65 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -61.6 | -38 | 177.8 | -77.1 | 179.5 | 174.2 | 0 | 0 | 112.3 | F88 Q90 W94 Y95 | F88-E92 WeakPolarHBondContact O-CB 3.29Å; F88-E92 WeakPolarHBondContact O-CG 3.45Å; F88-E92 PolarHBondContact O-N 3.24Å; Q90-E92 PolarHBondContact O-N 2.86Å; E92-W94 PolarHBondContact O-N 3.31Å; E92-Y95 PolarHBondContact O-N 3.03Å |
| 93 | K | 85.4 | Confident | 89 | Confident | 164 Ų | 164 | 117.1 Ų | 117.1 | 71% | 0.713 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -59.2 | -28.5 | 174.8 | -174 | 179.9 | 176.7 | -177.3 | 0 | 112.3 | A89 Q90 A91 | A89-K93 PolarHBondContact O-N 3.41Å; Q90-K93 WeakPolarHBondContact O-CB 3.16Å; Q90-K93 PolarHBondContact O-N 3.13Å; A91-K93 VanDerWaalsContact C-N 3.32Å; A91-K93 PolarHBondContact O-N 3.5Å |
| 94 | W | 87.2 | Confident | 88.6 | Confident | 189 Ų | 189 | 119.5 Ų | 119.5 | 72% | 0.716 | 57% | 0.572 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -101.6 | 11.5 | 176.8 | -61.6 | 100.8 | 0 | 0 | 0 | 112.9 | A91 E92 L96 | A91-W94 CarbonylContact O-C 3.58Å; A91-W94 WeakPolarHBondContact O-CA 3.13Å; A91-W94 PolarHBondContact O-N 2.76Å; E92-W94 PolarHBondContact O-N 3.31Å; W94-L96 HydrophobicContact CB-CD1 4.18Å; W94-L96 HydrophobicContact CB-CG 4.13Å; W94-L96 PolarHBondContact O-N 2.97Å |
| 95 | Y | 83.3 | Confident | 88.2 | Confident | 215 Ų | 215 | 121.7 Ų | 121.7 | 84% | 0.843 | 58% | 0.584 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 56.4 | 28.1 | -178.6 | -55.9 | -82.9 | 0 | 0 | 0 | 114.3 | A91 E92 | A91-Y95 PolarHBondContact O-N 3.45Å; A91-Y95 VanDerWaalsContact O-N 3.11Å; E92-Y95 PolarHBondContact O-N 3.03Å |
| 96 | L | 89.3 | Confident | 87.8 | Confident | 104 Ų | 104 | 121.5 Ų | 121.5 | 55% | 0.545 | 59% | 0.59 | S | S | . | * | trans | -87.1 | 134.6 | 177.1 | -63.4 | 174.1 | 0 | 0 | 0 | 110.4 | A91 W94 | A91-L96 HydrophobicContact CB-CB 4.13Å; A91-L96 PolarHBondContact O-N 3.1Å; W94-L96 HydrophobicContact CB-CD1 4.18Å; W94-L96 HydrophobicContact CB-CG 4.13Å; W94-L96 PolarHBondContact O-N 2.97Å | ||
| 97 | K | 86.6 | Confident | 87.7 | Confident | 200 Ų | 200 | 119.3 Ų | 119.3 | 87% | 0.87 | 58% | 0.582 | S | S | * | * | trans | -100.1 | 103.4 | 171.2 | -67.3 | -176 | 179.6 | -179.5 | 0 | 108.8 | ||||
| 98 | L | 88.4 | Confident | 87.6 | Confident | 96 Ų | 96 | 125.3 Ų | 125.3 | 50% | 0.503 | 60% | 0.599 | S | S | . | * | trans | -88.2 | 141.5 | 175.8 | -59.7 | -177.8 | 0 | 0 | 0 | 110 | F88 A91 | F88-L98 HydrophobicContact CD1-CB 4.17Å; F88-L98 HydrophobicContact CD1-CD1 4.17Å; F88-L98 HydrophobicContact CE1-CB 3.89Å; F88-L98 HydrophobicContact CE1-CD1 4.37Å; A91-L98 HydrophobicContact CB-CD1 3.56Å; A91-L98 HydrophobicContact CB-CG 3.81Å | ||
| 99 | Q | 86.8 | Confident | 87.4 | Confident | 187 Ų | 187 | 128.1 Ų | 128.1 | 87% | 0.874 | 61% | 0.613 | S | S | * | * | trans | -130.9 | 135.5 | 174.1 | -69.1 | -177.7 | -29.5 | 0 | 0 | 108.2 | ||||
| 100 | T | 87.3 | Confident | 87.2 | Confident | 92 Ų | 92 | 128.5 Ų | 128.5 | 56% | 0.564 | 61% | 0.607 | S | S | * | * | trans | -114.2 | 128.7 | 174.6 | 32.8 | 0 | 0 | 0 | 0 | 108.7 | I102 | T100-I102 PolarHBondContact O-N 3.29Š| ||
| 101 | D | 86.9 | Confident | 87.2 | Confident | 88 Ų | 88 | 127.5 Ų | 127.5 | 47% | 0.471 | 61% | 0.605 | S | S | . | * | trans | -79.8 | 108.5 | 171 | -167.6 | -12.1 | 0 | 0 | 0 | 109.3 | S103 E104 | D101-S103 PolarHBondContact O-N 3.12Å; D101-S103 WeakPolarHBondContact OD1-CB 3.29Å; D101-S103 PolarHBondContact OD1-N 2.86Å; D101-S103 PolarHBondContact OD1-OG 3.5Å; D101-E104 HydrophobicContact CB-CG 4.17Å; D101-E104 PolarHBondContact O-N 2.95Å | ||
| 102 | I | 88.6 | Confident | 87.3 | Confident | 129 Ų | 129 | 131.3 Ų | 131.3 | 66% | 0.662 | 62% | 0.621 | S | S | * | * | G | 310 helix | trans | -65.7 | -27.6 | -179.9 | -60.5 | 171.2 | 0 | 0 | 0 | 110.3 | T100 E104 L105 | T100-I102 PolarHBondContact O-N 3.29Å; I102-E104 PolarHBondContact O-N 3.36Å; I102-L105 HydrophobicContact CG2-CD1 4.28Å; I102-L105 WeakPolarHBondContact O-CB 3.47Å; I102-L105 PolarHBondContact O-N 2.85Å; I102-L105 VanDerWaalsContact O-N 3.15Å |
| 103 | S | 86.1 | Confident | 87.4 | Confident | 98 Ų | 98 | 129 Ų | 129 | 69% | 0.685 | 61% | 0.611 | S | S | * | * | G | 310 helix | trans | -64.7 | -27 | -178.5 | -34.5 | 0 | 0 | 0 | 0 | 112.2 | D101 | D101-S103 PolarHBondContact O-N 3.12Å; D101-S103 WeakPolarHBondContact OD1-CB 3.29Å; D101-S103 PolarHBondContact OD1-N 2.86Å; D101-S103 PolarHBondContact OD1-OG 3.5Å |
| 104 | E | 86.8 | Confident | 87.5 | Confident | 108 Ų | 108 | 124.3 Ų | 124.3 | 51% | 0.505 | 60% | 0.595 | S | S | . | * | G | 310 helix | trans | -81.8 | -14.9 | 179 | -65 | -166.9 | 154.1 | 0 | 0 | 113.3 | D101 I102 E106 N107 L110 | D101-E104 HydrophobicContact CB-CG 4.17Å; D101-E104 PolarHBondContact O-N 2.95Å; I102-E104 PolarHBondContact O-N 3.36Å; E104-E106 PolarHBondContact O-N 3.18Å; E104-N107 WeakPolarHBondContact O-CB 3.14Å; E104-N107 PolarHBondContact O-N 2.88Å; E104-L110 HydrophobicContact CB-CD1 4.09Å |
| 105 | L | 85.9 | Confident | 87.6 | Confident | 118 Ų | 118 | 116.8 Ų | 116.8 | 62% | 0.618 | 57% | 0.574 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.4 | -25.1 | -177.8 | -63.4 | 178.8 | 0 | 0 | 0 | 113.3 | I102 | I102-L105 HydrophobicContact CG2-CD1 4.28Å; I102-L105 WeakPolarHBondContact O-CB 3.47Å; I102-L105 PolarHBondContact O-N 2.85Å; I102-L105 VanDerWaalsContact O-N 3.15Å |
| 106 | E | 85.8 | Confident | 87.8 | Confident | 177 Ų | 177 | 112 Ų | 112 | 83% | 0.827 | 56% | 0.559 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -95.6 | 3.2 | 175.2 | -62.8 | -173.2 | 170.1 | 0 | 0 | 112.6 | E104 R108 | E104-E106 PolarHBondContact O-N 3.18Å; E106-R108 PolarHBondContact O-N 3.48Å |
| 107 | N | 91.3 | Very high | 87.7 | Confident | 62 Ų | 62 | 107.2 Ų | 107.2 | 33% | 0.332 | 53% | 0.533 | S | S | . | . | trans | -67.5 | 108.1 | 179.3 | -173.8 | -25.8 | 0 | 0 | 0 | 110.1 | E104 E109 L110 L111 | E104-N107 WeakPolarHBondContact O-CB 3.14Å; E104-N107 PolarHBondContact O-N 2.88Å; N107-E109 PolarHBondContact O-N 3.35Å; N107-E109 WeakPolarHBondContact OD1-CB 3.48Å; N107-E109 PolarHBondContact OD1-N 2.87Å; N107-L110 HydrophobicContact CB-CB 4.2Å; N107-L110 HydrophobicContact CB-CD1 3.94Å; N107-L110 HydrophobicContact CB-CG 4.05Å; N107-L110 PolarHBondContact O-N 2.94Å; N107-L111 WeakPolarHBondContact O-CG 3.41Å; N107-L111 PolarHBondContact O-N 2.9Å | ||
| 108 | R | 88.9 | Confident | 87.7 | Confident | 207 Ų | 207 | 99.5 Ų | 99.5 | 78% | 0.781 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -57.9 | -34.4 | -178.3 | -174.7 | 174.4 | 178.5 | 156.3 | 0.7 | 113.4 | E106 E112 | E106-R108 PolarHBondContact O-N 3.48Å; R108-E112 WeakPolarHBondContact O-CB 3.45Å; R108-E112 PolarHBondContact O-N 2.83Å |
| 109 | E | 88 | Confident | 87.6 | Confident | 133 Ų | 133 | 100.7 Ų | 100.7 | 62% | 0.621 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -68.4 | -46.1 | 179.2 | -170.7 | -179.8 | 172.2 | 0 | 0 | 110.9 | N107 L111 E112 Q113 | N107-E109 PolarHBondContact O-N 3.35Å; N107-E109 WeakPolarHBondContact OD1-CB 3.48Å; N107-E109 PolarHBondContact OD1-N 2.87Å; E109-L111 VanDerWaalsContact C-N 3.33Å; E109-L111 PolarHBondContact O-N 3.24Å; E109-E112 PolarHBondContact O-N 3.17Å; E109-Q113 WeakPolarHBondContact O-CG 3.35Å; E109-Q113 PolarHBondContact O-N 3.21Å |
| 110 | L | 86.6 | Confident | 87.5 | Confident | 64 Ų | 64 | 93.9 Ų | 93.9 | 34% | 0.335 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -63.7 | -39.7 | 176.7 | -63.5 | -179.9 | 0 | 0 | 0 | 111.6 | E104 N107 Q113 V114 | E104-L110 HydrophobicContact CB-CD1 4.09Å; N107-L110 HydrophobicContact CB-CB 4.2Å; N107-L110 HydrophobicContact CB-CD1 3.94Å; N107-L110 HydrophobicContact CB-CG 4.05Å; N107-L110 PolarHBondContact O-N 2.94Å; L110-Q113 PolarHBondContact O-N 2.94Å; L110-V114 WeakPolarHBondContact O-CG2 3.42Å; L110-V114 PolarHBondContact O-N 3.46Å |
| 111 | L | 89.2 | Confident | 87.2 | Confident | 99 Ų | 99 | 91.7 Ų | 91.7 | 52% | 0.518 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -64 | -40 | 175.2 | -69.3 | 173.8 | 0 | 0 | 0 | 112.3 | N107 E109 V114 A115 | N107-L111 WeakPolarHBondContact O-CG 3.41Å; N107-L111 PolarHBondContact O-N 2.9Å; E109-L111 VanDerWaalsContact C-N 3.33Å; E109-L111 PolarHBondContact O-N 3.24Å; L111-V114 PolarHBondContact O-N 2.85Å; L111-A115 WeakPolarHBondContact O-CB 3.34Å; L111-A115 PolarHBondContact O-N 2.91Å |
| 112 | E | 89.9 | Confident | 86.6 | Confident | 88 Ų | 88 | 89.4 Ų | 89.4 | 41% | 0.411 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -67 | -39.9 | 175.9 | -167.5 | 66.6 | -140.1 | 0 | 0 | 111.1 | R108 E109 V114 A115 E116 K119 | R108-E112 WeakPolarHBondContact O-CB 3.45Å; R108-E112 PolarHBondContact O-N 2.83Å; E109-E112 PolarHBondContact O-N 3.17Å; E112-V114 VanDerWaalsContact C-N 3.33Å; E112-V114 PolarHBondContact O-N 2.88Å; E112-A115 CarbonylContact O-C 3.59Å; E112-A115 WeakPolarHBondContact O-CB 3.47Å; E112-A115 PolarHBondContact O-N 2.92Å; E112-A115 VanDerWaalsContact O-N 3.1Å; E112-E116 WeakPolarHBondContact O-CG 3.25Å; E112-E116 PolarHBondContact O-N 2.83Å; E112-K119 IonicContact OE1-NZ 3.83Å |
| 113 | Q | 87.2 | Confident | 85.8 | Confident | 92 Ų | 92 | 88 Ų | 88 | 43% | 0.43 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -59.5 | -42.9 | 174.6 | -70.5 | 175 | 23 | 0 | 0 | 111.9 | E109 L110 A115 E116 F117 | E109-Q113 WeakPolarHBondContact O-CG 3.35Å; E109-Q113 PolarHBondContact O-N 3.21Å; L110-Q113 PolarHBondContact O-N 2.94Å; Q113-A115 VanDerWaalsContact C-N 3.34Å; Q113-E116 PolarHBondContact O-N 2.92Å; Q113-F117 WeakPolarHBondContact O-CB 3.28Å; Q113-F117 PolarHBondContact O-N 2.93Å |
| 114 | V | 88.5 | Confident | 84.9 | Confident | 65 Ų | 65 | 87 Ų | 87 | 39% | 0.394 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -64.9 | -38.8 | 174.4 | 174 | 0 | 0 | 0 | 0 | 111.1 | L4 M18 L110 L111 E112 F117 E118 | L4-V114 HydrophobicContact CD2-CG2 4.06Å; M18-V114 HydrophobicContact SD-CG1 4.42Å; L110-V114 WeakPolarHBondContact O-CG2 3.42Å; L110-V114 PolarHBondContact O-N 3.46Å; L111-V114 PolarHBondContact O-N 2.85Å; E112-V114 VanDerWaalsContact C-N 3.33Å; E112-V114 PolarHBondContact O-N 2.88Å; V114-F117 WeakPolarHBondContact O-CB 3.35Å; V114-F117 PolarHBondContact O-N 3.23Å; V114-E118 PolarHBondContact O-N 3.34Å |
| 115 | A | 87.6 | Confident | 83.5 | Confident | 31 Ų | 31 | 85.1 Ų | 85.1 | 26% | 0.256 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -66.9 | -41.1 | 177 | 0 | 0 | 0 | 0 | 0 | 112.5 | L111 E112 Q113 F117 E118 K119 | L111-A115 WeakPolarHBondContact O-CB 3.34Å; L111-A115 PolarHBondContact O-N 2.91Å; E112-A115 CarbonylContact O-C 3.59Å; E112-A115 WeakPolarHBondContact O-CB 3.47Å; E112-A115 PolarHBondContact O-N 2.92Å; E112-A115 VanDerWaalsContact O-N 3.1Å; Q113-A115 VanDerWaalsContact C-N 3.34Å; A115-F117 VanDerWaalsContact C-N 3.33Å; A115-E118 PolarHBondContact O-N 2.96Å; A115-K119 VanDerWaalsContact O-CG 3.27Å; A115-K119 WeakPolarHBondContact O-CG 3.43Å; A115-K119 PolarHBondContact O-N 2.86Å |
| 116 | E | 88.2 | Confident | 81.9 | Confident | 113 Ų | 113 | 85.8 Ų | 85.8 | 53% | 0.528 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -62.6 | -41.3 | 172.5 | -73.9 | -174.7 | 175.1 | 0 | 0 | 111.4 | E112 Q113 K119 A120 | E112-E116 WeakPolarHBondContact O-CG 3.25Å; E112-E116 PolarHBondContact O-N 2.83Å; Q113-E116 PolarHBondContact O-N 2.92Å; E116-K119 PolarHBondContact O-N 3.3Å; E116-A120 WeakPolarHBondContact O-CB 3.27Å; E116-A120 PolarHBondContact O-N 3.42Å |
| 117 | F | 86.5 | Confident | 80.1 | Confident | 4 Ų | 4 | 85.6 Ų | 85.6 | 2% | 0.018 | 44% | 0.438 | C | S | . | . | H | α-helix | trans | -61.3 | -47.7 | 174.3 | -176 | -106.8 | 0 | 0 | 0 | 112 | A2 L4 Q11 I15 M18 Q113 V114 A115 K119 A120 E121 | A2-F117 HydrophobicContact CB-CD2 4.1Å; A2-F117 WeakPolarHBondContact O-CD2 3.29Å; A2-F117 WeakPolarHBondContact O-CE2 3.48Å; L4-F117 HydrophobicContact CD1-CD1 3.65Å; L4-F117 HydrophobicContact CD1-CE1 3.62Å; L4-F117 HydrophobicContact CD1-CG 4.23Å; L4-F117 HydrophobicContact CD1-CZ 4.19Å; L4-F117 HydrophobicContact CG-CD1 4.16Å; L4-F117 HydrophobicContact CG-CE1 4.36Å; L4-F117 HydrophobicContact CG-CG 4.24Å; Q11-F117 HydrophobicContact CG-CZ 4.21Å; I15-F117 HydrophobicContact CD1-CZ 4.11Å; I15-F117 HydrophobicContact CG1-CE1 3.89Å; I15-F117 HydrophobicContact CG1-CZ 3.98Å; M18-F117 HydrophobicContact CE-CD1 3.34Å; M18-F117 HydrophobicContact CE-CE1 3.23Å; M18-F117 HydrophobicContact SD-CD1 4.1Å; Q113-F117 WeakPolarHBondContact O-CB 3.28Å; Q113-F117 PolarHBondContact O-N 2.93Å; V114-F117 WeakPolarHBondContact O-CB 3.35Å; V114-F117 PolarHBondContact O-N 3.23Å; A115-F117 VanDerWaalsContact C-N 3.33Å; F117-K119 VanDerWaalsContact C-N 3.32Å; F117-K119 PolarHBondContact O-N 3.41Å; F117-A120 PolarHBondContact O-N 3.38Å; F117-E121 HydrophobicContact CE1-CG 4.1Å; F117-E121 HydrophobicContact CE2-CG 4.36Å; F117-E121 HydrophobicContact CZ-CG 4Å; F117-E121 PolarHBondContact O-N 2.93Å |
| 118 | E | 87.1 | Confident | 77.5 | Confident | 39 Ų | 39 | 91.5 Ų | 91.5 | 18% | 0.182 | 46% | 0.461 | C | S | . | . | H | α-helix | trans | -56.6 | -46.1 | 175.3 | -169.5 | -171.9 | -176.7 | 0 | 0 | 110.6 | M18 R25 V114 A115 A120 E121 I122 | M18-E118 HydrophobicContact SD-CB 4.26Å; R25-E118 IonicContact CZ-OE1 2.79Å; R25-E118 IonicContact NH1-OE1 3.91Å; R25-E118 IonicContact NH1-OE2 3.56Å; R25-E118 IonicContact NH2-OE1 3.98Å; R25-E118 PolarHBondContact NH2-OE1 3.47Å; R25-E118 IonicContact NH2-OE2 3.53Å; V114-E118 PolarHBondContact O-N 3.34Å; A115-E118 PolarHBondContact O-N 2.96Å; E118-A120 PolarHBondContact O-N 3.37Å; E118-E121 PolarHBondContact O-N 3.24Å; E118-I122 HydrophobicContact CG-CD1 4.19Å; E118-I122 WeakPolarHBondContact O-CD1 3.33Å; E118-I122 WeakPolarHBondContact O-CG1 3.35Å; E118-I122 PolarHBondContact O-N 2.94Å |
| 119 | K | 86.5 | Confident | 75.3 | Confident | 121 Ų | 121 | 87.4 Ų | 87.4 | 53% | 0.526 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -62.5 | -40.6 | 177.7 | -71.2 | 167.4 | -172.1 | 164.1 | 0 | 112.7 | E112 A115 E116 F117 I122 T123 | E112-K119 IonicContact OE1-NZ 3.83Å; A115-K119 VanDerWaalsContact O-CG 3.27Å; A115-K119 WeakPolarHBondContact O-CG 3.43Å; A115-K119 PolarHBondContact O-N 2.86Å; E116-K119 PolarHBondContact O-N 3.3Å; F117-K119 VanDerWaalsContact C-N 3.32Å; F117-K119 PolarHBondContact O-N 3.41Å; K119-I122 PolarHBondContact O-N 2.87Å; K119-T123 PolarHBondContact O-N 2.87Å; K119-T123 VanDerWaalsContact O-N 3.13Å; K119-T123 PolarHBondContact O-OG1 3.03Å |
| 120 | A | 84.4 | Confident | 73 | Confident | 43 Ų | 43 | 88.2 Ų | 88.2 | 36% | 0.355 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -66.5 | -40.8 | 179.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | E116 F117 E118 I122 T123 S124 | E116-A120 WeakPolarHBondContact O-CB 3.27Å; E116-A120 PolarHBondContact O-N 3.42Å; F117-A120 PolarHBondContact O-N 3.38Å; E118-A120 PolarHBondContact O-N 3.37Å; A120-I122 VanDerWaalsContact C-N 3.32Å; A120-I122 PolarHBondContact O-N 3.49Å; A120-T123 PolarHBondContact O-N 2.82Å; A120-S124 PolarHBondContact O-N 2.93Å; A120-S124 PolarHBondContact O-OG 2.92Å |
| 121 | E | 81.6 | Confident | 70.9 | Confident | 47 Ų | 47 | 92.6 Ų | 92.6 | 22% | 0.22 | 49% | 0.491 | C | S | . | . | H | α-helix | trans | -62.5 | -39.4 | 175.3 | -81 | -61.6 | 108.5 | 0 | 0 | 112 | I15 F117 E118 S124 S125 | I15-E121 HydrophobicContact CD1-CG 4.45Å; I15-E121 HydrophobicContact CG1-CG 4.3Å; F117-E121 HydrophobicContact CE1-CG 4.1Å; F117-E121 HydrophobicContact CE2-CG 4.36Å; F117-E121 HydrophobicContact CZ-CG 4Å; F117-E121 PolarHBondContact O-N 2.93Å; E118-E121 PolarHBondContact O-N 3.24Å; E121-S124 PolarHBondContact O-N 3.25Å; E121-S125 WeakPolarHBondContact O-CB 3.44Å; E121-S125 PolarHBondContact O-N 3.29Å; E121-S125 PolarHBondContact O-OG 2.92Å |
| 122 | I | 73.4 | Confident | 68.4 | Low | 40 Ų | 40 | 94.2 Ų | 94.2 | 21% | 0.205 | 50% | 0.5 | C | S | . | . | H | α-helix | trans | -64.8 | -44.4 | 177.8 | -64.7 | 166.4 | 0 | 0 | 0 | 111.3 | R22 E118 K119 A120 S124 S125 N126 | R22-I122 VanDerWaalsContact CZ-CD1 3.47Å; R22-I122 VanDerWaalsContact NH1-CG1 3.3Å; E118-I122 HydrophobicContact CG-CD1 4.19Å; E118-I122 WeakPolarHBondContact O-CD1 3.33Å; E118-I122 WeakPolarHBondContact O-CG1 3.35Å; E118-I122 PolarHBondContact O-N 2.94Å; K119-I122 PolarHBondContact O-N 2.87Å; A120-I122 VanDerWaalsContact C-N 3.32Å; A120-I122 PolarHBondContact O-N 3.49Å; I122-S124 VanDerWaalsContact C-N 3.29Å; I122-S124 PolarHBondContact O-N 3.44Å; I122-S125 PolarHBondContact O-N 2.94Å; I122-N126 PolarHBondContact O-N 3.48Å |
| 123 | T | 73 | Confident | 66.3 | Low | 98 Ų | 98 | 97 Ų | 97 | 60% | 0.601 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -66.2 | -36.4 | -179 | -54.6 | 0 | 0 | 0 | 0 | 111.3 | K119 A120 | K119-T123 PolarHBondContact O-N 2.87Å; K119-T123 VanDerWaalsContact O-N 3.13Å; K119-T123 PolarHBondContact O-OG1 3.03Å; A120-T123 PolarHBondContact O-N 2.82Å |
| 124 | S | 66 | Low | 64 | Low | 78 Ų | 78 | 97.9 Ų | 97.9 | 55% | 0.545 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -69.4 | -33.9 | 176.2 | -58 | 0 | 0 | 0 | 0 | 112.4 | A120 E121 I122 | A120-S124 PolarHBondContact O-N 2.93Å; A120-S124 PolarHBondContact O-OG 2.92Å; E121-S124 PolarHBondContact O-N 3.25Å; I122-S124 VanDerWaalsContact C-N 3.29Å; I122-S124 PolarHBondContact O-N 3.44Å |
| 125 | S | 58.4 | Low | 61.8 | Low | 69 Ų | 69 | 103 Ų | 103 | 48% | 0.483 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -73.4 | -22.1 | 179.6 | -54.7 | 0 | 0 | 0 | 0 | 114.4 | E121 I122 | E121-S125 WeakPolarHBondContact O-CB 3.44Å; E121-S125 PolarHBondContact O-N 3.29Å; E121-S125 PolarHBondContact O-OG 2.92Å; I122-S125 PolarHBondContact O-N 2.94Å |
| 126 | N | 52 | Low | 59.7 | Low | 131 Ų | 131 | 107.5 Ų | 107.5 | 70% | 0.701 | 57% | 0.572 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.9 | -1.4 | -177.1 | -77.4 | -24 | 0 | 0 | 0 | 114.5 | I122 K128 | I122-N126 PolarHBondContact O-N 3.48Å; N126-K128 PolarHBondContact O-N 3.2Å |
| 127 | K | 46.9 | Very low | 57.4 | Low | 174 Ų | 174 | 110.8 Ų | 110.8 | 76% | 0.757 | 58% | 0.584 | S | S | * | * | S | Bend | trans | -77.6 | 119 | 168.3 | -71.4 | -178.7 | 179 | 176.5 | 0 | 108.2 | ||
| 128 | K | 38.1 | Very low | 55.1 | Low | 185 Ų | 185 | 119 Ų | 119 | 80% | 0.804 | 63% | 0.628 | S | S | * | * | trans | -42.8 | 143.5 | 175 | -77.9 | -178.8 | 177.1 | 177.7 | 0 | 110.9 | N126 I130 | N126-K128 PolarHBondContact O-N 3.2Å; K128-I130 VanDerWaalsContact C-N 3.28Å; K128-I130 PolarHBondContact O-N 2.9Å | ||
| 129 | P | 42.2 | Very low | 52.8 | Low | 122 Ų | 122 | 120.8 Ų | 120.8 | 79% | 0.792 | 65% | 0.649 | S | S | * | * | trans | -68.8 | 93.5 | 172 | 30.1 | -30.3 | 0 | 0 | 0 | 107.1 | L131 | P129-L131 VanDerWaalsContact C-N 3.29Å; P129-L131 PolarHBondContact O-N 3.38Å | ||
| 130 | I | 39.2 | Very low | 50.7 | Low | 149 Ų | 149 | 119.7 Ų | 119.7 | 76% | 0.764 | 65% | 0.654 | S | S | * | * | trans | -67.5 | 105.4 | 158.6 | -68.2 | 175.2 | 0 | 0 | 0 | 104.2 | K128 D132 | K128-I130 VanDerWaalsContact C-N 3.28Å; K128-I130 PolarHBondContact O-N 2.9Å; I130-D132 PolarHBondContact O-N 2.92Å | ||
| 131 | L | 43.7 | Very low | 48.8 | Very low | 157 Ų | 157 | 124.4 Ų | 124.4 | 82% | 0.822 | 67% | 0.672 | S | S | * | * | trans | -49.4 | 86.2 | 155.5 | -77.1 | 151.3 | 0 | 0 | 0 | 107.8 | P129 | P129-L131 VanDerWaalsContact C-N 3.29Å; P129-L131 PolarHBondContact O-N 3.38Å | ||
| 132 | D | 35.1 | Very low | 47 | Very low | 133 Ų | 133 | 129.7 Ų | 129.7 | 71% | 0.711 | 70% | 0.702 | S | S | * | * | trans | -122.3 | 108.7 | 148.1 | -114.2 | -30.2 | 0 | 0 | 0 | 107.8 | I130 T134 | I130-D132 PolarHBondContact O-N 2.92Å; D132-T134 PolarHBondContact O-N 3.46Å | ||
| 133 | I | 47.4 | Very low | 45.7 | Very low | 145 Ų | 145 | 134.2 Ų | 134.2 | 74% | 0.744 | 72% | 0.723 | S | S | * | * | trans | -68.5 | 72.4 | 169 | -59.4 | 163.2 | 0 | 0 | 0 | 105.9 | ||||
| 134 | T | 37.7 | Very low | 44.5 | Very low | 112 Ų | 112 | 130.9 Ų | 130.9 | 69% | 0.687 | 71% | 0.708 | S | S | * | * | trans | -106.2 | 91.5 | 139.2 | 53.3 | 0 | 0 | 0 | 0 | 104 | D132 P136 | D132-T134 PolarHBondContact O-N 3.46Å; T134-P136 WeakPolarHBondContact O-CD 3.22Å | ||
| 135 | K | 42.1 | Very low | 44 | Very low | 172 Ų | 172 | 129.2 Ų | 129.2 | 75% | 0.748 | 70% | 0.703 | S | S | * | * | trans | -37.9 | 118.9 | 148.7 | -71.4 | 176.2 | 176.7 | 177.5 | 0 | 104.8 | K137 | K135-K137 PolarHBondContact O-N 3.46Š| ||
| 136 | P | 43.3 | Very low | 43.8 | Very low | 125 Ų | 125 | 131.4 Ų | 131.4 | 81% | 0.812 | 71% | 0.713 | S | S | * | * | trans | -57.4 | 103.5 | 144.6 | 22.8 | -17.8 | 0 | 0 | 0 | 101.1 | T134 L138 | T134-P136 WeakPolarHBondContact O-CD 3.22Å; P136-L138 PolarHBondContact O-N 2.94Å; P136-L138 VanDerWaalsContact O-N 3.11Å | ||
| 137 | K | 39.8 | Very low | 44.3 | Very low | 183 Ų | 183 | 126.3 Ų | 126.3 | 80% | 0.796 | 69% | 0.69 | S | S | * | * | trans | -36.8 | 128.8 | 161.7 | -80 | 174.8 | 173.6 | 176.4 | 0 | 104 | K135 A139 | K135-K137 PolarHBondContact O-N 3.46Å; K137-A139 PolarHBondContact O-N 2.89Å | ||
| 138 | L | 39 | Very low | 45.3 | Very low | 177 Ų | 177 | 123 Ų | 123 | 93% | 0.927 | 68% | 0.677 | S | S | * | * | trans | -32.3 | 93.2 | 164.3 | -70.2 | 157.5 | 0 | 0 | 0 | 107 | P136 | P136-L138 PolarHBondContact O-N 2.94Å; P136-L138 VanDerWaalsContact O-N 3.11Å | ||
| 139 | A | 38.1 | Very low | 47 | Very low | 75 Ų | 75 | 119.9 Ų | 119.9 | 62% | 0.62 | 67% | 0.668 | S | S | * | * | trans | -70.5 | 128.4 | 161.2 | 0 | 0 | 0 | 0 | 0 | 99.8 | K137 L141 | K137-A139 PolarHBondContact O-N 2.89Å; A139-L141 PolarHBondContact O-N 3.46Å | ||
| 140 | P | 43.7 | Very low | 48.6 | Very low | 98 Ų | 98 | 119.1 Ų | 119.1 | 64% | 0.636 | 66% | 0.657 | S | S | * | * | trans | -45.8 | 125.7 | 171 | -16.9 | 27.7 | 0 | 0 | 0 | 105.5 | N142 | P140-N142 PolarHBondContact O-N 3.31Š| ||
| 141 | L | 44.3 | Very low | 50.5 | Low | 142 Ų | 142 | 116 Ų | 116 | 74% | 0.743 | 64% | 0.641 | S | S | * | * | trans | -39.6 | 114.5 | 167.9 | -112.1 | 78.5 | 0 | 0 | 0 | 104.4 | A139 E143 | A139-L141 PolarHBondContact O-N 3.46Å; L141-E143 PolarHBondContact O-N 3.35Å | ||
| 142 | N | 43 | Very low | 52.4 | Low | 159 Ų | 159 | 114.8 Ų | 114.8 | 85% | 0.85 | 63% | 0.63 | S | S | * | * | trans | -48.8 | 119 | -171.8 | -144.9 | 12.9 | 0 | 0 | 0 | 105.6 | P140 G144 | P140-N142 PolarHBondContact O-N 3.31Å; N142-G144 PolarHBondContact O-N 2.83Å | ||
| 143 | E | 46.3 | Very low | 54.7 | Low | 135 Ų | 135 | 112.2 Ų | 112.2 | 63% | 0.631 | 61% | 0.614 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.6 | 26.7 | -167.4 | -68.5 | 171.5 | 161.7 | 0 | 0 | 111.5 | L141 A147 E148 | L141-E143 PolarHBondContact O-N 3.35Å; E143-A147 HydrophobicContact CB-CB 3.61Å; E143-A147 HydrophobicContact CG-CB 4.35Å; E143-A147 CarbonylContact O-C 3.57Å; E143-A147 VanDerWaalsContact O-CA 3.28Å; E143-A147 WeakPolarHBondContact O-CA 3.24Å; E143-A147 WeakPolarHBondContact O-CB 3.31Å; E143-E148 PolarHBondContact O-N 3.22Å; E143-E148 VanDerWaalsContact O-N 3.08Å |
| 144 | G | 47.6 | Very low | 56.6 | Low | 28 Ų | 28 | 108.4 Ų | 108.4 | 29% | 0.289 | 59% | 0.594 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -96.4 | -13.8 | -168.2 | 0 | 0 | 0 | 0 | 0 | 114.9 | N142 E148 | N142-G144 PolarHBondContact O-N 2.83Å; G144-E148 WeakPolarHBondContact O-CB 3.15Å; G144-E148 WeakPolarHBondContact O-CG 3.25Å |
| 145 | G | 55.7 | Low | 59.1 | Low | 43 Ų | 43 | 107.6 Ų | 107.6 | 44% | 0.443 | 59% | 0.585 | S | S | . | * | S | Bend | trans | -103.1 | -76.1 | -178.9 | 0 | 0 | 0 | 0 | 0 | 111.4 | L149 | G145-L149 WeakPolarHBondContact O-CB 3.4Å; G145-L149 WeakPolarHBondContact O-CG 3.24Å; G145-L149 PolarHBondContact O-N 2.89Å |
| 146 | T | 54.8 | Low | 61.6 | Low | 115 Ų | 115 | 105.2 Ų | 105.2 | 71% | 0.706 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -66.4 | -39.6 | 173 | 41.5 | 0 | 0 | 0 | 0 | 111.6 | L149 L150 | T146-L149 PolarHBondContact O-N 2.93Å; T146-L150 WeakPolarHBondContact O-CA 3.33Å; T146-L150 WeakPolarHBondContact O-CB 3.49Å; T146-L150 PolarHBondContact O-N 3.02Å |
| 147 | A | 62.3 | Low | 64 | Low | 24 Ų | 24 | 103 Ų | 103 | 20% | 0.198 | 55% | 0.552 | C | S | . | * | H | α-helix | trans | -80.3 | -22.5 | 178.3 | 0 | 0 | 0 | 0 | 0 | 113.9 | E143 N151 | E143-A147 HydrophobicContact CB-CB 3.61Å; E143-A147 HydrophobicContact CG-CB 4.35Å; E143-A147 CarbonylContact O-C 3.57Å; E143-A147 VanDerWaalsContact O-CA 3.28Å; E143-A147 WeakPolarHBondContact O-CA 3.24Å; E143-A147 WeakPolarHBondContact O-CB 3.31Å; A147-N151 WeakPolarHBondContact O-CA 3.18Å; A147-N151 WeakPolarHBondContact O-CB 3.4Å; A147-N151 PolarHBondContact O-N 3.27Å; A147-N151 PolarHBondContact O-ND2 2.93Å |
| 148 | E | 68.2 | Low | 66.6 | Low | 105 Ų | 105 | 99.4 Ų | 99.4 | 49% | 0.491 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -73.1 | -38.7 | 163 | -82 | 175.1 | -160.3 | 0 | 0 | 112.3 | E143 G144 L150 N151 K152 | E143-E148 PolarHBondContact O-N 3.22Å; E143-E148 VanDerWaalsContact O-N 3.08Å; G144-E148 WeakPolarHBondContact O-CB 3.15Å; G144-E148 WeakPolarHBondContact O-CG 3.25Å; E148-L150 VanDerWaalsContact C-N 3.31Å; E148-N151 PolarHBondContact O-N 2.83Å; E148-K152 VanDerWaalsContact O-CB 3.26Å; E148-K152 WeakPolarHBondContact O-CB 3.32Å; E148-K152 VanDerWaalsContact O-CG 3.26Å; E148-K152 WeakPolarHBondContact O-CG 3.17Å; E148-K152 PolarHBondContact O-N 2.85Å |
| 149 | L | 72.6 | Confident | 69.2 | Low | 118 Ų | 118 | 97.7 Ų | 97.7 | 62% | 0.618 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -65.4 | -40.1 | 174.4 | -72.9 | 172.6 | 0 | 0 | 0 | 110.9 | G145 T146 K152 E153 | G145-L149 WeakPolarHBondContact O-CB 3.4Å; G145-L149 WeakPolarHBondContact O-CG 3.24Å; G145-L149 PolarHBondContact O-N 2.89Å; T146-L149 PolarHBondContact O-N 2.93Å; L149-K152 PolarHBondContact O-N 3.48Å; L149-E153 WeakPolarHBondContact O-CB 3.31Å; L149-E153 PolarHBondContact O-N 3.18Å |
| 150 | L | 77.7 | Confident | 71.9 | Confident | 106 Ų | 106 | 98 Ų | 98 | 56% | 0.555 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -72.2 | -34.7 | 175.6 | -163.9 | 131.3 | 0 | 0 | 0 | 110.9 | T146 E148 E153 I154 | T146-L150 WeakPolarHBondContact O-CA 3.33Å; T146-L150 WeakPolarHBondContact O-CB 3.49Å; T146-L150 PolarHBondContact O-N 3.02Å; E148-L150 VanDerWaalsContact C-N 3.31Å; L150-E153 PolarHBondContact O-N 2.92Å; L150-I154 HydrophobicContact CD2-CD1 3.48Å; L150-I154 VanDerWaalsContact CD2-CD1 3.48Å; L150-I154 HydrophobicContact CD2-CG1 4.32Å; L150-I154 HydrophobicContact CG-CD1 4.32Å; L150-I154 WeakPolarHBondContact O-CB 3.32Å; L150-I154 WeakPolarHBondContact O-CD1 3.45Å; L150-I154 WeakPolarHBondContact O-CG1 3.48Å; L150-I154 PolarHBondContact O-N 3.36Å |
| 151 | N | 78.9 | Confident | 74.3 | Confident | 83 Ų | 83 | 97.3 Ų | 97.3 | 44% | 0.444 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -69.2 | -37.6 | 170.9 | -79.1 | -31.2 | 0 | 0 | 0 | 111.6 | A147 E148 I154 L155 | A147-N151 WeakPolarHBondContact O-CA 3.18Å; A147-N151 WeakPolarHBondContact O-CB 3.4Å; A147-N151 PolarHBondContact O-N 3.27Å; A147-N151 PolarHBondContact O-ND2 2.93Å; E148-N151 PolarHBondContact O-N 2.83Å; N151-I154 PolarHBondContact O-N 2.77Å; N151-L155 VanDerWaalsContact O-CB 3.25Å; N151-L155 WeakPolarHBondContact O-CB 3.19Å; N151-L155 WeakPolarHBondContact O-CG 3.22Å; N151-L155 PolarHBondContact O-N 2.86Å |
| 152 | K | 82.9 | Confident | 76.7 | Confident | 132 Ų | 132 | 95.5 Ų | 95.5 | 57% | 0.574 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -65.4 | -42.2 | 172.8 | -80.3 | 175.6 | 179.9 | 170.6 | 0 | 111 | E148 L149 L155 R156 | E148-K152 VanDerWaalsContact O-CB 3.26Å; E148-K152 WeakPolarHBondContact O-CB 3.32Å; E148-K152 VanDerWaalsContact O-CG 3.26Å; E148-K152 WeakPolarHBondContact O-CG 3.17Å; E148-K152 PolarHBondContact O-N 2.85Å; L149-K152 PolarHBondContact O-N 3.48Å; K152-L155 PolarHBondContact O-N 3.49Å; K152-R156 VanDerWaalsContact O-CB 3.25Å; K152-R156 WeakPolarHBondContact O-CB 3.49Å; K152-R156 PolarHBondContact O-N 2.75Å |
| 153 | E | 83.3 | Confident | 79.2 | Confident | 80 Ų | 80 | 94.3 Ų | 94.3 | 37% | 0.374 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -70.3 | -37.4 | 175.5 | -169.3 | 61.7 | -164.8 | 0 | 0 | 111.2 | L149 L150 R156 L157 | L149-E153 WeakPolarHBondContact O-CB 3.31Å; L149-E153 PolarHBondContact O-N 3.18Å; L150-E153 PolarHBondContact O-N 2.92Å; E153-R156 PolarHBondContact O-N 3.2Å; E153-R156 IonicContact OE1-CZ 3.55Å; E153-R156 IonicContact OE1-NH1 3.69Å; E153-R156 PolarHBondContact OE1-NH1 3.34Å; E153-R156 IonicContact OE2-NH1 2.79Å; E153-R156 PolarHBondContact OE2-NH1 2.79Å; E153-L157 HydrophobicContact CG-CD1 4.04Å; E153-L157 HydrophobicContact CG-CG 4.38Å; E153-L157 WeakPolarHBondContact O-CB 3.39Å; E153-L157 WeakPolarHBondContact O-CG 3.38Å; E153-L157 PolarHBondContact O-N 2.82Å |
| 154 | I | 88 | Confident | 81.5 | Confident | 64 Ų | 64 | 92.7 Ų | 92.7 | 33% | 0.328 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -62.5 | -46.3 | 171.8 | -76 | 167.5 | 0 | 0 | 0 | 110.2 | L150 N151 L157 Q158 | L150-I154 HydrophobicContact CD2-CD1 3.48Å; L150-I154 VanDerWaalsContact CD2-CD1 3.48Å; L150-I154 HydrophobicContact CD2-CG1 4.32Å; L150-I154 HydrophobicContact CG-CD1 4.32Å; L150-I154 WeakPolarHBondContact O-CB 3.32Å; L150-I154 WeakPolarHBondContact O-CD1 3.45Å; L150-I154 WeakPolarHBondContact O-CG1 3.48Å; L150-I154 PolarHBondContact O-N 3.36Å; N151-I154 PolarHBondContact O-N 2.77Å; I154-L157 CarbonylContact O-C 3.37Å; I154-L157 PolarHBondContact O-N 3.31Å; I154-Q158 HydrophobicContact CG2-CG 4.22Å; I154-Q158 VanDerWaalsContact O-CB 3.24Å; I154-Q158 WeakPolarHBondContact O-CB 3.48Å; I154-Q158 WeakPolarHBondContact O-CG 3.38Å; I154-Q158 PolarHBondContact O-N 2.76Å |
| 155 | L | 90.7 | Very high | 83.8 | Confident | 96 Ų | 96 | 97 Ų | 97 | 50% | 0.503 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -63.1 | -44.8 | 177.9 | -77.1 | 169.6 | 0 | 0 | 0 | 110.7 | N151 K152 Q158 E159 | N151-L155 VanDerWaalsContact O-CB 3.25Å; N151-L155 WeakPolarHBondContact O-CB 3.19Å; N151-L155 WeakPolarHBondContact O-CG 3.22Å; N151-L155 PolarHBondContact O-N 2.86Å; K152-L155 PolarHBondContact O-N 3.49Å; L155-Q158 WeakPolarHBondContact O-CB 3.32Å; L155-Q158 PolarHBondContact O-N 2.78Å; L155-E159 WeakPolarHBondContact O-CB 3.42Å; L155-E159 WeakPolarHBondContact O-CG 3.31Å; L155-E159 PolarHBondContact O-N 3.33Å |
| 156 | R | 94.4 | Very high | 85.7 | Confident | 122 Ų | 122 | 97.9 Ų | 97.9 | 46% | 0.46 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -61.8 | -45.8 | 175.1 | -175.3 | -167.9 | 147.8 | -152.7 | -8.6 | 111.5 | K152 E153 Q158 E159 E160 | K152-R156 VanDerWaalsContact O-CB 3.25Å; K152-R156 WeakPolarHBondContact O-CB 3.49Å; K152-R156 PolarHBondContact O-N 2.75Å; E153-R156 PolarHBondContact O-N 3.2Å; E153-R156 IonicContact OE1-CZ 3.55Å; E153-R156 IonicContact OE1-NH1 3.69Å; E153-R156 PolarHBondContact OE1-NH1 3.34Å; E153-R156 IonicContact OE2-NH1 2.79Å; E153-R156 PolarHBondContact OE2-NH1 2.79Å; R156-Q158 VanDerWaalsContact C-N 3.29Å; R156-Q158 PolarHBondContact O-N 3.5Å; R156-E159 PolarHBondContact O-N 3.24Å; R156-E160 IonicContact CZ-OE1 3.41Å; R156-E160 IonicContact NE-OE1 3.82Å; R156-E160 PolarHBondContact NE-OE1 2.81Å; R156-E160 IonicContact NH2-OE1 3.34Å; R156-E160 PolarHBondContact NH2-OE1 3.36Å; R156-E160 WeakPolarHBondContact O-CB 3.31Å; R156-E160 WeakPolarHBondContact O-CG 3.27Å; R156-E160 PolarHBondContact O-N 3.35Å |
| 157 | L | 92.9 | Very high | 87.6 | Confident | 77 Ų | 77 | 99.9 Ų | 99.9 | 40% | 0.403 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -66.5 | -31.4 | 176.7 | -74.5 | 171.1 | 0 | 0 | 0 | 111.9 | E153 I154 N161 | E153-L157 HydrophobicContact CG-CD1 4.04Å; E153-L157 HydrophobicContact CG-CG 4.38Å; E153-L157 WeakPolarHBondContact O-CB 3.39Å; E153-L157 WeakPolarHBondContact O-CG 3.38Å; E153-L157 PolarHBondContact O-N 2.82Å; I154-L157 CarbonylContact O-C 3.37Å; I154-L157 PolarHBondContact O-N 3.31Å; L157-N161 WeakPolarHBondContact O-CB 3.34Å; L157-N161 PolarHBondContact O-N 3.28Å; L157-N161 PolarHBondContact O-ND2 2.8Å |
| 158 | Q | 94.1 | Very high | 89.1 | Confident | 108 Ų | 108 | 104 Ų | 104 | 51% | 0.505 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -70.3 | -44.9 | 172.9 | -78.8 | 173.1 | -11.1 | 0 | 0 | 110.8 | I154 L155 R156 N161 E162 | I154-Q158 HydrophobicContact CG2-CG 4.22Å; I154-Q158 VanDerWaalsContact O-CB 3.24Å; I154-Q158 WeakPolarHBondContact O-CB 3.48Å; I154-Q158 WeakPolarHBondContact O-CG 3.38Å; I154-Q158 PolarHBondContact O-N 2.76Å; L155-Q158 WeakPolarHBondContact O-CB 3.32Å; L155-Q158 PolarHBondContact O-N 2.78Å; R156-Q158 VanDerWaalsContact C-N 3.29Å; R156-Q158 PolarHBondContact O-N 3.5Å; Q158-N161 PolarHBondContact O-N 2.78Å; Q158-E162 WeakPolarHBondContact O-CB 3.31Å; Q158-E162 WeakPolarHBondContact O-CG 3.43Å; Q158-E162 PolarHBondContact O-N 2.8Å |
| 159 | E | 94 | Very high | 90.5 | Very high | 141 Ų | 141 | 105.5 Ų | 105.5 | 66% | 0.659 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -62.1 | -45.2 | 174 | -76.7 | -179.2 | -179.7 | 0 | 0 | 111.7 | L155 R156 N161 E162 K163 | L155-E159 WeakPolarHBondContact O-CB 3.42Å; L155-E159 WeakPolarHBondContact O-CG 3.31Å; L155-E159 PolarHBondContact O-N 3.33Å; R156-E159 PolarHBondContact O-N 3.24Å; E159-N161 VanDerWaalsContact C-N 3.35Å; E159-E162 PolarHBondContact O-N 2.84Å; E159-K163 VanDerWaalsContact O-CB 3.26Å; E159-K163 WeakPolarHBondContact O-CB 3.21Å; E159-K163 PolarHBondContact O-N 2.76Å |
| 160 | E | 94 | Very high | 91.6 | Very high | 82 Ų | 82 | 103.2 Ų | 103.2 | 38% | 0.383 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -61.8 | -42.6 | 173.8 | -78.5 | -176.5 | -163.7 | 0 | 0 | 110.8 | R156 K163 L164 | R156-E160 IonicContact CZ-OE1 3.41Å; R156-E160 IonicContact NE-OE1 3.82Å; R156-E160 PolarHBondContact NE-OE1 2.81Å; R156-E160 IonicContact NH2-OE1 3.34Å; R156-E160 PolarHBondContact NH2-OE1 3.36Å; R156-E160 WeakPolarHBondContact O-CB 3.31Å; R156-E160 WeakPolarHBondContact O-CG 3.27Å; R156-E160 PolarHBondContact O-N 3.35Å; E160-K163 PolarHBondContact O-N 2.8Å; E160-L164 WeakPolarHBondContact O-CB 3.42Å; E160-L164 VanDerWaalsContact O-CG 3.25Å; E160-L164 WeakPolarHBondContact O-CG 3.23Å; E160-L164 PolarHBondContact O-N 3.27Å |
| 161 | N | 94.3 | Very high | 92.4 | Very high | 83 Ų | 83 | 103.2 Ų | 103.2 | 44% | 0.444 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -63.9 | -42.8 | 174.9 | -92.7 | -61.1 | 0 | 0 | 0 | 112.8 | L157 Q158 E159 K163 L164 K165 | L157-N161 WeakPolarHBondContact O-CB 3.34Å; L157-N161 PolarHBondContact O-N 3.28Å; L157-N161 PolarHBondContact O-ND2 2.8Å; Q158-N161 PolarHBondContact O-N 2.78Å; E159-N161 VanDerWaalsContact C-N 3.35Å; N161-K163 VanDerWaalsContact C-N 3.33Å; N161-L164 PolarHBondContact O-N 2.74Å; N161-K165 WeakPolarHBondContact O-CB 3.44Å; N161-K165 VanDerWaalsContact O-CG 3.28Å; N161-K165 WeakPolarHBondContact O-CG 3.42Å; N161-K165 PolarHBondContact O-N 3.34Å |
| 162 | E | 95.7 | Very high | 93.2 | Very high | 105 Ų | 105 | 104.7 Ų | 104.7 | 49% | 0.491 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -67.6 | -35.8 | 176.9 | -73.2 | -54.4 | 128.3 | 0 | 0 | 111.3 | Q158 E159 K165 S166 | Q158-E162 WeakPolarHBondContact O-CB 3.31Å; Q158-E162 WeakPolarHBondContact O-CG 3.43Å; Q158-E162 PolarHBondContact O-N 2.8Å; E159-E162 PolarHBondContact O-N 2.84Å; E162-K165 PolarHBondContact O-N 3.01Å; E162-K165 WeakPolarHBondContact OE1-CD 3.47Å; E162-K165 IonicContact OE1-NZ 2.75Å; E162-K165 PolarHBondContact OE1-NZ 2.88Å; E162-S166 WeakPolarHBondContact O-CB 3.22Å; E162-S166 PolarHBondContact O-N 3.44Å; E162-S166 PolarHBondContact O-OG 3.46Å |
| 163 | K | 95.5 | Very high | 93.8 | Very high | 134 Ų | 134 | 103.1 Ų | 103.1 | 58% | 0.583 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -66 | -39.5 | 171.8 | -169.1 | 175.9 | -176.3 | 176.6 | 0 | 112 | E159 E160 N161 S166 R167 | E159-K163 VanDerWaalsContact O-CB 3.26Å; E159-K163 WeakPolarHBondContact O-CB 3.21Å; E159-K163 PolarHBondContact O-N 2.76Å; E160-K163 PolarHBondContact O-N 2.8Å; N161-K163 VanDerWaalsContact C-N 3.33Å; K163-S166 WeakPolarHBondContact CA-OG 3.48Å; K163-S166 PolarHBondContact O-OG 3.44Å; K163-R167 WeakPolarHBondContact O-CB 3.37Å; K163-R167 WeakPolarHBondContact O-CG 3.41Å; K163-R167 PolarHBondContact O-N 2.93Å |
| 164 | L | 94.4 | Very high | 94.4 | Very high | 101 Ų | 101 | 105 Ų | 105 | 53% | 0.529 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -69.1 | -45.3 | 175.1 | -74.4 | 172.6 | 0 | 0 | 0 | 111.1 | E160 N161 S166 R167 L168 | E160-L164 WeakPolarHBondContact O-CB 3.42Å; E160-L164 VanDerWaalsContact O-CG 3.25Å; E160-L164 WeakPolarHBondContact O-CG 3.23Å; E160-L164 PolarHBondContact O-N 3.27Å; N161-L164 PolarHBondContact O-N 2.74Å; L164-S166 PolarHBondContact O-N 2.84Å; L164-R167 PolarHBondContact O-N 2.97Å; L164-L168 VanDerWaalsContact O-CB 3.3Å; L164-L168 WeakPolarHBondContact O-CB 3.4Å; L164-L168 PolarHBondContact O-N 2.7Å |
| 165 | K | 95.3 | Very high | 94.6 | Very high | 117 Ų | 117 | 104.7 Ų | 104.7 | 51% | 0.509 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -60.4 | -43.4 | 175.2 | -75.7 | 177.4 | -167.6 | 166.9 | 0 | 112.1 | N161 E162 L168 K169 | N161-K165 WeakPolarHBondContact O-CB 3.44Å; N161-K165 VanDerWaalsContact O-CG 3.28Å; N161-K165 WeakPolarHBondContact O-CG 3.42Å; N161-K165 PolarHBondContact O-N 3.34Å; E162-K165 PolarHBondContact O-N 3.01Å; E162-K165 WeakPolarHBondContact OE1-CD 3.47Å; E162-K165 IonicContact OE1-NZ 2.75Å; E162-K165 PolarHBondContact OE1-NZ 2.88Å; K165-L168 PolarHBondContact O-N 2.73Å; K165-K169 VanDerWaalsContact O-CB 3.31Å; K165-K169 WeakPolarHBondContact O-CB 3.35Å; K165-K169 PolarHBondContact O-N 2.9Å |
| 166 | S | 95.3 | Very high | 94.8 | Very high | 62 Ų | 62 | 103.6 Ų | 103.6 | 43% | 0.434 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -65.7 | -40 | 176.5 | 54.1 | 0 | 0 | 0 | 0 | 112.1 | E162 K163 L164 T170 | E162-S166 WeakPolarHBondContact O-CB 3.22Å; E162-S166 PolarHBondContact O-N 3.44Å; E162-S166 PolarHBondContact O-OG 3.46Å; K163-S166 WeakPolarHBondContact CA-OG 3.48Å; K163-S166 PolarHBondContact O-OG 3.44Å; L164-S166 PolarHBondContact O-N 2.84Å; S166-T170 WeakPolarHBondContact O-CB 3.26Å; S166-T170 PolarHBondContact O-N 3.42Å; S166-T170 PolarHBondContact O-OG1 2.77Å |
| 167 | R | 95.6 | Very high | 94.9 | Very high | 157 Ų | 157 | 100.3 Ų | 100.3 | 59% | 0.592 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -62 | -45.1 | 170.7 | -83.2 | -177.8 | 161.6 | -169.7 | -5.7 | 112.1 | K163 L164 T170 I171 | K163-R167 WeakPolarHBondContact O-CB 3.37Å; K163-R167 WeakPolarHBondContact O-CG 3.41Å; K163-R167 PolarHBondContact O-N 2.93Å; L164-R167 PolarHBondContact O-N 2.97Å; R167-T170 WeakPolarHBondContact O-CB 3.36Å; R167-T170 PolarHBondContact O-N 2.72Å; R167-I171 WeakPolarHBondContact O-CG1 3.31Å; R167-I171 PolarHBondContact O-N 3.08Å |
| 168 | L | 94.1 | Very high | 95 | Very high | 111 Ų | 111 | 99.2 Ų | 99.2 | 58% | 0.581 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -62.4 | -47.1 | -180 | -148.8 | 168.3 | 0 | 0 | 0 | 109.9 | L164 K165 T170 I171 E172 | L164-L168 VanDerWaalsContact O-CB 3.3Å; L164-L168 WeakPolarHBondContact O-CB 3.4Å; L164-L168 PolarHBondContact O-N 2.7Å; K165-L168 PolarHBondContact O-N 2.73Å; L168-T170 VanDerWaalsContact C-N 3.31Å; L168-T170 PolarHBondContact O-N 3.45Å; L168-I171 PolarHBondContact O-N 2.87Å; L168-E172 VanDerWaalsContact O-CB 3.28Å; L168-E172 WeakPolarHBondContact O-CB 3.28Å; L168-E172 PolarHBondContact O-N 3.42Å |
| 169 | K | 96.2 | Very high | 95 | Very high | 136 Ų | 136 | 99.5 Ų | 99.5 | 59% | 0.591 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -58.9 | -40.3 | 173.5 | -172.7 | 176.2 | -177.6 | 178.4 | 0 | 112.3 | K165 E172 I173 | K165-K169 VanDerWaalsContact O-CB 3.31Å; K165-K169 WeakPolarHBondContact O-CB 3.35Å; K165-K169 PolarHBondContact O-N 2.9Å; K169-E172 PolarHBondContact O-N 3.38Å; K169-I173 HydrophobicContact CG-CD1 4.09Å; K169-I173 WeakPolarHBondContact O-CB 3.44Å; K169-I173 WeakPolarHBondContact O-CD1 3.4Å; K169-I173 WeakPolarHBondContact O-CG1 3.21Å; K169-I173 PolarHBondContact O-N 2.71Å |
| 170 | T | 95.5 | Very high | 95.1 | Very high | 71 Ų | 71 | 97.3 Ų | 97.3 | 44% | 0.436 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -64.9 | -45.9 | 176.5 | -56.3 | 0 | 0 | 0 | 0 | 111.3 | S166 R167 L168 E172 I173 Q174 | S166-T170 WeakPolarHBondContact O-CB 3.26Å; S166-T170 PolarHBondContact O-N 3.42Å; S166-T170 PolarHBondContact O-OG1 2.77Å; R167-T170 WeakPolarHBondContact O-CB 3.36Å; R167-T170 PolarHBondContact O-N 2.72Å; L168-T170 VanDerWaalsContact C-N 3.31Å; L168-T170 PolarHBondContact O-N 3.45Å; T170-E172 VanDerWaalsContact C-N 3.32Å; T170-E172 PolarHBondContact O-N 2.84Å; T170-I173 PolarHBondContact O-N 2.77Å; T170-Q174 VanDerWaalsContact O-CG 3.32Å; T170-Q174 WeakPolarHBondContact O-CG 3.34Å; T170-Q174 PolarHBondContact O-N 2.76Å |
| 171 | I | 95.2 | Very high | 95.1 | Very high | 106 Ų | 106 | 99.2 Ų | 99.2 | 54% | 0.544 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -64.7 | -39.1 | 177.3 | -69.2 | 167.3 | 0 | 0 | 0 | 110.5 | R167 L168 Q174 A175 | R167-I171 WeakPolarHBondContact O-CG1 3.31Å; R167-I171 PolarHBondContact O-N 3.08Å; L168-I171 PolarHBondContact O-N 2.87Å; I171-Q174 PolarHBondContact O-N 3.47Å; I171-A175 VanDerWaalsContact O-CB 3.28Å; I171-A175 WeakPolarHBondContact O-CB 3.46Å; I171-A175 PolarHBondContact O-N 2.84Å |
| 172 | E | 95 | Very high | 95.2 | Very high | 114 Ų | 114 | 100.9 Ų | 100.9 | 53% | 0.533 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -65 | -42.9 | 177 | -171.7 | 178.2 | -170.1 | 0 | 0 | 111.6 | L168 K169 T170 A175 T176 | L168-E172 VanDerWaalsContact O-CB 3.28Å; L168-E172 WeakPolarHBondContact O-CB 3.28Å; L168-E172 PolarHBondContact O-N 3.42Å; K169-E172 PolarHBondContact O-N 3.38Å; T170-E172 VanDerWaalsContact C-N 3.32Å; T170-E172 PolarHBondContact O-N 2.84Å; E172-A175 PolarHBondContact O-N 3.34Å; E172-T176 WeakPolarHBondContact O-CB 3.47Å; E172-T176 WeakPolarHBondContact O-CG2 3.43Å; E172-T176 PolarHBondContact O-N 2.99Å; E172-T176 PolarHBondContact O-OG1 3.08Å |
| 173 | I | 95.8 | Very high | 95.1 | Very high | 99 Ų | 99 | 98.3 Ų | 98.3 | 51% | 0.508 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -61.7 | -44 | 172.4 | -69.2 | 164.3 | 0 | 0 | 0 | 110.6 | K169 T170 T176 S177 | K169-I173 HydrophobicContact CG-CD1 4.09Å; K169-I173 WeakPolarHBondContact O-CB 3.44Å; K169-I173 WeakPolarHBondContact O-CD1 3.4Å; K169-I173 WeakPolarHBondContact O-CG1 3.21Å; K169-I173 PolarHBondContact O-N 2.71Å; T170-I173 PolarHBondContact O-N 2.77Å; I173-T176 WeakPolarHBondContact CA-OG1 3.39Å; I173-T176 PolarHBondContact O-N 2.58Å; I173-T176 PolarHBondContact O-OG1 3.11Å; I173-S177 WeakPolarHBondContact O-CB 2.87Å; I173-S177 PolarHBondContact O-N 2.81Å; I173-S177 PolarHBondContact O-OG 2.97Å |
| 174 | Q | 95.6 | Very high | 95.1 | Very high | 118 Ų | 118 | 99 Ų | 99 | 55% | 0.551 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -65.4 | -39 | 177.4 | -73.6 | 175.1 | -5.2 | 0 | 0 | 112.5 | T170 I171 S177 A178 | T170-Q174 VanDerWaalsContact O-CG 3.32Å; T170-Q174 WeakPolarHBondContact O-CG 3.34Å; T170-Q174 PolarHBondContact O-N 2.76Å; I171-Q174 PolarHBondContact O-N 3.47Å; Q174-S177 WeakPolarHBondContact CA-OG 3.32Å; Q174-S177 PolarHBondContact O-OG 3.35Å; Q174-A178 WeakPolarHBondContact O-CB 3.47Å; Q174-A178 PolarHBondContact O-N 3.33Å |
| 175 | A | 94.1 | Very high | 95.1 | Very high | 58 Ų | 58 | 100 Ų | 100 | 48% | 0.479 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -68 | -42.5 | 178.2 | 0 | 0 | 0 | 0 | 0 | 111.3 | I171 E172 A178 L179 | I171-A175 VanDerWaalsContact O-CB 3.28Å; I171-A175 WeakPolarHBondContact O-CB 3.46Å; I171-A175 PolarHBondContact O-N 2.84Å; E172-A175 PolarHBondContact O-N 3.34Å; A175-A178 PolarHBondContact O-N 3.17Å; A175-L179 WeakPolarHBondContact O-CB 3.33Å; A175-L179 PolarHBondContact O-N 3.41Å |
| 176 | T | 94.6 | Very high | 95 | Very high | 74 Ų | 74 | 99.5 Ų | 99.5 | 45% | 0.454 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -66.5 | -43.2 | 175.7 | 48.5 | 0 | 0 | 0 | 0 | 111.6 | E172 I173 A178 L179 D180 | E172-T176 WeakPolarHBondContact O-CB 3.47Å; E172-T176 WeakPolarHBondContact O-CG2 3.43Å; E172-T176 PolarHBondContact O-N 2.99Å; E172-T176 PolarHBondContact O-OG1 3.08Å; I173-T176 WeakPolarHBondContact CA-OG1 3.39Å; I173-T176 PolarHBondContact O-N 2.58Å; I173-T176 PolarHBondContact O-OG1 3.11Å; T176-A178 PolarHBondContact O-N 3.08Å; T176-L179 WeakPolarHBondContact O-CB 3.46Å; T176-L179 PolarHBondContact O-N 2.81Å; T176-D180 PolarHBondContact O-N 2.94Å |
| 177 | S | 95.3 | Very high | 94.9 | Very high | 53 Ų | 53 | 102.8 Ų | 102.8 | 37% | 0.371 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -63 | -41.8 | 174.9 | 67.2 | 0 | 0 | 0 | 0 | 112.2 | I173 Q174 L179 D180 E181 | I173-S177 WeakPolarHBondContact O-CB 2.87Å; I173-S177 PolarHBondContact O-N 2.81Å; I173-S177 PolarHBondContact O-OG 2.97Å; Q174-S177 WeakPolarHBondContact CA-OG 3.32Å; Q174-S177 PolarHBondContact O-OG 3.35Å; S177-L179 VanDerWaalsContact C-N 3.32Å; S177-L179 PolarHBondContact O-N 2.77Å; S177-D180 PolarHBondContact O-N 3.32Å; S177-E181 WeakPolarHBondContact O-CG 3.28Å; S177-E181 PolarHBondContact O-N 3.42Å |
| 178 | A | 94.8 | Very high | 94.8 | Very high | 53 Ų | 53 | 97.5 Ų | 97.5 | 44% | 0.438 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -65.1 | -35.6 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | Q174 A175 T176 K182 | Q174-A178 WeakPolarHBondContact O-CB 3.47Å; Q174-A178 PolarHBondContact O-N 3.33Å; A175-A178 PolarHBondContact O-N 3.17Å; T176-A178 PolarHBondContact O-N 3.08Å; A178-K182 VanDerWaalsContact O-CB 3.26Å; A178-K182 WeakPolarHBondContact O-CB 3.32Å; A178-K182 PolarHBondContact O-N 2.81Å |
| 179 | L | 94.9 | Very high | 94.7 | Very high | 114 Ų | 114 | 97 Ų | 97 | 60% | 0.597 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -66.4 | -43 | 174.5 | -163.9 | 93 | 0 | 0 | 0 | 111.5 | A175 T176 S177 K182 S183 | A175-L179 WeakPolarHBondContact O-CB 3.33Å; A175-L179 PolarHBondContact O-N 3.41Å; T176-L179 WeakPolarHBondContact O-CB 3.46Å; T176-L179 PolarHBondContact O-N 2.81Å; S177-L179 VanDerWaalsContact C-N 3.32Å; S177-L179 PolarHBondContact O-N 2.77Å; L179-K182 PolarHBondContact O-N 2.93Å; L179-S183 PolarHBondContact O-N 3.03Å |
| 180 | D | 95.1 | Very high | 94.6 | Very high | 95 Ų | 95 | 96.2 Ų | 96.2 | 51% | 0.508 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -64.1 | -43.4 | 176.8 | -77.1 | -15.7 | 0 | 0 | 0 | 111.6 | T176 S177 S183 K184 | T176-D180 PolarHBondContact O-N 2.94Å; S177-D180 PolarHBondContact O-N 3.32Å; D180-S183 PolarHBondContact O-N 3.29Å; D180-K184 WeakPolarHBondContact O-CG 3.25Å; D180-K184 PolarHBondContact O-N 3.45Å |
| 181 | E | 95.2 | Very high | 94.4 | Very high | 123 Ų | 123 | 97.2 Ų | 97.2 | 58% | 0.575 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -61.9 | -45.8 | 173.7 | -76 | -177.8 | 179.6 | 0 | 0 | 111.4 | S177 S183 K184 L185 | S177-E181 WeakPolarHBondContact O-CG 3.28Å; S177-E181 PolarHBondContact O-N 3.42Å; E181-S183 VanDerWaalsContact C-N 3.32Å; E181-S183 PolarHBondContact O-N 3.06Å; E181-K184 PolarHBondContact O-N 3.35Å; E181-L185 WeakPolarHBondContact O-CB 3.28Å; E181-L185 VanDerWaalsContact O-CG 3.31Å; E181-L185 WeakPolarHBondContact O-CG 3.48Å; E181-L185 PolarHBondContact O-N 3.15Å |
| 182 | K | 95.7 | Very high | 94.1 | Very high | 118 Ų | 118 | 97.8 Ų | 97.8 | 51% | 0.513 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -56.8 | -46.3 | 174.6 | 179.8 | -175.7 | 167 | -175.6 | 0 | 111.2 | A178 L179 K184 L185 E186 | A178-K182 VanDerWaalsContact O-CB 3.26Å; A178-K182 WeakPolarHBondContact O-CB 3.32Å; A178-K182 PolarHBondContact O-N 2.81Å; L179-K182 PolarHBondContact O-N 2.93Å; K182-K184 PolarHBondContact O-N 2.82Å; K182-L185 PolarHBondContact O-N 3.22Å; K182-E186 WeakPolarHBondContact CE-OE1 3.49Å; K182-E186 HydrophobicContact CG-CG 4.42Å; K182-E186 IonicContact NZ-OE1 3.98Å; K182-E186 WeakPolarHBondContact O-CB 3.37Å; K182-E186 WeakPolarHBondContact O-CG 3.3Å; K182-E186 PolarHBondContact O-N 3.46Å |
| 183 | S | 94.2 | Very high | 93.8 | Very high | 50 Ų | 50 | 98.1 Ų | 98.1 | 35% | 0.35 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -63.5 | -40.4 | 178.7 | -176.7 | 0 | 0 | 0 | 0 | 112.4 | L179 D180 E181 E186 K187 | L179-S183 PolarHBondContact O-N 3.03Å; D180-S183 PolarHBondContact O-N 3.29Å; E181-S183 VanDerWaalsContact C-N 3.32Å; E181-S183 PolarHBondContact O-N 3.06Å; S183-E186 PolarHBondContact O-N 3.26Å; S183-K187 WeakPolarHBondContact O-CG 3.26Å; S183-K187 PolarHBondContact O-N 3.45Å |
| 184 | K | 95.2 | Very high | 93.3 | Very high | 148 Ų | 148 | 98 Ų | 98 | 64% | 0.643 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -64.2 | -43.9 | 175.1 | -72.8 | 170 | -175.5 | 170.8 | 0 | 111.7 | D180 E181 K182 K187 A188 | D180-K184 WeakPolarHBondContact O-CG 3.25Å; D180-K184 PolarHBondContact O-N 3.45Å; E181-K184 PolarHBondContact O-N 3.35Å; K182-K184 PolarHBondContact O-N 2.82Å; K184-K187 PolarHBondContact O-N 3.48Å; K184-A188 WeakPolarHBondContact O-CB 3.16Å; K184-A188 PolarHBondContact O-N 3.47Å |
| 185 | L | 94.1 | Very high | 92.8 | Very high | 123 Ų | 123 | 97.2 Ų | 97.2 | 64% | 0.644 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -65.7 | -41.5 | 177.5 | -72.1 | 172.4 | 0 | 0 | 0 | 111.6 | E181 K182 A188 L189 | E181-L185 WeakPolarHBondContact O-CB 3.28Å; E181-L185 VanDerWaalsContact O-CG 3.31Å; E181-L185 WeakPolarHBondContact O-CG 3.48Å; E181-L185 PolarHBondContact O-N 3.15Å; K182-L185 PolarHBondContact O-N 3.22Å; L185-A188 PolarHBondContact O-N 3.27Å; L185-L189 VanDerWaalsContact O-CB 3.23Å; L185-L189 WeakPolarHBondContact O-CB 3.41Å; L185-L189 PolarHBondContact O-N 2.93Å |
| 186 | E | 93.4 | Very high | 92.3 | Very high | 107 Ų | 107 | 99.6 Ų | 99.6 | 50% | 0.5 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -60.4 | -44.6 | 174.9 | -79.5 | 177 | 168.6 | 0 | 0 | 111.6 | K182 S183 L189 Q190 | K182-E186 WeakPolarHBondContact CE-OE1 3.49Å; K182-E186 HydrophobicContact CG-CG 4.42Å; K182-E186 IonicContact NZ-OE1 3.98Å; K182-E186 WeakPolarHBondContact O-CB 3.37Å; K182-E186 WeakPolarHBondContact O-CG 3.3Å; K182-E186 PolarHBondContact O-N 3.46Å; S183-E186 PolarHBondContact O-N 3.26Å; E186-L189 PolarHBondContact O-N 3.33Å; E186-Q190 WeakPolarHBondContact O-CB 3.47Å; E186-Q190 PolarHBondContact O-N 3.04Å |
| 187 | K | 94.2 | Very high | 91.5 | Very high | 130 Ų | 130 | 97.4 Ų | 97.4 | 57% | 0.565 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -61.9 | -49.6 | 174.5 | -73.9 | 177.2 | -178.3 | 178.4 | 0 | 112 | S183 K184 L189 Q190 D191 | S183-K187 WeakPolarHBondContact O-CG 3.26Å; S183-K187 PolarHBondContact O-N 3.45Å; K184-K187 PolarHBondContact O-N 3.48Å; K187-L189 PolarHBondContact O-N 3.34Å; K187-Q190 PolarHBondContact O-N 3.03Å; K187-Q190 VanDerWaalsContact O-N 3.12Å; K187-D191 PolarHBondContact O-N 2.96Å |
| 188 | A | 93.4 | Very high | 90.8 | Very high | 47 Ų | 47 | 99.6 Ų | 99.6 | 39% | 0.388 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -60 | -36.6 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | K184 L185 L192 | K184-A188 WeakPolarHBondContact O-CB 3.16Å; K184-A188 PolarHBondContact O-N 3.47Å; L185-A188 PolarHBondContact O-N 3.27Å; A188-L192 WeakPolarHBondContact O-CB 3.24Å; A188-L192 WeakPolarHBondContact O-CG 3.2Å; A188-L192 PolarHBondContact O-N 2.89Å |
| 189 | L | 92.1 | Very high | 90 | Very high | 99 Ų | 99 | 103.2 Ų | 103.2 | 52% | 0.518 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -69.8 | -40.3 | 176.9 | -161.8 | 153.1 | 0 | 0 | 0 | 111.1 | L185 E186 K187 L192 Q193 | L185-L189 VanDerWaalsContact O-CB 3.23Å; L185-L189 WeakPolarHBondContact O-CB 3.41Å; L185-L189 PolarHBondContact O-N 2.93Å; E186-L189 PolarHBondContact O-N 3.33Å; K187-L189 PolarHBondContact O-N 3.34Å; L189-L192 PolarHBondContact O-N 3.32Å; L189-Q193 HydrophobicContact CD2-CG 4.14Å; L189-Q193 WeakPolarHBondContact O-CB 3.41Å; L189-Q193 VanDerWaalsContact O-CG 3.31Å; L189-Q193 WeakPolarHBondContact O-CG 3.4Å; L189-Q193 PolarHBondContact O-N 2.92Å |
| 190 | Q | 92.2 | Very high | 89.1 | Confident | 120 Ų | 120 | 103 Ų | 103 | 56% | 0.561 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -64.4 | -43.6 | 174.5 | -169.8 | 172.6 | 11.1 | 0 | 0 | 111.9 | E186 K187 Q193 L194 | E186-Q190 WeakPolarHBondContact O-CB 3.47Å; E186-Q190 PolarHBondContact O-N 3.04Å; K187-Q190 PolarHBondContact O-N 3.03Å; K187-Q190 VanDerWaalsContact O-N 3.12Å; Q190-Q193 PolarHBondContact O-N 2.93Å; Q190-L194 WeakPolarHBondContact O-CG 3.2Å; Q190-L194 PolarHBondContact O-N 3.11Å |
| 191 | D | 91.3 | Very high | 88.4 | Confident | 92 Ų | 92 | 103 Ų | 103 | 49% | 0.492 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -62.5 | -46.3 | 176.3 | -67.7 | -21.8 | 0 | 0 | 0 | 111 | K187 Q193 L194 D195 | K187-D191 PolarHBondContact O-N 2.96Å; D191-Q193 VanDerWaalsContact C-N 3.3Å; D191-Q193 PolarHBondContact O-N 2.94Å; D191-L194 PolarHBondContact O-N 3.04Å; D191-D195 WeakPolarHBondContact O-CB 3.16Å; D191-D195 PolarHBondContact O-N 3.19Å |
| 192 | L | 90.1 | Very high | 87.4 | Confident | 118 Ų | 118 | 103.7 Ų | 103.7 | 62% | 0.618 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -60.3 | -37.6 | 174.2 | -83.5 | 164.4 | 0 | 0 | 0 | 112.7 | A188 L189 Q196 | A188-L192 WeakPolarHBondContact O-CB 3.24Å; A188-L192 WeakPolarHBondContact O-CG 3.2Å; A188-L192 PolarHBondContact O-N 2.89Å; L189-L192 PolarHBondContact O-N 3.32Å; L192-Q196 WeakPolarHBondContact O-CB 3.25Å; L192-Q196 PolarHBondContact O-N 2.96Å |
| 193 | Q | 88.1 | Confident | 86.5 | Confident | 121 Ų | 121 | 101.9 Ų | 101.9 | 57% | 0.565 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -67.7 | -40.2 | 175.6 | -80.1 | -179.7 | -12.4 | 0 | 0 | 112.1 | L189 Q190 D191 G197 | L189-Q193 HydrophobicContact CD2-CG 4.14Å; L189-Q193 WeakPolarHBondContact O-CB 3.41Å; L189-Q193 VanDerWaalsContact O-CG 3.31Å; L189-Q193 WeakPolarHBondContact O-CG 3.4Å; L189-Q193 PolarHBondContact O-N 2.92Å; Q190-Q193 PolarHBondContact O-N 2.93Å; D191-Q193 VanDerWaalsContact C-N 3.3Å; D191-Q193 PolarHBondContact O-N 2.94Å; Q193-G197 PolarHBondContact O-N 3.2Å |
| 194 | L | 86.6 | Confident | 85.9 | Confident | 96 Ų | 96 | 105.9 Ų | 105.9 | 50% | 0.503 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -64.9 | -46.3 | 174.9 | -72.6 | 171 | 0 | 0 | 0 | 111.1 | Q190 D191 Q196 G197 N198 | Q190-L194 WeakPolarHBondContact O-CG 3.2Å; Q190-L194 PolarHBondContact O-N 3.11Å; D191-L194 PolarHBondContact O-N 3.04Å; L194-Q196 PolarHBondContact O-N 3.13Å; L194-G197 PolarHBondContact O-N 3.44Å; L194-N198 WeakPolarHBondContact O-CB 3.25Å; L194-N198 PolarHBondContact O-N 3.34Å; L194-N198 PolarHBondContact O-ND2 3.2Å |
| 195 | D | 84.3 | Confident | 85.2 | Confident | 103 Ų | 103 | 101.5 Ų | 101.5 | 55% | 0.551 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -62.3 | -43.1 | 176.8 | -77.1 | -14.4 | 0 | 0 | 0 | 111.5 | D191 N198 Q199 | D191-D195 WeakPolarHBondContact O-CB 3.16Å; D191-D195 PolarHBondContact O-N 3.19Å; D195-N198 PolarHBondContact O-N 3.44Å; D195-Q199 WeakPolarHBondContact O-CB 3.41Å; D195-Q199 PolarHBondContact O-N 3.38Å |
| 196 | Q | 83.3 | Confident | 84.6 | Confident | 107 Ų | 107 | 100.2 Ų | 100.2 | 50% | 0.5 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -66.2 | -37.7 | 176.1 | -169.1 | -178 | 46.2 | 0 | 0 | 112.1 | L192 L194 K200 | L192-Q196 WeakPolarHBondContact O-CB 3.25Å; L192-Q196 PolarHBondContact O-N 2.96Å; L194-Q196 PolarHBondContact O-N 3.13Å; Q196-K200 HydrophobicContact CG-CD 4.47Å; Q196-K200 VanDerWaalsContact O-CB 3.32Å; Q196-K200 WeakPolarHBondContact O-CB 3.36Å; Q196-K200 VanDerWaalsContact O-CG 3.31Å; Q196-K200 WeakPolarHBondContact O-CG 3.16Å; Q196-K200 PolarHBondContact O-N 3.4Å |
| 197 | G | 78.1 | Confident | 84.2 | Confident | 28 Ų | 28 | 99.6 Ų | 99.6 | 29% | 0.289 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -61.7 | -54.1 | 173.4 | 0 | 0 | 0 | 0 | 0 | 111.2 | Q193 L194 Q199 K200 D201 | Q193-G197 PolarHBondContact O-N 3.2Å; L194-G197 PolarHBondContact O-N 3.44Å; G197-Q199 VanDerWaalsContact C-N 3.31Å; G197-Q199 PolarHBondContact O-N 2.93Å; G197-K200 PolarHBondContact O-N 3.2Å; G197-D201 WeakPolarHBondContact O-CB 3.26Å; G197-D201 VanDerWaalsContact O-CG 3.32Å; G197-D201 PolarHBondContact O-N 2.68Å |
| 198 | N | 80.8 | Confident | 83.8 | Confident | 100 Ų | 100 | 98.3 Ų | 98.3 | 54% | 0.535 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -58.3 | -42 | 177.9 | -69.7 | -24.2 | 0 | 0 | 0 | 112 | L194 D195 D201 F202 | L194-N198 WeakPolarHBondContact O-CB 3.25Å; L194-N198 PolarHBondContact O-N 3.34Å; L194-N198 PolarHBondContact O-ND2 3.2Å; D195-N198 PolarHBondContact O-N 3.44Å; N198-D201 PolarHBondContact O-N 3.02Å; N198-F202 VanDerWaalsContact O-CB 3.28Å; N198-F202 WeakPolarHBondContact O-CB 3.26Å; N198-F202 PolarHBondContact O-N 3.47Å |
| 199 | Q | 77 | Confident | 83.5 | Confident | 129 Ų | 129 | 98.6 Ų | 98.6 | 60% | 0.603 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -69.3 | -39.6 | 178.6 | -162.6 | 176.6 | 39.7 | 0 | 0 | 111.6 | D195 G197 F202 I203 | D195-Q199 WeakPolarHBondContact O-CB 3.41Å; D195-Q199 PolarHBondContact O-N 3.38Å; G197-Q199 VanDerWaalsContact C-N 3.31Å; G197-Q199 PolarHBondContact O-N 2.93Å; Q199-F202 PolarHBondContact O-N 2.95Å; Q199-I203 HydrophobicContact CG-CD1 4.1Å; Q199-I203 WeakPolarHBondContact O-CB 3.28Å; Q199-I203 WeakPolarHBondContact O-CD1 3.49Å; Q199-I203 WeakPolarHBondContact O-CG1 3.42Å; Q199-I203 PolarHBondContact O-N 3.3Å |
| 200 | K | 77.1 | Confident | 83.3 | Confident | 108 Ų | 108 | 97.7 Ų | 97.7 | 47% | 0.47 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -64.1 | -40.4 | 172.7 | -81.5 | 178.3 | 179.1 | 172.9 | 0 | 111.9 | Q196 G197 K204 | Q196-K200 HydrophobicContact CG-CD 4.47Å; Q196-K200 VanDerWaalsContact O-CB 3.32Å; Q196-K200 WeakPolarHBondContact O-CB 3.36Å; Q196-K200 VanDerWaalsContact O-CG 3.31Å; Q196-K200 WeakPolarHBondContact O-CG 3.16Å; Q196-K200 PolarHBondContact O-N 3.4Å; G197-K200 PolarHBondContact O-N 3.2Å; K200-K204 WeakPolarHBondContact O-CB 3.48Å; K200-K204 WeakPolarHBondContact O-CG 3.08Å; K200-K204 PolarHBondContact O-N 3.31Å |
| 201 | D | 79.5 | Confident | 83.1 | Confident | 95 Ų | 95 | 97 Ų | 97 | 51% | 0.508 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -71.3 | -37.3 | 179.5 | -68.9 | -21 | 0 | 0 | 0 | 111.3 | G197 N198 A205 | G197-D201 WeakPolarHBondContact O-CB 3.26Å; G197-D201 VanDerWaalsContact O-CG 3.32Å; G197-D201 PolarHBondContact O-N 2.68Å; N198-D201 PolarHBondContact O-N 3.02Å; D201-A205 VanDerWaalsContact O-CB 3.24Å; D201-A205 WeakPolarHBondContact O-CB 2.9Å; D201-A205 PolarHBondContact O-N 3.48Å |
| 202 | F | 75.6 | Confident | 83 | Confident | 138 Ų | 138 | 98.3 Ų | 98.3 | 61% | 0.605 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -64.1 | -47.4 | 172.1 | -174.2 | -93.9 | 0 | 0 | 0 | 112.1 | N198 Q199 A205 Q206 | N198-F202 VanDerWaalsContact O-CB 3.28Å; N198-F202 WeakPolarHBondContact O-CB 3.26Å; N198-F202 PolarHBondContact O-N 3.47Å; Q199-F202 PolarHBondContact O-N 2.95Å; F202-A205 PolarHBondContact O-N 3.27Å; F202-Q206 VanDerWaalsContact O-CB 3.29Å; F202-Q206 WeakPolarHBondContact O-CB 3.17Å; F202-Q206 PolarHBondContact O-N 2.88Å |
| 203 | I | 76.8 | Confident | 83 | Confident | 81 Ų | 81 | 97.4 Ų | 97.4 | 42% | 0.415 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -62 | -45.9 | 177.2 | -68.9 | 165.3 | 0 | 0 | 0 | 110.2 | Q199 A205 Q206 D207 | Q199-I203 HydrophobicContact CG-CD1 4.1Å; Q199-I203 WeakPolarHBondContact O-CB 3.28Å; Q199-I203 WeakPolarHBondContact O-CD1 3.49Å; Q199-I203 WeakPolarHBondContact O-CG1 3.42Å; Q199-I203 PolarHBondContact O-N 3.3Å; I203-A205 PolarHBondContact O-N 2.93Å; I203-Q206 PolarHBondContact O-N 3.34Å; I203-D207 VanDerWaalsContact O-CB 3.31Å; I203-D207 WeakPolarHBondContact O-CB 3.03Å; I203-D207 VanDerWaalsContact O-CG 3.28Å; I203-D207 PolarHBondContact O-N 3.5Å |
| 204 | K | 80.7 | Confident | 83.1 | Confident | 133 Ų | 133 | 95.5 Ų | 95.5 | 58% | 0.578 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -61.4 | -43.6 | 176.7 | -75.5 | 171.8 | -175.6 | 173.9 | 0 | 112.3 | K200 L208 | K200-K204 WeakPolarHBondContact O-CB 3.48Å; K200-K204 WeakPolarHBondContact O-CG 3.08Å; K200-K204 PolarHBondContact O-N 3.31Å; K204-L208 VanDerWaalsContact O-CB 3.22Å; K204-L208 WeakPolarHBondContact O-CB 3.08Å; K204-L208 PolarHBondContact O-N 3.49Å |
| 205 | A | 80.4 | Confident | 83.3 | Confident | 57 Ų | 57 | 95.1 Ų | 95.1 | 47% | 0.471 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -66.2 | -40.1 | 178.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | D201 F202 I203 S209 | D201-A205 VanDerWaalsContact O-CB 3.24Å; D201-A205 WeakPolarHBondContact O-CB 2.9Å; D201-A205 PolarHBondContact O-N 3.48Å; F202-A205 PolarHBondContact O-N 3.27Å; I203-A205 PolarHBondContact O-N 2.93Å; A205-S209 WeakPolarHBondContact O-CB 3.47Å; A205-S209 PolarHBondContact O-N 3.28Å |
| 206 | Q | 82.3 | Confident | 83.6 | Confident | 96 Ų | 96 | 93 Ų | 93 | 45% | 0.449 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -67 | -44.8 | 176.2 | -173.8 | 175.5 | 2.4 | 0 | 0 | 111.6 | F202 I203 L208 S209 N210 | F202-Q206 VanDerWaalsContact O-CB 3.29Å; F202-Q206 WeakPolarHBondContact O-CB 3.17Å; F202-Q206 PolarHBondContact O-N 2.88Å; I203-Q206 PolarHBondContact O-N 3.34Å; Q206-L208 VanDerWaalsContact C-N 3.35Å; Q206-S209 PolarHBondContact O-N 2.93Å; Q206-N210 WeakPolarHBondContact O-CB 3.19Å; Q206-N210 PolarHBondContact O-N 3.34Å; Q206-N210 PolarHBondContact O-ND2 3.42Å |
| 207 | D | 83.8 | Confident | 84 | Confident | 94 Ų | 94 | 90.3 Ų | 90.3 | 50% | 0.503 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -63.8 | -40.4 | 176.1 | -74.7 | -16.8 | 0 | 0 | 0 | 111.4 | I203 N210 L211 | I203-D207 VanDerWaalsContact O-CB 3.31Å; I203-D207 WeakPolarHBondContact O-CB 3.03Å; I203-D207 VanDerWaalsContact O-CG 3.28Å; I203-D207 PolarHBondContact O-N 3.5Å; D207-N210 PolarHBondContact O-N 3.41Å; D207-L211 VanDerWaalsContact O-CB 3.27Å; D207-L211 WeakPolarHBondContact O-CB 3.2Å; D207-L211 PolarHBondContact O-N 2.82Å |
| 208 | L | 86.2 | Confident | 84.7 | Confident | 103 Ų | 103 | 94.8 Ų | 94.8 | 54% | 0.539 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -63.9 | -45.6 | 175.5 | -160.3 | 81.1 | 0 | 0 | 0 | 111 | K204 Q206 L211 E212 | K204-L208 VanDerWaalsContact O-CB 3.22Å; K204-L208 WeakPolarHBondContact O-CB 3.08Å; K204-L208 PolarHBondContact O-N 3.49Å; Q206-L208 VanDerWaalsContact C-N 3.35Å; L208-L211 PolarHBondContact O-N 2.99Å; L208-E212 WeakPolarHBondContact O-CB 3.01Å; L208-E212 WeakPolarHBondContact O-CG 3.21Å; L208-E212 PolarHBondContact O-N 3.37Å |
| 209 | S | 87.3 | Confident | 85.3 | Confident | 53 Ų | 53 | 97.4 Ų | 97.4 | 37% | 0.371 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -64.2 | -42.1 | 177.1 | -177.9 | 0 | 0 | 0 | 0 | 112.1 | A205 Q206 L211 E212 N213 | A205-S209 WeakPolarHBondContact O-CB 3.47Å; A205-S209 PolarHBondContact O-N 3.28Å; Q206-S209 PolarHBondContact O-N 2.93Å; S209-L211 VanDerWaalsContact C-N 3.34Å; S209-L211 PolarHBondContact O-N 3.14Å; S209-E212 PolarHBondContact O-N 3.27Å; S209-N213 WeakPolarHBondContact O-CB 3.28Å; S209-N213 PolarHBondContact O-N 3.21Å; S209-N213 PolarHBondContact O-ND2 3.35Å; S209-N213 VanDerWaalsContact O-ND2 3.12Å |
| 210 | N | 88.1 | Confident | 85.9 | Confident | 79 Ų | 79 | 95.1 Ų | 95.1 | 42% | 0.422 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -61.4 | -44.2 | 174.3 | -72.4 | -23.7 | 0 | 0 | 0 | 110.9 | Q206 D207 N213 T214 | Q206-N210 WeakPolarHBondContact O-CB 3.19Å; Q206-N210 PolarHBondContact O-N 3.34Å; Q206-N210 PolarHBondContact O-ND2 3.42Å; D207-N210 PolarHBondContact O-N 3.41Å; N210-N213 PolarHBondContact O-N 3.25Å; N210-T214 WeakPolarHBondContact O-CG2 3.01Å; N210-T214 PolarHBondContact O-N 3.38Å; N210-T214 PolarHBondContact O-OG1 3.24Å |
| 211 | L | 88.4 | Confident | 86.7 | Confident | 105 Ų | 105 | 96.2 Ų | 96.2 | 55% | 0.55 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -64.5 | -45.3 | 177.9 | -169.1 | 64.8 | 0 | 0 | 0 | 111.2 | D207 L208 S209 N213 T214 V215 | D207-L211 VanDerWaalsContact O-CB 3.27Å; D207-L211 WeakPolarHBondContact O-CB 3.2Å; D207-L211 PolarHBondContact O-N 2.82Å; L208-L211 PolarHBondContact O-N 2.99Å; S209-L211 VanDerWaalsContact C-N 3.34Å; S209-L211 PolarHBondContact O-N 3.14Å; L211-N213 VanDerWaalsContact C-N 3.31Å; L211-N213 PolarHBondContact O-N 3.23Å; L211-T214 WeakPolarHBondContact CA-OG1 3.03Å; L211-T214 PolarHBondContact O-N 3.1Å; L211-T214 PolarHBondContact O-OG1 2.94Å; L211-V215 HydrophobicContact CG-CG2 4.49Å; L211-V215 WeakPolarHBondContact O-CB 3.33Å; L211-V215 VanDerWaalsContact O-CG2 3.27Å; L211-V215 WeakPolarHBondContact O-CG2 3.35Å; L211-V215 PolarHBondContact O-N 2.97Å |
| 212 | E | 87.9 | Confident | 87.2 | Confident | 121 Ų | 121 | 98.3 Ų | 98.3 | 57% | 0.565 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -56.2 | -44.8 | 173.8 | -77.6 | 176.6 | 179.5 | 0 | 0 | 111.8 | L208 S209 V215 A216 | L208-E212 WeakPolarHBondContact O-CB 3.01Å; L208-E212 WeakPolarHBondContact O-CG 3.21Å; L208-E212 PolarHBondContact O-N 3.37Å; S209-E212 PolarHBondContact O-N 3.27Å; E212-V215 PolarHBondContact O-N 3.19Å; E212-A216 VanDerWaalsContact O-CB 3.31Å; E212-A216 WeakPolarHBondContact O-CB 3.46Å; E212-A216 PolarHBondContact O-N 2.97Å |
| 213 | N | 90.9 | Very high | 88 | Confident | 99 Ų | 99 | 96.5 Ų | 96.5 | 53% | 0.529 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -63.6 | -44 | 176.9 | -71.9 | -31.3 | 0 | 0 | 0 | 112.1 | S209 N210 L211 A216 A217 | S209-N213 WeakPolarHBondContact O-CB 3.28Å; S209-N213 PolarHBondContact O-N 3.21Å; S209-N213 PolarHBondContact O-ND2 3.35Å; S209-N213 VanDerWaalsContact O-ND2 3.12Å; N210-N213 PolarHBondContact O-N 3.25Å; L211-N213 VanDerWaalsContact C-N 3.31Å; L211-N213 PolarHBondContact O-N 3.23Å; N213-A216 PolarHBondContact O-N 2.97Å; N213-A217 WeakPolarHBondContact O-CB 3.25Å; N213-A217 PolarHBondContact O-N 2.99Å |
| 214 | T | 91.2 | Very high | 88.7 | Confident | 81 Ų | 81 | 99 Ų | 99 | 50% | 0.497 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -65.5 | -39.8 | 177 | 60.3 | 0 | 0 | 0 | 0 | 112.1 | N210 L211 A217 L218 | N210-T214 WeakPolarHBondContact O-CG2 3.01Å; N210-T214 PolarHBondContact O-N 3.38Å; N210-T214 PolarHBondContact O-OG1 3.24Å; L211-T214 WeakPolarHBondContact CA-OG1 3.03Å; L211-T214 PolarHBondContact O-N 3.1Å; L211-T214 PolarHBondContact O-OG1 2.94Å; T214-A217 PolarHBondContact O-N 3.41Å; T214-L218 VanDerWaalsContact O-CB 3.25Å; T214-L218 WeakPolarHBondContact O-CB 3.38Å; T214-L218 PolarHBondContact O-N 2.8Å |
| 215 | V | 90.2 | Very high | 89.2 | Confident | 88 Ų | 88 | 97 Ų | 97 | 53% | 0.533 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -65.9 | -41.2 | 176.1 | 170.7 | 0 | 0 | 0 | 0 | 110.6 | L211 E212 L218 K219 | L211-V215 HydrophobicContact CG-CG2 4.49Å; L211-V215 WeakPolarHBondContact O-CB 3.33Å; L211-V215 VanDerWaalsContact O-CG2 3.27Å; L211-V215 WeakPolarHBondContact O-CG2 3.35Å; L211-V215 PolarHBondContact O-N 2.97Å; E212-V215 PolarHBondContact O-N 3.19Å; V215-L218 PolarHBondContact O-N 3.33Å; V215-K219 VanDerWaalsContact O-CB 3.22Å; V215-K219 WeakPolarHBondContact O-CB 3.37Å; V215-K219 PolarHBondContact O-N 3.4Å |
| 216 | A | 91.2 | Very high | 89.7 | Confident | 57 Ų | 57 | 98.2 Ų | 98.2 | 47% | 0.471 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -63.9 | -44.6 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | E212 N213 K219 S220 | E212-A216 VanDerWaalsContact O-CB 3.31Å; E212-A216 WeakPolarHBondContact O-CB 3.46Å; E212-A216 PolarHBondContact O-N 2.97Å; N213-A216 PolarHBondContact O-N 2.97Å; A216-K219 PolarHBondContact O-N 3.45Å; A216-S220 WeakPolarHBondContact O-CB 3.39Å; A216-S220 PolarHBondContact O-N 3.42Å |
| 217 | A | 91.4 | Very high | 90.1 | Very high | 51 Ų | 51 | 97.2 Ų | 97.2 | 42% | 0.421 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -61.3 | -48.8 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.4 | N213 T214 K219 S220 E221 | N213-A217 WeakPolarHBondContact O-CB 3.25Å; N213-A217 PolarHBondContact O-N 2.99Å; T214-A217 PolarHBondContact O-N 3.41Å; A217-K219 VanDerWaalsContact C-N 3.31Å; A217-K219 PolarHBondContact O-N 3.04Å; A217-S220 WeakPolarHBondContact O-CB 3.48Å; A217-S220 PolarHBondContact O-N 3.3Å; A217-S220 VanDerWaalsContact O-N 3.1Å; A217-E221 PolarHBondContact O-N 2.88Å |
| 218 | L | 92.3 | Very high | 90.5 | Very high | 123 Ų | 123 | 96 Ų | 96 | 64% | 0.644 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -63.7 | -37.7 | 179.9 | -161.6 | 128.9 | 0 | 0 | 0 | 111.8 | T214 V215 E221 F222 | T214-L218 VanDerWaalsContact O-CB 3.25Å; T214-L218 WeakPolarHBondContact O-CB 3.38Å; T214-L218 PolarHBondContact O-N 2.8Å; V215-L218 PolarHBondContact O-N 3.33Å; L218-E221 PolarHBondContact O-N 2.79Å; L218-F222 VanDerWaalsContact O-CB 3.24Å; L218-F222 WeakPolarHBondContact O-CB 3.46Å; L218-F222 PolarHBondContact O-N 3.36Å |
| 219 | K | 92.4 | Very high | 90.7 | Very high | 155 Ų | 155 | 98.2 Ų | 98.2 | 67% | 0.674 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -64.2 | -42 | 172.8 | -173.9 | 179.4 | -179.3 | -177.5 | 0 | 111.8 | V215 A216 A217 Q223 | V215-K219 VanDerWaalsContact O-CB 3.22Å; V215-K219 WeakPolarHBondContact O-CB 3.37Å; V215-K219 PolarHBondContact O-N 3.4Å; A216-K219 PolarHBondContact O-N 3.45Å; A217-K219 VanDerWaalsContact C-N 3.31Å; A217-K219 PolarHBondContact O-N 3.04Å; K219-Q223 WeakPolarHBondContact O-CB 3.36Å; K219-Q223 PolarHBondContact O-N 3.01Å |
| 220 | S | 91.3 | Very high | 90.8 | Very high | 80 Ų | 80 | 98.5 Ų | 98.5 | 56% | 0.559 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -65 | -44.7 | 176.7 | -173.9 | 0 | 0 | 0 | 0 | 111.8 | A216 A217 Q223 K224 | A216-S220 WeakPolarHBondContact O-CB 3.39Å; A216-S220 PolarHBondContact O-N 3.42Å; A217-S220 WeakPolarHBondContact O-CB 3.48Å; A217-S220 PolarHBondContact O-N 3.3Å; A217-S220 VanDerWaalsContact O-N 3.1Å; S220-Q223 PolarHBondContact O-N 3.37Å; S220-K224 WeakPolarHBondContact O-CB 3.16Å; S220-K224 PolarHBondContact O-N 3.49Å |
| 221 | E | 92 | Very high | 90.9 | Very high | 132 Ų | 132 | 101.1 Ų | 101.1 | 62% | 0.617 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -64.4 | -41.4 | 176.4 | -74.7 | -172.6 | 168.4 | 0 | 0 | 112.3 | A217 L218 K224 T225 | A217-E221 PolarHBondContact O-N 2.88Å; L218-E221 PolarHBondContact O-N 2.79Å; E221-K224 PolarHBondContact O-N 3.37Å; E221-T225 WeakPolarHBondContact O-CB 3.47Å; E221-T225 PolarHBondContact O-N 3.42Å; E221-T225 PolarHBondContact O-OG1 2.87Å |
| 222 | F | 90.6 | Very high | 90.9 | Very high | 138 Ų | 138 | 101 Ų | 101 | 61% | 0.605 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -62.6 | -46.4 | 175.6 | -171.9 | -98 | 0 | 0 | 0 | 111.2 | L218 K224 T225 L226 | L218-F222 VanDerWaalsContact O-CB 3.24Å; L218-F222 WeakPolarHBondContact O-CB 3.46Å; L218-F222 PolarHBondContact O-N 3.36Å; F222-K224 VanDerWaalsContact C-N 3.33Å; F222-K224 PolarHBondContact O-N 2.83Å; F222-T225 PolarHBondContact O-N 3.23Å; F222-L226 HydrophobicContact CE1-CD1 3.78Å; F222-L226 HydrophobicContact CZ-CD1 4.07Å; F222-L226 VanDerWaalsContact O-CB 3.31Å; F222-L226 WeakPolarHBondContact O-CB 3.35Å; F222-L226 PolarHBondContact O-N 3.1Å |
| 223 | Q | 92.8 | Very high | 91.1 | Very high | 101 Ų | 101 | 100.2 Ų | 100.2 | 47% | 0.472 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -60.6 | -43 | 176.2 | -173.2 | 64.7 | 41.9 | 0 | 0 | 111.8 | K219 S220 L226 N227 | K219-Q223 WeakPolarHBondContact O-CB 3.36Å; K219-Q223 PolarHBondContact O-N 3.01Å; S220-Q223 PolarHBondContact O-N 3.37Å; Q223-L226 PolarHBondContact O-N 2.95Å; Q223-N227 PolarHBondContact NE2-OD1 3.39Å; Q223-N227 WeakPolarHBondContact O-CB 3.44Å; Q223-N227 VanDerWaalsContact O-CG 3.32Å; Q223-N227 PolarHBondContact O-N 2.86Å |
| 224 | K | 92.3 | Very high | 91.1 | Very high | 134 Ų | 134 | 101.9 Ų | 101.9 | 58% | 0.583 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -62.1 | -48.5 | 177.1 | -173.8 | -179.3 | 176.8 | -175 | 0 | 111.2 | S220 E221 F222 L226 N227 D228 | S220-K224 WeakPolarHBondContact O-CB 3.16Å; S220-K224 PolarHBondContact O-N 3.49Å; E221-K224 PolarHBondContact O-N 3.37Å; F222-K224 VanDerWaalsContact C-N 3.33Å; F222-K224 PolarHBondContact O-N 2.83Å; K224-L226 VanDerWaalsContact C-N 3.28Å; K224-L226 PolarHBondContact O-N 3.2Å; K224-N227 PolarHBondContact O-N 3Å; K224-D228 WeakPolarHBondContact O-CB 3.38Å; K224-D228 PolarHBondContact O-N 3.03Å |
| 225 | T | 90.6 | Very high | 91 | Very high | 91 Ų | 91 | 100.5 Ų | 100.5 | 56% | 0.558 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -63.5 | -36 | 179.8 | -55.9 | 0 | 0 | 0 | 0 | 111.6 | E221 F222 K229 | E221-T225 WeakPolarHBondContact O-CB 3.47Å; E221-T225 PolarHBondContact O-N 3.42Å; E221-T225 PolarHBondContact O-OG1 2.87Å; F222-T225 PolarHBondContact O-N 3.23Å; T225-K229 VanDerWaalsContact O-CB 3.23Å; T225-K229 WeakPolarHBondContact O-CB 3.28Å; T225-K229 PolarHBondContact O-N 3.38Å |
| 226 | L | 91.3 | Very high | 91 | Very high | 81 Ų | 81 | 102.1 Ų | 102.1 | 42% | 0.424 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -68.9 | -40.9 | 176.7 | -158.8 | 130.3 | 0 | 0 | 0 | 111.6 | F222 Q223 K224 T230 | F222-L226 HydrophobicContact CE1-CD1 3.78Å; F222-L226 HydrophobicContact CZ-CD1 4.07Å; F222-L226 VanDerWaalsContact O-CB 3.31Å; F222-L226 WeakPolarHBondContact O-CB 3.35Å; F222-L226 PolarHBondContact O-N 3.1Å; Q223-L226 PolarHBondContact O-N 2.95Å; K224-L226 VanDerWaalsContact C-N 3.28Å; K224-L226 PolarHBondContact O-N 3.2Å; L226-T230 WeakPolarHBondContact O-CB 3.48Å; L226-T230 PolarHBondContact O-N 3.35Å; L226-T230 PolarHBondContact O-OG1 2.94Å |
| 227 | N | 90.9 | Very high | 90.9 | Very high | 75 Ų | 75 | 104.8 Ų | 104.8 | 40% | 0.401 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -64 | -49.8 | 172.8 | -72.8 | -2.9 | 0 | 0 | 0 | 111.3 | Q223 K224 K229 T230 E231 | Q223-N227 PolarHBondContact NE2-OD1 3.39Å; Q223-N227 WeakPolarHBondContact O-CB 3.44Å; Q223-N227 VanDerWaalsContact O-CG 3.32Å; Q223-N227 PolarHBondContact O-N 2.86Å; K224-N227 PolarHBondContact O-N 3Å; N227-K229 VanDerWaalsContact C-N 3.29Å; N227-K229 PolarHBondContact O-N 3.04Å; N227-T230 CarbonylContact O-C 3.17Å; N227-T230 WeakPolarHBondContact O-CA 3.39Å; N227-T230 WeakPolarHBondContact O-CB 3.41Å; N227-T230 PolarHBondContact O-N 2.73Å; N227-E231 PolarHBondContact O-N 3.15Å |
| 228 | D | 90.6 | Very high | 90.9 | Very high | 70 Ų | 70 | 108.7 Ų | 108.7 | 37% | 0.374 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -58.4 | -41.7 | 178.5 | -67.1 | -12.1 | 0 | 0 | 0 | 110.9 | K224 T230 E231 N232 | K224-D228 WeakPolarHBondContact O-CB 3.38Å; K224-D228 PolarHBondContact O-N 3.03Å; D228-T230 VanDerWaalsContact C-N 3.35Å; D228-E231 PolarHBondContact O-N 3.04Å; D228-N232 VanDerWaalsContact O-CB 3.26Å; D228-N232 WeakPolarHBondContact O-CB 3.48Å; D228-N232 PolarHBondContact O-N 3Å; D228-N232 PolarHBondContact O-ND2 3.36Å; D228-N232 VanDerWaalsContact O-ND2 3.13Å |
| 229 | K | 90.5 | Very high | 90.9 | Very high | 149 Ų | 149 | 107.4 Ų | 107.4 | 65% | 0.648 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -64.1 | -40.3 | 175.1 | -173.2 | 174.8 | -178.7 | 179.1 | 0 | 111.9 | T225 N227 Q233 | T225-K229 VanDerWaalsContact O-CB 3.23Å; T225-K229 WeakPolarHBondContact O-CB 3.28Å; T225-K229 PolarHBondContact O-N 3.38Å; N227-K229 VanDerWaalsContact C-N 3.29Å; N227-K229 PolarHBondContact O-N 3.04Å; K229-Q233 VanDerWaalsContact O-CB 3.28Å; K229-Q233 WeakPolarHBondContact O-CB 3.42Å; K229-Q233 PolarHBondContact O-N 3.27Å |
| 230 | T | 90.8 | Very high | 90.8 | Very high | 59 Ų | 59 | 104.6 Ų | 104.6 | 36% | 0.362 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -68.6 | -42.3 | 178.8 | -55.2 | 0 | 0 | 0 | 0 | 111.4 | L226 N227 D228 Q233 K234 | L226-T230 WeakPolarHBondContact O-CB 3.48Å; L226-T230 PolarHBondContact O-N 3.35Å; L226-T230 PolarHBondContact O-OG1 2.94Å; N227-T230 CarbonylContact O-C 3.17Å; N227-T230 WeakPolarHBondContact O-CA 3.39Å; N227-T230 WeakPolarHBondContact O-CB 3.41Å; N227-T230 PolarHBondContact O-N 2.73Å; D228-T230 VanDerWaalsContact C-N 3.35Å; T230-Q233 PolarHBondContact O-N 3.46Å; T230-K234 WeakPolarHBondContact O-CG 3.39Å; T230-K234 PolarHBondContact O-N 2.97Å |
| 231 | E | 89.3 | Confident | 90.8 | Very high | 133 Ų | 133 | 102.8 Ų | 102.8 | 62% | 0.621 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -65.2 | -45.7 | 175.4 | -74.7 | -173.4 | 174.1 | 0 | 0 | 111.7 | N227 D228 Q233 K234 S235 | N227-E231 PolarHBondContact O-N 3.15Å; D228-E231 PolarHBondContact O-N 3.04Å; E231-Q233 VanDerWaalsContact C-N 3.33Å; E231-Q233 PolarHBondContact O-N 3.33Å; E231-K234 PolarHBondContact O-N 2.63Å; E231-S235 PolarHBondContact O-N 3.38Å |
| 232 | N | 89.3 | Confident | 90.7 | Very high | 103 Ų | 103 | 99.9 Ų | 99.9 | 55% | 0.551 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -61.1 | -41.5 | 175.2 | -76.3 | -30.8 | 0 | 0 | 0 | 111.9 | D228 S235 L236 | D228-N232 VanDerWaalsContact O-CB 3.26Å; D228-N232 WeakPolarHBondContact O-CB 3.48Å; D228-N232 PolarHBondContact O-N 3Å; D228-N232 PolarHBondContact O-ND2 3.36Å; D228-N232 VanDerWaalsContact O-ND2 3.13Å; N232-S235 PolarHBondContact O-N 2.87Å; N232-L236 WeakPolarHBondContact O-CB 3.16Å; N232-L236 WeakPolarHBondContact O-CG 3.27Å; N232-L236 PolarHBondContact O-N 2.92Å |
| 233 | Q | 90.8 | Very high | 90.7 | Very high | 105 Ų | 105 | 96.1 Ų | 96.1 | 49% | 0.491 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -61.1 | -46.9 | 175.5 | 179.9 | 175.8 | -14.7 | 0 | 0 | 111.3 | K229 T230 E231 S235 L236 E237 | K229-Q233 VanDerWaalsContact O-CB 3.28Å; K229-Q233 WeakPolarHBondContact O-CB 3.42Å; K229-Q233 PolarHBondContact O-N 3.27Å; T230-Q233 PolarHBondContact O-N 3.46Å; E231-Q233 VanDerWaalsContact C-N 3.33Å; E231-Q233 PolarHBondContact O-N 3.33Å; Q233-S235 PolarHBondContact O-N 3.33Å; Q233-L236 PolarHBondContact O-N 3.32Å; Q233-E237 WeakPolarHBondContact CG-OE1 3.45Å; Q233-E237 PolarHBondContact NE2-OE1 3.17Å; Q233-E237 WeakPolarHBondContact O-CG 3.45Å; Q233-E237 PolarHBondContact O-N 3.23Å |
| 234 | K | 91 | Very high | 90.6 | Very high | 133 Ų | 133 | 97.6 Ų | 97.6 | 58% | 0.578 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -59.9 | -45 | 176.3 | -75 | 176.4 | 179.5 | 179.6 | 0 | 112.1 | T230 E231 L236 E237 E238 | T230-K234 WeakPolarHBondContact O-CG 3.39Å; T230-K234 PolarHBondContact O-N 2.97Å; E231-K234 PolarHBondContact O-N 2.63Å; K234-L236 PolarHBondContact O-N 3.38Å; K234-E237 PolarHBondContact O-N 3.37Å; K234-E238 WeakPolarHBondContact O-CB 3.38Å; K234-E238 PolarHBondContact O-N 3.41Å |
| 235 | S | 90.2 | Very high | 90.5 | Very high | 53 Ų | 53 | 97.5 Ų | 97.5 | 37% | 0.371 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -62.9 | -41.3 | 177.6 | -179.6 | 0 | 0 | 0 | 0 | 112.1 | E231 N232 Q233 E238 N239 | E231-S235 PolarHBondContact O-N 3.38Å; N232-S235 PolarHBondContact O-N 2.87Å; Q233-S235 PolarHBondContact O-N 3.33Å; S235-E238 PolarHBondContact O-N 2.95Å; S235-N239 WeakPolarHBondContact O-CB 3.28Å; S235-N239 VanDerWaalsContact O-CG 3.23Å; S235-N239 PolarHBondContact O-N 3Å; S235-N239 PolarHBondContact O-ND2 3.44Å; S235-N239 PolarHBondContact OG-ND2 2.94Å |
| 236 | L | 89.7 | Confident | 90.5 | Very high | 121 Ų | 121 | 96.3 Ų | 96.3 | 63% | 0.634 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -63.3 | -43.6 | 174.6 | -83.2 | 159.3 | 0 | 0 | 0 | 112 | N232 Q233 K234 N239 L240 | N232-L236 WeakPolarHBondContact O-CB 3.16Å; N232-L236 WeakPolarHBondContact O-CG 3.27Å; N232-L236 PolarHBondContact O-N 2.92Å; Q233-L236 PolarHBondContact O-N 3.32Å; K234-L236 PolarHBondContact O-N 3.38Å; L236-N239 PolarHBondContact O-N 2.94Å; L236-L240 WeakPolarHBondContact O-CB 3.4Å; L236-L240 PolarHBondContact O-N 2.92Å |
| 237 | E | 89.9 | Confident | 90.4 | Very high | 113 Ų | 113 | 97.2 Ų | 97.2 | 53% | 0.528 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -61.5 | -43.4 | 176.1 | -74.9 | 172.8 | -170.2 | 0 | 0 | 111.6 | Q233 K234 L240 A241 | Q233-E237 WeakPolarHBondContact CG-OE1 3.45Å; Q233-E237 PolarHBondContact NE2-OE1 3.17Å; Q233-E237 WeakPolarHBondContact O-CG 3.45Å; Q233-E237 PolarHBondContact O-N 3.23Å; K234-E237 PolarHBondContact O-N 3.37Å; E237-L240 PolarHBondContact O-N 3.1Å; E237-A241 WeakPolarHBondContact O-CB 3.46Å; E237-A241 PolarHBondContact O-N 3.17Å |
| 238 | E | 91.1 | Very high | 90.4 | Very high | 134 Ų | 134 | 98.5 Ų | 98.5 | 63% | 0.626 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -65.5 | -46.6 | 176.6 | -173.1 | 174.5 | -166.8 | 0 | 0 | 112 | K234 S235 L240 A241 T242 | K234-E238 WeakPolarHBondContact O-CB 3.38Å; K234-E238 PolarHBondContact O-N 3.41Å; S235-E238 PolarHBondContact O-N 2.95Å; E238-L240 VanDerWaalsContact C-N 3.3Å; E238-L240 PolarHBondContact O-N 2.89Å; E238-A241 WeakPolarHBondContact O-CB 3.31Å; E238-A241 PolarHBondContact O-N 3.08Å; E238-T242 PolarHBondContact O-N 3.03Å; E238-T242 PolarHBondContact O-OG1 3Å; E238-T242 VanDerWaalsContact O-OG1 3.07Å |
| 239 | N | 90.9 | Very high | 90.3 | Very high | 96 Ų | 96 | 101.9 Ų | 101.9 | 51% | 0.513 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -61.1 | -39.9 | 176.1 | -75.5 | -37.5 | 0 | 0 | 0 | 111.9 | S235 L236 T242 A243 | S235-N239 WeakPolarHBondContact O-CB 3.28Å; S235-N239 VanDerWaalsContact O-CG 3.23Å; S235-N239 PolarHBondContact O-N 3Å; S235-N239 PolarHBondContact O-ND2 3.44Å; S235-N239 PolarHBondContact OG-ND2 2.94Å; L236-N239 PolarHBondContact O-N 2.94Å; N239-T242 PolarHBondContact O-N 3.27Å; N239-A243 VanDerWaalsContact O-CB 3.29Å; N239-A243 WeakPolarHBondContact O-CB 3.41Å; N239-A243 PolarHBondContact O-N 3.23Å |
| 240 | L | 91.3 | Very high | 90.3 | Very high | 95 Ų | 95 | 98.4 Ų | 98.4 | 50% | 0.497 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -65.5 | -41 | 176.8 | -169.2 | 160.7 | 0 | 0 | 0 | 111 | L236 E237 E238 K244 | L236-L240 WeakPolarHBondContact O-CB 3.4Å; L236-L240 PolarHBondContact O-N 2.92Å; E237-L240 PolarHBondContact O-N 3.1Å; E238-L240 VanDerWaalsContact C-N 3.3Å; E238-L240 PolarHBondContact O-N 2.89Å; L240-K244 HydrophobicContact CD2-CD 3.69Å; L240-K244 HydrophobicContact CD2-CG 4.16Å; L240-K244 WeakPolarHBondContact O-CB 3.48Å; L240-K244 WeakPolarHBondContact O-CG 3.43Å; L240-K244 PolarHBondContact O-N 3.31Å |
| 241 | A | 90.6 | Very high | 90.1 | Very high | 43 Ų | 43 | 101 Ų | 101 | 36% | 0.355 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -62.6 | -47.3 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | E237 E238 A243 K244 H245 | E237-A241 WeakPolarHBondContact O-CB 3.46Å; E237-A241 PolarHBondContact O-N 3.17Å; E238-A241 WeakPolarHBondContact O-CB 3.31Å; E238-A241 PolarHBondContact O-N 3.08Å; A241-A243 PolarHBondContact O-N 3.47Å; A241-K244 WeakPolarHBondContact O-CB 3.44Å; A241-K244 PolarHBondContact O-N 3.45Å; A241-H245 PolarHBondContact O-CD2 3.25Å; A241-H245 PolarHBondContact O-N 2.89Å |
| 242 | T | 91.1 | Very high | 90.1 | Very high | 71 Ų | 71 | 101.2 Ų | 101.2 | 44% | 0.436 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -60.5 | -46.7 | 176.5 | -54.9 | 0 | 0 | 0 | 0 | 111.7 | E238 N239 K244 H245 D246 | E238-T242 PolarHBondContact O-N 3.03Å; E238-T242 PolarHBondContact O-OG1 3Å; E238-T242 VanDerWaalsContact O-OG1 3.07Å; N239-T242 PolarHBondContact O-N 3.27Å; T242-K244 VanDerWaalsContact C-N 3.3Å; T242-K244 PolarHBondContact O-N 3.48Å; T242-H245 PolarHBondContact O-N 3.47Å; T242-H245 VanDerWaalsContact O-N 3.11Å; T242-D246 PolarHBondContact O-N 2.89Å |
| 243 | A | 89.8 | Confident | 90 | Very high | 58 Ų | 58 | 101.9 Ų | 101.9 | 48% | 0.479 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -61.5 | -37.5 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | N239 A241 D246 L247 | N239-A243 VanDerWaalsContact O-CB 3.29Å; N239-A243 WeakPolarHBondContact O-CB 3.41Å; N239-A243 PolarHBondContact O-N 3.23Å; A241-A243 PolarHBondContact O-N 3.47Å; A243-D246 PolarHBondContact O-N 2.74Å; A243-L247 VanDerWaalsContact O-CB 3.29Å; A243-L247 WeakPolarHBondContact O-CB 3.44Å; A243-L247 PolarHBondContact O-N 3.02Å |
| 244 | K | 89.9 | Confident | 89.9 | Confident | 132 Ų | 132 | 101.4 Ų | 101.4 | 57% | 0.574 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -62.4 | -44.5 | 172.5 | -82.2 | 178.4 | 174.8 | 169.6 | 0 | 111.9 | L240 A241 T242 L247 L248 | L240-K244 HydrophobicContact CD2-CD 3.69Å; L240-K244 HydrophobicContact CD2-CG 4.16Å; L240-K244 WeakPolarHBondContact O-CB 3.48Å; L240-K244 WeakPolarHBondContact O-CG 3.43Å; L240-K244 PolarHBondContact O-N 3.31Å; A241-K244 WeakPolarHBondContact O-CB 3.44Å; A241-K244 PolarHBondContact O-N 3.45Å; T242-K244 VanDerWaalsContact C-N 3.3Å; T242-K244 PolarHBondContact O-N 3.48Å; K244-L247 PolarHBondContact O-N 3.35Å; K244-L248 WeakPolarHBondContact O-CG 3.16Å; K244-L248 PolarHBondContact O-N 3.25Å |
| 245 | H | 90.9 | Very high | 89.8 | Confident | 132 Ų | 132 | 100.4 Ų | 100.4 | 61% | 0.611 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -63.5 | -43.4 | 177 | -76.5 | -60.8 | 0 | 0 | 0 | 112.2 | A241 T242 L248 R249 | A241-H245 PolarHBondContact O-CD2 3.25Å; A241-H245 PolarHBondContact O-N 2.89Å; T242-H245 PolarHBondContact O-N 3.47Å; T242-H245 VanDerWaalsContact O-N 3.11Å; H245-L248 PolarHBondContact O-N 3.44Å; H245-R249 WeakPolarHBondContact O-CB 3.4Å; H245-R249 PolarHBondContact O-N 2.98Å |
| 246 | D | 89.9 | Confident | 89.6 | Confident | 66 Ų | 66 | 102.5 Ų | 102.5 | 35% | 0.353 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -63.7 | -42 | 176 | -84.1 | -35.4 | 0 | 0 | 0 | 112.3 | T242 A243 R249 V250 | T242-D246 PolarHBondContact O-N 2.89Å; A243-D246 PolarHBondContact O-N 2.74Å; D246-R249 WeakPolarHBondContact O-CB 3.35Å; D246-R249 PolarHBondContact O-N 3.34Å; D246-R249 IonicContact OD1-CZ 2.93Å; D246-R249 IonicContact OD1-NE 2.97Å; D246-R249 IonicContact OD1-NH2 3.41Å; D246-R249 PolarHBondContact OD1-NH2 3.42Å; D246-V250 WeakPolarHBondContact O-CG2 3.43Å; D246-V250 PolarHBondContact O-N 2.84Å |
| 247 | L | 89.9 | Confident | 89.3 | Confident | 101 Ų | 101 | 99.4 Ų | 99.4 | 53% | 0.529 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -61.7 | -45.5 | 176.8 | -170.6 | 154.9 | 0 | 0 | 0 | 111.3 | A243 K244 R249 V250 Q251 | A243-L247 VanDerWaalsContact O-CB 3.29Å; A243-L247 WeakPolarHBondContact O-CB 3.44Å; A243-L247 PolarHBondContact O-N 3.02Å; K244-L247 PolarHBondContact O-N 3.35Å; L247-R249 VanDerWaalsContact C-N 3.31Å; L247-R249 PolarHBondContact O-N 3Å; L247-V250 PolarHBondContact O-N 3.03Å; L247-Q251 VanDerWaalsContact CD2-CD 3.45Å; L247-Q251 HydrophobicContact CD2-CG 3.94Å; L247-Q251 WeakPolarHBondContact O-CB 3.34Å; L247-Q251 WeakPolarHBondContact O-CG 3.48Å; L247-Q251 PolarHBondContact O-N 2.92Å |
| 248 | L | 90.3 | Very high | 89 | Confident | 102 Ų | 102 | 99.5 Ų | 99.5 | 53% | 0.534 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -60.2 | -42.3 | 175.4 | -75.2 | 170.5 | 0 | 0 | 0 | 111.6 | K244 H245 Q251 E252 | K244-L248 WeakPolarHBondContact O-CG 3.16Å; K244-L248 PolarHBondContact O-N 3.25Å; H245-L248 PolarHBondContact O-N 3.44Å; L248-Q251 PolarHBondContact O-N 3.28Å; L248-E252 PolarHBondContact O-N 3.48Å |
| 249 | R | 90.1 | Very high | 88.8 | Confident | 140 Ų | 140 | 99.7 Ų | 99.7 | 53% | 0.528 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -62.4 | -44.3 | 176.3 | -177.6 | 176.2 | 64.2 | 151.5 | -4.2 | 111.9 | H245 D246 L247 E252 Q253 | H245-R249 WeakPolarHBondContact O-CB 3.4Å; H245-R249 PolarHBondContact O-N 2.98Å; D246-R249 WeakPolarHBondContact O-CB 3.35Å; D246-R249 PolarHBondContact O-N 3.34Å; D246-R249 IonicContact OD1-CZ 2.93Å; D246-R249 IonicContact OD1-NE 2.97Å; D246-R249 IonicContact OD1-NH2 3.41Å; D246-R249 PolarHBondContact OD1-NH2 3.42Å; L247-R249 VanDerWaalsContact C-N 3.31Å; L247-R249 PolarHBondContact O-N 3Å; R249-E252 PolarHBondContact O-N 2.97Å; R249-Q253 WeakPolarHBondContact O-CG 3.47Å; R249-Q253 PolarHBondContact O-N 2.94Å |
| 250 | V | 89.5 | Confident | 88.4 | Confident | 76 Ų | 76 | 100.8 Ų | 100.8 | 46% | 0.461 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -66 | -40.7 | 176.7 | 172.4 | 0 | 0 | 0 | 0 | 110.8 | D246 L247 E252 Q253 L254 | D246-V250 WeakPolarHBondContact O-CG2 3.43Å; D246-V250 PolarHBondContact O-N 2.84Å; L247-V250 PolarHBondContact O-N 3.03Å; V250-E252 VanDerWaalsContact C-N 3.33Å; V250-E252 PolarHBondContact O-N 3.13Å; V250-Q253 PolarHBondContact O-N 3.45Å; V250-L254 VanDerWaalsContact O-CB 3.24Å; V250-L254 WeakPolarHBondContact O-CB 3.38Å; V250-L254 PolarHBondContact O-N 3.35Å |
| 251 | Q | 87.3 | Confident | 88 | Confident | 114 Ų | 114 | 102.3 Ų | 102.3 | 53% | 0.533 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -59.5 | -43 | 173.9 | -81.4 | -177.6 | -31.1 | 0 | 0 | 111.8 | L247 L248 L254 H255 | L247-Q251 VanDerWaalsContact CD2-CD 3.45Å; L247-Q251 HydrophobicContact CD2-CG 3.94Å; L247-Q251 WeakPolarHBondContact O-CB 3.34Å; L247-Q251 WeakPolarHBondContact O-CG 3.48Å; L247-Q251 PolarHBondContact O-N 2.92Å; L248-Q251 PolarHBondContact O-N 3.28Å; Q251-L254 PolarHBondContact O-N 2.68Å; Q251-H255 WeakPolarHBondContact O-CB 3.42Å; Q251-H255 PolarHBondContact O-N 3.16Å |
| 252 | E | 89.2 | Confident | 87.6 | Confident | 137 Ų | 137 | 104.8 Ų | 104.8 | 64% | 0.64 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -66.3 | -43.3 | 177.1 | -172.6 | 169.4 | -157.5 | 0 | 0 | 111.9 | L248 R249 V250 L254 H255 M256 | L248-E252 PolarHBondContact O-N 3.48Å; R249-E252 PolarHBondContact O-N 2.97Å; V250-E252 VanDerWaalsContact C-N 3.33Å; V250-E252 PolarHBondContact O-N 3.13Å; E252-L254 VanDerWaalsContact C-N 3.34Å; E252-L254 PolarHBondContact O-N 3.25Å; E252-H255 PolarHBondContact O-N 2.85Å; E252-M256 WeakPolarHBondContact O-CB 3.47Å; E252-M256 VanDerWaalsContact O-CG 3.3Å; E252-M256 WeakPolarHBondContact O-CG 3.38Å; E252-M256 PolarHBondContact O-N 3.39Å |
| 253 | Q | 87.4 | Confident | 87.1 | Confident | 117 Ų | 117 | 107.9 Ų | 107.9 | 55% | 0.547 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -61.2 | -41.8 | 173.7 | -74.5 | 179.1 | -11.2 | 0 | 0 | 112.2 | R249 V250 M256 A257 | R249-Q253 WeakPolarHBondContact O-CG 3.47Å; R249-Q253 PolarHBondContact O-N 2.94Å; V250-Q253 PolarHBondContact O-N 3.45Å; Q253-M256 PolarHBondContact O-N 2.82Å; Q253-A257 WeakPolarHBondContact O-CB 3.4Å; Q253-A257 PolarHBondContact O-N 3.19Å |
| 254 | L | 87.2 | Confident | 86.8 | Confident | 96 Ų | 96 | 111.6 Ų | 111.6 | 50% | 0.503 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -66 | -45.1 | 178.4 | -168.8 | 145.1 | 0 | 0 | 0 | 110.7 | V250 Q251 E252 M256 A257 E258 | V250-L254 VanDerWaalsContact O-CB 3.24Å; V250-L254 WeakPolarHBondContact O-CB 3.38Å; V250-L254 PolarHBondContact O-N 3.35Å; Q251-L254 PolarHBondContact O-N 2.68Å; E252-L254 VanDerWaalsContact C-N 3.34Å; E252-L254 PolarHBondContact O-N 3.25Å; L254-M256 VanDerWaalsContact C-N 3.31Å; L254-M256 PolarHBondContact O-N 3.03Å; L254-A257 PolarHBondContact O-N 2.94Å; L254-E258 HydrophobicContact CD2-CG 4.05Å; L254-E258 WeakPolarHBondContact CD2-OE1 3.46Å; L254-E258 WeakPolarHBondContact O-CB 3.43Å; L254-E258 WeakPolarHBondContact O-CG 3.46Å; L254-E258 PolarHBondContact O-N 2.98Å |
| 255 | H | 88.7 | Confident | 86.4 | Confident | 111 Ų | 111 | 110.6 Ų | 110.6 | 51% | 0.514 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -59.9 | -40.3 | 173.8 | 178.5 | -80.7 | 0 | 0 | 0 | 112 | Q251 E252 K259 | Q251-H255 WeakPolarHBondContact O-CB 3.42Å; Q251-H255 PolarHBondContact O-N 3.16Å; E252-H255 PolarHBondContact O-N 2.85Å; H255-K259 WeakPolarHBondContact O-CB 3.34Å; H255-K259 PolarHBondContact O-N 3.33Å |
| 256 | M | 86.8 | Confident | 85.7 | Confident | 97 Ų | 97 | 109 Ų | 109 | 48% | 0.478 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -66.6 | -42 | 174.9 | -73.2 | -61.5 | -68.8 | 0 | 0 | 112.1 | E252 Q253 L254 K259 E260 | E252-M256 WeakPolarHBondContact O-CB 3.47Å; E252-M256 VanDerWaalsContact O-CG 3.3Å; E252-M256 WeakPolarHBondContact O-CG 3.38Å; E252-M256 PolarHBondContact O-N 3.39Å; Q253-M256 PolarHBondContact O-N 2.82Å; L254-M256 VanDerWaalsContact C-N 3.31Å; L254-M256 PolarHBondContact O-N 3.03Å; M256-K259 PolarHBondContact O-N 2.87Å; M256-E260 PolarHBondContact O-N 3.49Å |
| 257 | A | 83.8 | Confident | 85 | Confident | 57 Ų | 57 | 110.7 Ų | 110.7 | 47% | 0.471 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -64.7 | -41.2 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | Q253 L254 K259 E260 L261 | Q253-A257 WeakPolarHBondContact O-CB 3.4Å; Q253-A257 PolarHBondContact O-N 3.19Å; L254-A257 PolarHBondContact O-N 2.94Å; A257-K259 VanDerWaalsContact C-N 3.34Å; A257-K259 PolarHBondContact O-N 2.99Å; A257-E260 PolarHBondContact O-N 3.22Å; A257-L261 VanDerWaalsContact O-CB 3.29Å; A257-L261 WeakPolarHBondContact O-CB 3.44Å; A257-L261 PolarHBondContact O-N 3.22Å |
| 258 | E | 84.4 | Confident | 84.6 | Confident | 114 Ų | 114 | 109.2 Ų | 109.2 | 53% | 0.533 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -59 | -45.6 | 172.6 | -76.4 | 178.7 | 159.8 | 0 | 0 | 111 | L254 E260 L261 E262 | L254-E258 HydrophobicContact CD2-CG 4.05Å; L254-E258 WeakPolarHBondContact CD2-OE1 3.46Å; L254-E258 WeakPolarHBondContact O-CB 3.43Å; L254-E258 WeakPolarHBondContact O-CG 3.46Å; L254-E258 PolarHBondContact O-N 2.98Å; E258-E260 PolarHBondContact O-N 3.19Å; E258-L261 PolarHBondContact O-N 2.99Å; E258-E262 WeakPolarHBondContact O-CB 3.43Å; E258-E262 PolarHBondContact O-N 3.34Å |
| 259 | K | 85.8 | Confident | 83.8 | Confident | 138 Ų | 138 | 107.2 Ų | 107.2 | 60% | 0.6 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -64.8 | -38.2 | 177.7 | -167.6 | 175.8 | -177.5 | 177.4 | 0 | 112.6 | H255 M256 A257 K263 | H255-K259 WeakPolarHBondContact O-CB 3.34Å; H255-K259 PolarHBondContact O-N 3.33Å; M256-K259 PolarHBondContact O-N 2.87Å; A257-K259 VanDerWaalsContact C-N 3.34Å; A257-K259 PolarHBondContact O-N 2.99Å; K259-K263 WeakPolarHBondContact O-CB 3.37Å; K259-K263 PolarHBondContact O-N 3.46Å; K259-K263 VanDerWaalsContact O-N 3.09Å |
| 260 | E | 83.5 | Confident | 83 | Confident | 119 Ų | 119 | 104 Ų | 104 | 56% | 0.556 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -69.4 | -40.2 | 173.8 | -77.5 | -168.5 | 174.1 | 0 | 0 | 112.7 | M256 A257 E258 K263 K264 | M256-E260 PolarHBondContact O-N 3.49Å; A257-E260 PolarHBondContact O-N 3.22Å; E258-E260 PolarHBondContact O-N 3.19Å; E260-K263 WeakPolarHBondContact O-CB 3.48Å; E260-K263 PolarHBondContact O-N 3.32Å; E260-K264 PolarHBondContact O-N 3.28Å |
| 261 | L | 82.3 | Confident | 82.5 | Confident | 127 Ų | 127 | 103.8 Ų | 103.8 | 67% | 0.665 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -64.3 | -44.7 | 177.1 | -165.7 | 77.9 | 0 | 0 | 0 | 110.5 | A257 E258 K263 K264 F265 | A257-L261 VanDerWaalsContact O-CB 3.29Å; A257-L261 WeakPolarHBondContact O-CB 3.44Å; A257-L261 PolarHBondContact O-N 3.22Å; E258-L261 PolarHBondContact O-N 2.99Å; L261-K263 VanDerWaalsContact C-N 3.3Å; L261-K263 PolarHBondContact O-N 3.25Å; L261-K264 CarbonylContact O-C 3.59Å; L261-K264 PolarHBondContact O-N 2.96Å; L261-F265 VanDerWaalsContact O-CB 3.31Å; L261-F265 WeakPolarHBondContact O-CB 3.44Å; L261-F265 PolarHBondContact O-N 3.5Å |
| 262 | E | 81.4 | Confident | 82 | Confident | 96 Ų | 96 | 104.5 Ų | 104.5 | 45% | 0.449 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -57.4 | -44.4 | 173.3 | -179.1 | 56.6 | -142.8 | 0 | 0 | 110.8 | E258 K264 F265 Q266 | E258-E262 WeakPolarHBondContact O-CB 3.43Å; E258-E262 PolarHBondContact O-N 3.34Å; E262-K264 PolarHBondContact O-N 3Å; E262-F265 PolarHBondContact O-N 3.28Å; E262-Q266 WeakPolarHBondContact O-CG 3.43Å; E262-Q266 PolarHBondContact O-N 3.48Å; E262-Q266 PolarHBondContact OE1-NE2 3.37Å |
| 263 | K | 81.8 | Confident | 81.4 | Confident | 135 Ų | 135 | 102.3 Ų | 102.3 | 59% | 0.587 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -63.1 | -42.2 | 175.8 | -167.9 | 178.4 | -178.6 | -177.6 | 0 | 112.3 | K259 E260 L261 Q267 | K259-K263 WeakPolarHBondContact O-CB 3.37Å; K259-K263 PolarHBondContact O-N 3.46Å; K259-K263 VanDerWaalsContact O-N 3.09Å; E260-K263 WeakPolarHBondContact O-CB 3.48Å; E260-K263 PolarHBondContact O-N 3.32Å; L261-K263 VanDerWaalsContact C-N 3.3Å; L261-K263 PolarHBondContact O-N 3.25Å; K263-Q267 VanDerWaalsContact O-CG 3.26Å; K263-Q267 WeakPolarHBondContact O-CG 3.44Å; K263-Q267 PolarHBondContact O-N 2.85Å |
| 264 | K | 83 | Confident | 80.8 | Confident | 137 Ų | 137 | 101.9 Ų | 101.9 | 60% | 0.596 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -68.7 | -37.8 | 176 | -77 | -171.8 | 179.4 | 176.4 | 0 | 112.1 | E260 L261 E262 Q267 T268 | E260-K264 PolarHBondContact O-N 3.28Å; L261-K264 CarbonylContact O-C 3.59Å; L261-K264 PolarHBondContact O-N 2.96Å; E262-K264 PolarHBondContact O-N 3Å; K264-Q267 CarbonylContact O-C 3.45Å; K264-Q267 WeakPolarHBondContact O-CA 3.46Å; K264-Q267 PolarHBondContact O-N 3.03Å; K264-Q267 VanDerWaalsContact O-N 3.1Å; K264-T268 PolarHBondContact O-N 3.3Å; K264-T268 PolarHBondContact O-OG1 2.97Å |
| 265 | F | 81.2 | Confident | 80.5 | Confident | 110 Ų | 110 | 103.3 Ų | 103.3 | 48% | 0.482 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -60.5 | -49 | 175 | 179.5 | -102.9 | 0 | 0 | 0 | 110.6 | L261 E262 Q267 T268 Y271 | L261-F265 VanDerWaalsContact O-CB 3.31Å; L261-F265 WeakPolarHBondContact O-CB 3.44Å; L261-F265 PolarHBondContact O-N 3.5Å; E262-F265 PolarHBondContact O-N 3.28Å; F265-Q267 PolarHBondContact O-N 3.47Å; F265-Q267 VanDerWaalsContact O-N 3.15Å; F265-T268 WeakPolarHBondContact O-CB 3.4Å; F265-T268 PolarHBondContact O-N 3.41Å; F265-T268 PolarHBondContact O-OG1 3.3Å; F265-Y271 HydrophobicContact CD1-CD2 4.15Å; F265-Y271 HydrophobicContact CD1-CE2 4.43Å; F265-Y271 AromaticContact CE1-CD2 3.47Å; F265-Y271 HydrophobicContact CE1-CD2 3.47Å; F265-Y271 VanDerWaalsContact CE1-CD2 3.47Å; F265-Y271 AromaticContact CE1-CE2 3.74Å; F265-Y271 HydrophobicContact CE1-CE2 3.74Å; F265-Y271 HydrophobicContact CE1-CG 4.27Å; F265-Y271 AromaticContact CZ-CD2 3.88Å; F265-Y271 HydrophobicContact CZ-CD2 3.88Å; F265-Y271 HydrophobicContact CZ-CE2 4.47Å; F265-Y271 WeakPolarHBondContact O-CB 3.34Å |
| 266 | Q | 75.5 | Confident | 80 | Confident | 98 Ų | 98 | 102.1 Ų | 102.1 | 46% | 0.458 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -59.3 | -26.2 | 173.8 | -70.3 | 177.8 | 18.3 | 0 | 0 | 113.5 | E262 Y271 | E262-Q266 WeakPolarHBondContact O-CG 3.43Å; E262-Q266 PolarHBondContact O-N 3.48Å; E262-Q266 PolarHBondContact OE1-NE2 3.37Å; Q266-Y271 HydrophobicContact CB-CE1 4.38Å; Q266-Y271 HydrophobicContact CG-CE1 4.25Å |
| 267 | Q | 76.4 | Confident | 79.5 | Confident | 103 Ų | 103 | 102.2 Ų | 102.2 | 48% | 0.481 | 51% | 0.506 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -90.4 | -3.8 | 177 | -70.4 | 177.5 | 4.4 | 0 | 0 | 114.3 | K263 K264 F265 R272 | K263-Q267 VanDerWaalsContact O-CG 3.26Å; K263-Q267 WeakPolarHBondContact O-CG 3.44Å; K263-Q267 PolarHBondContact O-N 2.85Å; K264-Q267 CarbonylContact O-C 3.45Å; K264-Q267 WeakPolarHBondContact O-CA 3.46Å; K264-Q267 PolarHBondContact O-N 3.03Å; K264-Q267 VanDerWaalsContact O-N 3.1Å; F265-Q267 PolarHBondContact O-N 3.47Å; F265-Q267 VanDerWaalsContact O-N 3.15Å; Q267-R272 PolarHBondContact O-NH1 3.35Å; Q267-R272 PolarHBondContact O-NH2 3.15Å |
| 268 | T | 81.4 | Confident | 79.2 | Confident | 69 Ų | 69 | 104.3 Ų | 104.3 | 42% | 0.423 | 51% | 0.509 | S | S | . | . | S | Bend | trans | -74.4 | 139.6 | -176.5 | -59 | 0 | 0 | 0 | 0 | 110.6 | K264 F265 A270 Y271 R272 | K264-T268 PolarHBondContact O-N 3.3Å; K264-T268 PolarHBondContact O-OG1 2.97Å; F265-T268 WeakPolarHBondContact O-CB 3.4Å; F265-T268 PolarHBondContact O-N 3.41Å; F265-T268 PolarHBondContact O-OG1 3.3Å; T268-A270 HydrophobicContact CG2-CB 4.42Å; T268-A270 PolarHBondContact O-N 3.3Å; T268-A270 VanDerWaalsContact O-N 3.16Å; T268-Y271 PolarHBondContact O-N 3.26Å; T268-R272 WeakPolarHBondContact O-CB 3.28Å; T268-R272 PolarHBondContact O-N 2.76Å |
| 269 | A | 72.3 | Confident | 78.9 | Confident | 60 Ų | 60 | 102 Ų | 102 | 50% | 0.496 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -56.8 | -32.8 | -176.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | N273 | A269-N273 WeakPolarHBondContact O-CB 3.3Å; A269-N273 PolarHBondContact O-N 3.27Å; A269-N273 PolarHBondContact O-ND2 2.91Å |
| 270 | A | 73.4 | Confident | 78.6 | Confident | 72 Ų | 72 | 100.9 Ų | 100.9 | 60% | 0.595 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -65.5 | -47.8 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | T268 M274 | T268-A270 HydrophobicContact CG2-CB 4.42Å; T268-A270 PolarHBondContact O-N 3.3Å; T268-A270 VanDerWaalsContact O-N 3.16Å; A270-M274 VanDerWaalsContact O-CB 3.23Å; A270-M274 WeakPolarHBondContact O-CB 3.48Å; A270-M274 PolarHBondContact O-N 3.05Å |
| 271 | Y | 80.4 | Confident | 78.5 | Confident | 73 Ų | 73 | 101.3 Ų | 101.3 | 29% | 0.286 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -67 | -39.9 | 176 | -173.8 | -93.6 | 0 | 0 | 0 | 111.4 | F265 Q266 T268 M274 K275 | F265-Y271 HydrophobicContact CD1-CD2 4.15Å; F265-Y271 HydrophobicContact CD1-CE2 4.43Å; F265-Y271 AromaticContact CE1-CD2 3.47Å; F265-Y271 HydrophobicContact CE1-CD2 3.47Å; F265-Y271 VanDerWaalsContact CE1-CD2 3.47Å; F265-Y271 AromaticContact CE1-CE2 3.74Å; F265-Y271 HydrophobicContact CE1-CE2 3.74Å; F265-Y271 HydrophobicContact CE1-CG 4.27Å; F265-Y271 AromaticContact CZ-CD2 3.88Å; F265-Y271 HydrophobicContact CZ-CD2 3.88Å; F265-Y271 HydrophobicContact CZ-CE2 4.47Å; F265-Y271 WeakPolarHBondContact O-CB 3.34Å; Q266-Y271 HydrophobicContact CB-CE1 4.38Å; Q266-Y271 HydrophobicContact CG-CE1 4.25Å; T268-Y271 PolarHBondContact O-N 3.26Å; Y271-M274 PolarHBondContact O-N 3.07Å; Y271-K275 HydrophobicContact CE1-CD 4.27Å; Y271-K275 VanDerWaalsContact O-CB 3.24Å; Y271-K275 WeakPolarHBondContact O-CB 3.35Å; Y271-K275 PolarHBondContact O-N 3.03Å |
| 272 | R | 76.6 | Confident | 78.4 | Confident | 129 Ų | 129 | 99.8 Ų | 99.8 | 49% | 0.487 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -65 | -46.8 | 177.5 | -144.7 | -176 | -80.2 | 126.2 | -9.8 | 111 | Q267 T268 K275 E276 | Q267-R272 PolarHBondContact O-NH1 3.35Å; Q267-R272 PolarHBondContact O-NH2 3.15Å; T268-R272 WeakPolarHBondContact O-CB 3.28Å; T268-R272 PolarHBondContact O-N 2.76Å; R272-K275 PolarHBondContact O-N 2.93Å; R272-E276 VanDerWaalsContact O-CB 3.29Å; R272-E276 WeakPolarHBondContact O-CB 3.32Å; R272-E276 PolarHBondContact O-N 3.09Å |
| 273 | N | 76.3 | Confident | 78.3 | Confident | 91 Ų | 91 | 99.5 Ų | 99.5 | 49% | 0.487 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -62.5 | -41.1 | 172.4 | -79.9 | -20.5 | 0 | 0 | 0 | 111.8 | A269 E276 I277 | A269-N273 WeakPolarHBondContact O-CB 3.3Å; A269-N273 PolarHBondContact O-N 3.27Å; A269-N273 PolarHBondContact O-ND2 2.91Å; N273-E276 PolarHBondContact O-N 2.78Å; N273-I277 WeakPolarHBondContact O-CB 3.36Å; N273-I277 WeakPolarHBondContact O-CD1 3.37Å; N273-I277 WeakPolarHBondContact O-CG1 3.27Å; N273-I277 PolarHBondContact O-N 3.09Å |
| 274 | M | 75.6 | Confident | 78.1 | Confident | 107 Ų | 107 | 98.7 Ų | 98.7 | 53% | 0.527 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -65.8 | -41.1 | 177.7 | -169.1 | 168.8 | 79.1 | 0 | 0 | 111.4 | A270 Y271 I277 L278 | A270-M274 VanDerWaalsContact O-CB 3.23Å; A270-M274 WeakPolarHBondContact O-CB 3.48Å; A270-M274 PolarHBondContact O-N 3.05Å; Y271-M274 PolarHBondContact O-N 3.07Å; M274-I277 PolarHBondContact O-N 3.38Å; M274-L278 HydrophobicContact CG-CD1 4.17Å; M274-L278 VanDerWaalsContact O-CB 3.27Å; M274-L278 WeakPolarHBondContact O-CB 3.41Å; M274-L278 WeakPolarHBondContact O-CG 3.44Å; M274-L278 PolarHBondContact O-N 3.4Å |
| 275 | K | 79.3 | Confident | 77.8 | Confident | 126 Ų | 126 | 95.8 Ų | 95.8 | 55% | 0.548 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -64.6 | -39.4 | 173.2 | -172.6 | 173.6 | -177.4 | 174.9 | 0 | 111.5 | Y271 R272 L278 T279 | Y271-K275 HydrophobicContact CE1-CD 4.27Å; Y271-K275 VanDerWaalsContact O-CB 3.24Å; Y271-K275 WeakPolarHBondContact O-CB 3.35Å; Y271-K275 PolarHBondContact O-N 3.03Å; R272-K275 PolarHBondContact O-N 2.93Å; K275-L278 PolarHBondContact O-N 2.88Å; K275-T279 WeakPolarHBondContact O-CB 3.11Å; K275-T279 PolarHBondContact O-N 3.49Å; K275-T279 PolarHBondContact O-OG1 3.02Å |
| 276 | E | 78.1 | Confident | 77.7 | Confident | 87 Ų | 87 | 97.4 Ų | 97.4 | 41% | 0.407 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -71.4 | -36.9 | 177.6 | -146.9 | -173.3 | 148.7 | 0 | 0 | 112.3 | R272 N273 T279 K280 | R272-E276 VanDerWaalsContact O-CB 3.29Å; R272-E276 WeakPolarHBondContact O-CB 3.32Å; R272-E276 PolarHBondContact O-N 3.09Å; N273-E276 PolarHBondContact O-N 2.78Å; E276-T279 WeakPolarHBondContact CA-OG1 3.35Å; E276-T279 PolarHBondContact O-OG1 3.12Å; E276-T279 VanDerWaalsContact O-OG1 3.09Å; E276-K280 WeakPolarHBondContact O-CB 3.33Å; E276-K280 VanDerWaalsContact O-CG 3.27Å; E276-K280 WeakPolarHBondContact O-CG 3.45Å; E276-K280 PolarHBondContact O-N 3.33Å; E276-K280 WeakPolarHBondContact OE1-CE 3.41Å; E276-K280 IonicContact OE1-NZ 3.46Å; E276-K280 PolarHBondContact OE1-NZ 3.42Å |
| 277 | I | 78.1 | Confident | 77.8 | Confident | 98 Ų | 98 | 97.5 Ų | 97.5 | 50% | 0.503 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -69.2 | -42.1 | 172.2 | -69.4 | 163.9 | 0 | 0 | 0 | 110.2 | N273 M274 K281 | N273-I277 WeakPolarHBondContact O-CB 3.36Å; N273-I277 WeakPolarHBondContact O-CD1 3.37Å; N273-I277 WeakPolarHBondContact O-CG1 3.27Å; N273-I277 PolarHBondContact O-N 3.09Å; M274-I277 PolarHBondContact O-N 3.38Å; I277-K281 HydrophobicContact CG2-CD 4.34Å; I277-K281 HydrophobicContact CG2-CG 4.3Å; I277-K281 VanDerWaalsContact O-CB 3.23Å; I277-K281 WeakPolarHBondContact O-CB 3.46Å; I277-K281 WeakPolarHBondContact O-CG 3.43Å; I277-K281 PolarHBondContact O-N 3.29Å |
| 278 | L | 76.8 | Confident | 77.5 | Confident | 102 Ų | 102 | 97.8 Ų | 97.8 | 53% | 0.534 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -64.1 | -42.2 | 175.7 | -90.7 | 157.9 | 0 | 0 | 0 | 111.7 | M274 K275 N282 | M274-L278 HydrophobicContact CG-CD1 4.17Å; M274-L278 VanDerWaalsContact O-CB 3.27Å; M274-L278 WeakPolarHBondContact O-CB 3.41Å; M274-L278 WeakPolarHBondContact O-CG 3.44Å; M274-L278 PolarHBondContact O-N 3.4Å; K275-L278 PolarHBondContact O-N 2.88Å; L278-N282 VanDerWaalsContact O-CB 3.29Å; L278-N282 WeakPolarHBondContact O-CB 3.49Å; L278-N282 PolarHBondContact O-N 3.41Å |
| 279 | T | 78.5 | Confident | 77.1 | Confident | 66 Ų | 66 | 103.3 Ų | 103.3 | 41% | 0.405 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -67.4 | -48.1 | 174.3 | 39.2 | 0 | 0 | 0 | 0 | 111.3 | K275 E276 K281 N282 D283 | K275-T279 WeakPolarHBondContact O-CB 3.11Å; K275-T279 PolarHBondContact O-N 3.49Å; K275-T279 PolarHBondContact O-OG1 3.02Å; E276-T279 WeakPolarHBondContact CA-OG1 3.35Å; E276-T279 PolarHBondContact O-OG1 3.12Å; E276-T279 VanDerWaalsContact O-OG1 3.09Å; T279-K281 PolarHBondContact O-N 3.34Å; T279-N282 CarbonylContact O-C 3.58Å; T279-N282 PolarHBondContact O-N 3.49Å; T279-N282 VanDerWaalsContact O-N 3.14Å; T279-D283 WeakPolarHBondContact O-CB 3.46Å; T279-D283 VanDerWaalsContact O-CG 3.29Å; T279-D283 PolarHBondContact O-N 3.01Å |
| 280 | K | 78.9 | Confident | 77.2 | Confident | 113 Ų | 113 | 107.9 Ų | 107.9 | 49% | 0.491 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -60.3 | -40.2 | 174.6 | -78.6 | 173.5 | -176.6 | 161.2 | 0 | 113.1 | E276 D283 Q284 | E276-K280 WeakPolarHBondContact O-CB 3.33Å; E276-K280 VanDerWaalsContact O-CG 3.27Å; E276-K280 WeakPolarHBondContact O-CG 3.45Å; E276-K280 PolarHBondContact O-N 3.33Å; E276-K280 WeakPolarHBondContact OE1-CE 3.41Å; E276-K280 IonicContact OE1-NZ 3.46Å; E276-K280 PolarHBondContact OE1-NZ 3.42Å; K280-D283 PolarHBondContact O-N 3.49Å; K280-Q284 VanDerWaalsContact O-CB 3.24Å; K280-Q284 WeakPolarHBondContact O-CB 3.41Å; K280-Q284 WeakPolarHBondContact O-CG 3.41Å; K280-Q284 PolarHBondContact O-N 2.85Å |
| 281 | K | 80.5 | Confident | 76.9 | Confident | 129 Ų | 129 | 113.1 Ų | 113.1 | 56% | 0.561 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -67.7 | -39.1 | 174.5 | -79.9 | -164.5 | 175.1 | -164.1 | 0 | 111.3 | I277 T279 D283 Q284 I285 | I277-K281 HydrophobicContact CG2-CD 4.34Å; I277-K281 HydrophobicContact CG2-CG 4.3Å; I277-K281 VanDerWaalsContact O-CB 3.23Å; I277-K281 WeakPolarHBondContact O-CB 3.46Å; I277-K281 WeakPolarHBondContact O-CG 3.43Å; I277-K281 PolarHBondContact O-N 3.29Å; T279-K281 PolarHBondContact O-N 3.34Å; K281-D283 VanDerWaalsContact C-N 3.34Å; K281-Q284 PolarHBondContact O-N 2.98Å; K281-I285 VanDerWaalsContact O-CB 3.29Å; K281-I285 WeakPolarHBondContact O-CB 3.3Å; K281-I285 WeakPolarHBondContact O-CD1 3.4Å; K281-I285 WeakPolarHBondContact O-CG1 3.48Å; K281-I285 PolarHBondContact O-N 2.74Å |
| 282 | N | 80.3 | Confident | 76.1 | Confident | 95 Ų | 95 | 114.4 Ų | 114.4 | 51% | 0.508 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -64.8 | -38.5 | 173 | -88.2 | -22.3 | 0 | 0 | 0 | 112.3 | L278 T279 I285 K286 | L278-N282 VanDerWaalsContact O-CB 3.29Å; L278-N282 WeakPolarHBondContact O-CB 3.49Å; L278-N282 PolarHBondContact O-N 3.41Å; T279-N282 CarbonylContact O-C 3.58Å; T279-N282 PolarHBondContact O-N 3.49Å; T279-N282 VanDerWaalsContact O-N 3.14Å; N282-I285 PolarHBondContact O-N 3.09Å; N282-K286 PolarHBondContact O-N 2.63Å |
| 283 | D | 79.8 | Confident | 75.5 | Confident | 89 Ų | 89 | 111.9 Ų | 111.9 | 48% | 0.476 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -72 | -38.9 | 176.9 | -68.4 | -26.6 | 0 | 0 | 0 | 111.3 | T279 K280 K281 K286 D287 | T279-D283 WeakPolarHBondContact O-CB 3.46Å; T279-D283 VanDerWaalsContact O-CG 3.29Å; T279-D283 PolarHBondContact O-N 3.01Å; K280-D283 PolarHBondContact O-N 3.49Å; K281-D283 VanDerWaalsContact C-N 3.34Å; D283-K286 CarbonylContact O-C 3.58Å; D283-K286 WeakPolarHBondContact O-CB 3.43Å; D283-K286 PolarHBondContact O-N 3.44Å; D283-D287 WeakPolarHBondContact O-CB 3.49Å; D283-D287 PolarHBondContact O-N 3.44Å |
| 284 | Q | 77.6 | Confident | 74.9 | Confident | 118 Ų | 118 | 114.4 Ų | 114.4 | 55% | 0.551 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -64.1 | -38.7 | 169.8 | -76.7 | 174.3 | -12.6 | 0 | 0 | 111.8 | K280 K281 K286 D287 L288 | K280-Q284 VanDerWaalsContact O-CB 3.24Å; K280-Q284 WeakPolarHBondContact O-CB 3.41Å; K280-Q284 WeakPolarHBondContact O-CG 3.41Å; K280-Q284 PolarHBondContact O-N 2.85Å; K281-Q284 PolarHBondContact O-N 2.98Å; Q284-K286 VanDerWaalsContact C-N 3.34Å; Q284-D287 PolarHBondContact O-N 2.91Å; Q284-L288 WeakPolarHBondContact O-CB 3.2Å; Q284-L288 WeakPolarHBondContact O-CG 3.1Å; Q284-L288 PolarHBondContact O-N 2.95Å |
| 285 | I | 77.9 | Confident | 74.2 | Confident | 77 Ų | 77 | 119.2 Ų | 119.2 | 40% | 0.395 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -64.8 | -40.2 | 172.6 | -74.4 | 165.4 | 0 | 0 | 0 | 109.8 | K281 N282 R289 | K281-I285 VanDerWaalsContact O-CB 3.29Å; K281-I285 WeakPolarHBondContact O-CB 3.3Å; K281-I285 WeakPolarHBondContact O-CD1 3.4Å; K281-I285 WeakPolarHBondContact O-CG1 3.48Å; K281-I285 PolarHBondContact O-N 2.74Å; N282-I285 PolarHBondContact O-N 3.09Å; I285-R289 HydrophobicContact CG2-CG 4.47Å; I285-R289 VanDerWaalsContact O-CB 3.25Å; I285-R289 WeakPolarHBondContact O-CB 3.4Å; I285-R289 WeakPolarHBondContact O-CG 3.27Å; I285-R289 PolarHBondContact O-N 3.4Å |
| 286 | K | 78.8 | Confident | 73 | Confident | 143 Ų | 143 | 118.8 Ų | 118.8 | 62% | 0.622 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -63.3 | -45.3 | 173.6 | -87.4 | -179.1 | 175.5 | 176.3 | 0 | 112.2 | N282 D283 Q284 R289 K290 | N282-K286 PolarHBondContact O-N 2.63Å; D283-K286 CarbonylContact O-C 3.58Å; D283-K286 WeakPolarHBondContact O-CB 3.43Å; D283-K286 PolarHBondContact O-N 3.44Å; Q284-K286 VanDerWaalsContact C-N 3.34Å; K286-R289 PolarHBondContact O-N 2.96Å; K286-K290 WeakPolarHBondContact O-CB 3.38Å; K286-K290 PolarHBondContact O-N 2.96Å |
| 287 | D | 76.1 | Confident | 72 | Confident | 100 Ų | 100 | 120.6 Ų | 120.6 | 54% | 0.535 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -71.8 | -37 | 179.6 | -90.9 | -5.8 | 0 | 0 | 0 | 112.5 | D283 Q284 K290 R291 | D283-D287 WeakPolarHBondContact O-CB 3.49Å; D283-D287 PolarHBondContact O-N 3.44Å; Q284-D287 PolarHBondContact O-N 2.91Å; D287-K290 CarbonylContact O-C 3.59Å; D287-K290 WeakPolarHBondContact O-CB 3.35Å; D287-K290 PolarHBondContact O-N 3.29Å; D287-R291 WeakPolarHBondContact O-CB 3.48Å; D287-R291 PolarHBondContact O-N 3.09Å |
| 288 | L | 71.8 | Confident | 70.6 | Confident | 109 Ų | 109 | 124.7 Ų | 124.7 | 57% | 0.571 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -64.9 | -42.1 | 171.2 | -75.7 | 168.4 | 0 | 0 | 0 | 110.4 | Q284 K290 R291 L292 | Q284-L288 WeakPolarHBondContact O-CB 3.2Å; Q284-L288 WeakPolarHBondContact O-CG 3.1Å; Q284-L288 PolarHBondContact O-N 2.95Å; L288-K290 VanDerWaalsContact C-N 3.31Å; L288-K290 PolarHBondContact O-N 3.25Å; L288-R291 PolarHBondContact O-N 3.4Å; L288-L292 WeakPolarHBondContact O-CB 3.23Å; L288-L292 PolarHBondContact O-N 3.31Å |
| 289 | R | 72.9 | Confident | 69.3 | Low | 185 Ų | 185 | 130.9 Ų | 130.9 | 70% | 0.698 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -60.1 | -39.7 | 170.1 | -76.3 | 173 | -179.3 | -167.6 | 0.1 | 111.8 | I285 K286 A293 | I285-R289 HydrophobicContact CG2-CG 4.47Å; I285-R289 VanDerWaalsContact O-CB 3.25Å; I285-R289 WeakPolarHBondContact O-CB 3.4Å; I285-R289 WeakPolarHBondContact O-CG 3.27Å; I285-R289 PolarHBondContact O-N 3.4Å; K286-R289 PolarHBondContact O-N 2.96Å; R289-A293 WeakPolarHBondContact O-CB 3.39Å; R289-A293 PolarHBondContact O-N 2.94Å; R289-A293 VanDerWaalsContact O-N 3.13Å |
| 290 | K | 72.7 | Confident | 68.8 | Low | 156 Ų | 156 | 134.2 Ų | 134.2 | 68% | 0.678 | 64% | 0.644 | S | S | * | * | H | α-helix | trans | -69.1 | -32.7 | 177.6 | -132.9 | 179.3 | -175.5 | -177.8 | 0 | 113.5 | K286 D287 L288 | K286-K290 WeakPolarHBondContact O-CB 3.38Å; K286-K290 PolarHBondContact O-N 2.96Å; D287-K290 CarbonylContact O-C 3.59Å; D287-K290 WeakPolarHBondContact O-CB 3.35Å; D287-K290 PolarHBondContact O-N 3.29Å; L288-K290 VanDerWaalsContact C-N 3.31Å; L288-K290 PolarHBondContact O-N 3.25Å |
| 291 | R | 68.8 | Low | 68.3 | Low | 182 Ų | 182 | 135.3 Ų | 135.3 | 69% | 0.687 | 65% | 0.652 | S | S | * | * | H | α-helix | trans | -83.5 | -32.5 | 175.1 | -91.9 | 179.2 | 172.4 | 155.6 | -1.5 | 113.1 | D287 L288 A293 Q294 | D287-R291 WeakPolarHBondContact O-CB 3.48Å; D287-R291 PolarHBondContact O-N 3.09Å; L288-R291 PolarHBondContact O-N 3.4Å; R291-A293 VanDerWaalsContact C-N 3.26Å; R291-A293 PolarHBondContact O-N 2.88Å; R291-Q294 WeakPolarHBondContact O-CB 3.46Å; R291-Q294 PolarHBondContact O-N 3.47Å; R291-Q294 VanDerWaalsContact O-N 3.1Å |
| 292 | L | 62.6 | Low | 67.6 | Low | 101 Ų | 101 | 135.6 Ų | 135.6 | 53% | 0.529 | 66% | 0.657 | S | S | . | * | H | α-helix | trans | -60.5 | -41.4 | 170.4 | -130.5 | 83.8 | 0 | 0 | 0 | 109.8 | L288 Q294 Y295 E296 | L288-L292 WeakPolarHBondContact O-CB 3.23Å; L288-L292 PolarHBondContact O-N 3.31Å; L292-Q294 PolarHBondContact O-N 2.79Å; L292-Y295 PolarHBondContact O-N 3.34Å; L292-E296 PolarHBondContact O-N 3.39Å |
| 293 | A | 65.1 | Low | 66.8 | Low | 75 Ų | 75 | 138 Ų | 138 | 62% | 0.62 | 67% | 0.666 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -61.2 | -7.1 | 174 | 0 | 0 | 0 | 0 | 0 | 115.1 | R289 R291 | R289-A293 WeakPolarHBondContact O-CB 3.39Å; R289-A293 PolarHBondContact O-N 2.94Å; R289-A293 VanDerWaalsContact O-N 3.13Å; R291-A293 VanDerWaalsContact C-N 3.26Å; R291-A293 PolarHBondContact O-N 2.88Å |
| 294 | Q | 62 | Low | 66 | Low | 145 Ų | 145 | 141.1 Ų | 141.1 | 68% | 0.678 | 68% | 0.677 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -98.8 | -14.7 | 173.8 | -70.1 | -174.3 | -16.6 | 0 | 0 | 114.1 | R291 L292 | R291-Q294 WeakPolarHBondContact O-CB 3.46Å; R291-Q294 PolarHBondContact O-N 3.47Å; R291-Q294 VanDerWaalsContact O-N 3.1Å; L292-Q294 PolarHBondContact O-N 2.79Å |
| 295 | Y | 62.1 | Low | 65.3 | Low | 207 Ų | 207 | 142.6 Ų | 142.6 | 81% | 0.812 | 69% | 0.686 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -130.9 | -5.6 | -174.9 | -73.7 | -78 | 0 | 0 | 0 | 114.7 | L292 | L292-Y295 PolarHBondContact O-N 3.34Š|
| 296 | E | 53.8 | Low | 64.4 | Low | 117 Ų | 117 | 147.3 Ų | 147.3 | 55% | 0.547 | 71% | 0.707 | S | S | . | * | S | Bend | trans | -118.2 | 123.8 | 158.2 | -72.6 | 179.1 | 160.5 | 0 | 0 | 107.6 | L292 E298 | L292-E296 PolarHBondContact O-N 3.39Å; E296-E298 PolarHBondContact O-N 3.37Å |
| 297 | P | 57.2 | Low | 63.2 | Low | 125 Ų | 125 | 147.6 Ų | 147.6 | 81% | 0.812 | 71% | 0.713 | S | S | * | * | trans | -65.7 | 115.7 | 161.6 | 29.2 | -26.4 | 0 | 0 | 0 | 105.7 | D299 | P297-D299 PolarHBondContact O-N 2.74Š| ||
| 298 | E | 47.9 | Very low | 62.2 | Low | 185 Ų | 185 | 151.6 Ų | 151.6 | 86% | 0.864 | 73% | 0.728 | S | S | * | * | trans | -74.5 | 109.7 | 159.7 | -85.1 | -164.1 | 163.4 | 0 | 0 | 107.3 | E296 | E296-E298 PolarHBondContact O-N 3.37Š| ||
| 299 | D | 49.3 | Very low | 61.3 | Low | 232 Ų | 232 | 155.5 Ų | 155.5 | 100% | 1.241 | 74% | 0.742 | S | S | * | * | trans | -39.2 | 0 | 132.1 | -77.5 | -39.5 | 0 | 0 | 0 | 112.1 | P297 | P297-D299 PolarHBondContact O-N 2.74Š|
Retrieved 299 of 299 residues in 2074.1 ms
(Link to these results)