| 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 | 33.5 | Very low | 46.6 | Very low | 249 Ų | 249 | 138.9 Ų | 138.9 | 100% | 1.227 | 80% | 0.798 | S | S | * | * | 0 | 95.9 | 0 | -90.5 | 178.7 | 173.7 | 0 | 0 | 106.4 | A3 | M1-A3 PolarHBondContact O-N 3.17Š| |||
| 2 | E | 32.1 | Very low | 49.2 | Very low | 194 Ų | 194 | 133.6 Ų | 133.6 | 91% | 0.907 | 77% | 0.77 | S | S | * | * | trans | -70.2 | 120.9 | 177.6 | -63.2 | -170.3 | 150.7 | 0 | 0 | 107.8 | E4 | E2-E4 PolarHBondContact O-N 3.39Š| ||
| 3 | A | 38.6 | Very low | 51 | Low | 96 Ų | 96 | 133.3 Ų | 133.3 | 79% | 0.793 | 76% | 0.764 | S | S | * | * | trans | -72.5 | 110.4 | 168 | 0 | 0 | 0 | 0 | 0 | 106.2 | M1 A5 | M1-A3 PolarHBondContact O-N 3.17Å; A3-A5 PolarHBondContact O-N 3.11Å | ||
| 4 | E | 41.3 | Very low | 52.6 | Low | 190 Ų | 190 | 135.7 Ų | 135.7 | 89% | 0.888 | 77% | 0.765 | S | S | * | * | trans | -51.3 | 111.8 | 167.3 | -79.4 | -154.8 | 146.4 | 0 | 0 | 108.5 | E2 G6 | E2-E4 PolarHBondContact O-N 3.39Å; E4-G6 VanDerWaalsContact C-N 3.26Å; E4-G6 PolarHBondContact O-N 3.48Å | ||
| 5 | A | 41 | Very low | 54.2 | Low | 99 Ų | 99 | 133.1 Ų | 133.1 | 82% | 0.818 | 75% | 0.745 | S | S | * | * | trans | -66.3 | 95.4 | 163.6 | 0 | 0 | 0 | 0 | 0 | 106 | A3 G7 | A3-A5 PolarHBondContact O-N 3.11Å; A5-G7 PolarHBondContact O-N 3.29Å; A5-G7 VanDerWaalsContact O-N 3.15Å | ||
| 6 | G | 41 | Very low | 55.4 | Low | 64 Ų | 64 | 129.6 Ų | 129.6 | 66% | 0.66 | 72% | 0.722 | S | S | * | * | trans | -47 | 122.5 | 174.3 | 0 | 0 | 0 | 0 | 0 | 109.4 | E4 L8 | E4-G6 VanDerWaalsContact C-N 3.26Å; E4-G6 PolarHBondContact O-N 3.48Å; G6-L8 PolarHBondContact O-N 3.45Å; G6-L8 VanDerWaalsContact O-N 3.07Å | ||
| 7 | G | 42.3 | Very low | 56.7 | Low | 72 Ų | 72 | 127.1 Ų | 127.1 | 74% | 0.742 | 72% | 0.721 | S | S | * | * | trans | -53.1 | 114.4 | 179.7 | 0 | 0 | 0 | 0 | 0 | 110 | A5 E9 | A5-G7 PolarHBondContact O-N 3.29Å; A5-G7 VanDerWaalsContact O-N 3.15Å; G7-E9 PolarHBondContact O-N 3.49Å | ||
| 8 | L | 50.9 | Low | 58.1 | Low | 124 Ų | 124 | 124.9 Ų | 124.9 | 65% | 0.649 | 72% | 0.721 | S | S | * | * | trans | -71.3 | 104.1 | 156.5 | -65.2 | 169.6 | 0 | 0 | 0 | 104.4 | G6 E10 E31 | G6-L8 PolarHBondContact O-N 3.45Å; G6-L8 VanDerWaalsContact O-N 3.07Å; L8-E10 VanDerWaalsContact C-N 3.26Å; L8-E10 PolarHBondContact O-N 2.77Å; L8-E31 WeakPolarHBondContact CD2-OE2 3.35Å | ||
| 9 | E | 61.2 | Low | 59.4 | Low | 185 Ų | 185 | 120.8 Ų | 120.8 | 86% | 0.864 | 70% | 0.696 | S | S | * | * | trans | -61.2 | 96.3 | 167.5 | -73.8 | -173.3 | 158 | 0 | 0 | 107.2 | G7 L11 | G7-E9 PolarHBondContact O-N 3.49Å; E9-L11 PolarHBondContact O-N 2.94Å | ||
| 10 | E | 63.6 | Low | 60.9 | Low | 184 Ų | 184 | 117.3 Ų | 117.3 | 86% | 0.86 | 69% | 0.687 | S | S | * | * | trans | -65.3 | 99.5 | 172.2 | -81.6 | -175.1 | 153.2 | 0 | 0 | 108.1 | L8 | L8-E10 VanDerWaalsContact C-N 3.26Å; L8-E10 PolarHBondContact O-N 2.77Å | ||
| 11 | L | 67.6 | Low | 62.2 | Low | 71 Ų | 71 | 120 Ų | 120 | 37% | 0.372 | 69% | 0.691 | S | S | . | * | trans | -61.4 | 133.5 | 170.5 | -87.4 | 148.1 | 0 | 0 | 0 | 109.8 | E9 E15 M16 | E9-L11 PolarHBondContact O-N 2.94Å; L11-E15 HydrophobicContact CD2-CB 3.58Å; L11-E15 HydrophobicContact CD2-CG 4.43Å; L11-M16 HydrophobicContact CB-CG 4.27Å | ||
| 12 | T | 76.8 | Confident | 65 | Low | 75 Ų | 75 | 115.3 Ų | 115.3 | 46% | 0.46 | 67% | 0.666 | S | S | . | * | trans | -75.7 | 155.5 | 174.8 | 60.5 | 0 | 0 | 0 | 0 | 110.9 | E14 E15 M16 | T12-E14 PolarHBondContact O-N 3.35Å; T12-E14 VanDerWaalsContact O-N 3.17Å; T12-E15 PolarHBondContact N-OE2 3.06Å; T12-E15 PolarHBondContact O-N 3.11Å; T12-E15 VanDerWaalsContact OG1-CD 3.23Å; T12-E15 WeakPolarHBondContact OG1-CG 3.29Å; T12-E15 PolarHBondContact OG1-OE2 2.98Å; T12-M16 PolarHBondContact O-N 3.16Å; T12-M16 VanDerWaalsContact O-N 3.12Å | ||
| 13 | D | 73.8 | Confident | 67.6 | Low | 130 Ų | 130 | 108.5 Ų | 108.5 | 70% | 0.695 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -58 | -31 | -178.3 | -78.1 | -23.3 | 0 | 0 | 0 | 113.1 | M16 A17 | D13-M16 PolarHBondContact O-N 3.12Å; D13-M16 VanDerWaalsContact OD1-CE 3.29Å; D13-M16 WeakPolarHBondContact OD1-CE 3.33Å; D13-A17 PolarHBondContact O-N 3.47Å; D13-A17 VanDerWaalsContact O-N 3.11Å |
| 14 | E | 73.4 | Confident | 70 | Confident | 167 Ų | 167 | 106.8 Ų | 106.8 | 78% | 0.78 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -67.9 | -39.1 | 176.7 | -66.2 | -176.8 | 170.2 | 0 | 0 | 112.2 | T12 A17 A18 | T12-E14 PolarHBondContact O-N 3.35Å; T12-E14 VanDerWaalsContact O-N 3.17Å; E14-A17 PolarHBondContact O-N 3.07Å; E14-A18 PolarHBondContact O-N 2.92Å |
| 15 | E | 76.2 | Confident | 72.5 | Confident | 97 Ų | 97 | 100.6 Ų | 100.6 | 45% | 0.453 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -73.3 | -31.3 | 177.8 | -66.2 | 167.8 | 135.5 | 0 | 0 | 111.8 | L11 T12 L19 | L11-E15 HydrophobicContact CD2-CB 3.58Å; L11-E15 HydrophobicContact CD2-CG 4.43Å; T12-E15 PolarHBondContact N-OE2 3.06Å; T12-E15 PolarHBondContact O-N 3.11Å; T12-E15 VanDerWaalsContact OG1-CD 3.23Å; T12-E15 WeakPolarHBondContact OG1-CG 3.29Å; T12-E15 PolarHBondContact OG1-OE2 2.98Å; E15-L19 WeakPolarHBondContact O-CG 3.41Å |
| 16 | M | 73.6 | Confident | 74.9 | Confident | 77 Ų | 77 | 100.6 Ų | 100.6 | 38% | 0.379 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -68.5 | -37.4 | 171.8 | -75 | -156.1 | -67.2 | 0 | 0 | 112.5 | L11 T12 D13 A18 L19 L24 | L11-M16 HydrophobicContact CB-CG 4.27Å; T12-M16 PolarHBondContact O-N 3.16Å; T12-M16 VanDerWaalsContact O-N 3.12Å; D13-M16 PolarHBondContact O-N 3.12Å; D13-M16 VanDerWaalsContact OD1-CE 3.29Å; D13-M16 WeakPolarHBondContact OD1-CE 3.33Å; M16-A18 VanDerWaalsContact C-N 3.29Å; M16-A18 PolarHBondContact O-N 2.86Å; M16-L19 PolarHBondContact O-N 3.23Å; M16-L24 HydrophobicContact CB-CD2 4.4Å; M16-L24 HydrophobicContact CG-CD2 4.32Å |
| 17 | A | 76.5 | Confident | 77.2 | Confident | 86 Ų | 86 | 102 Ų | 102 | 71% | 0.711 | 55% | 0.55 | S | S | * | * | H | α-helix | trans | -68.4 | -27.3 | 178 | 0 | 0 | 0 | 0 | 0 | 113.2 | D13 E14 L19 | D13-A17 PolarHBondContact O-N 3.47Å; D13-A17 VanDerWaalsContact O-N 3.11Å; E14-A17 PolarHBondContact O-N 3.07Å; A17-L19 VanDerWaalsContact C-N 3.3Å; A17-L19 PolarHBondContact O-N 3.5Å |
| 18 | A | 82.4 | Confident | 79.5 | Confident | 88 Ų | 88 | 103.2 Ų | 103.2 | 73% | 0.727 | 54% | 0.54 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -76.1 | -13.4 | 177.5 | 0 | 0 | 0 | 0 | 0 | 114 | E14 M16 | E14-A18 PolarHBondContact O-N 2.92Å; M16-A18 VanDerWaalsContact C-N 3.29Å; M16-A18 PolarHBondContact O-N 2.86Å |
| 19 | L | 83.2 | Confident | 81.6 | Confident | 47 Ų | 47 | 105.4 Ų | 105.4 | 25% | 0.246 | 54% | 0.539 | C | S | . | . | S | Bend | trans | -94.9 | 144.2 | -176.6 | -66.9 | 173.1 | 0 | 0 | 0 | 112.7 | E15 M16 A17 E23 L24 | E15-L19 WeakPolarHBondContact O-CG 3.41Å; M16-L19 PolarHBondContact O-N 3.23Å; A17-L19 VanDerWaalsContact C-N 3.3Å; A17-L19 PolarHBondContact O-N 3.5Å; L19-E23 HydrophobicContact CD2-CG 4Å; L19-L24 HydrophobicContact CB-CD2 4.06Å; L19-L24 HydrophobicContact CB-CG 4.02Å; L19-L24 HydrophobicContact CD1-CD2 3.89Å |
| 20 | G | 88.3 | Confident | 83.1 | Confident | 50 Ų | 50 | 103.2 Ų | 103.2 | 52% | 0.515 | 52% | 0.523 | S | S | . | . | trans | -70.7 | 150.6 | 171.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | E22 E23 L24 | G20-E22 PolarHBondContact O-N 2.65Å; G20-E22 VanDerWaalsContact O-N 3.11Å; G20-E23 WeakPolarHBondContact O-CB 3.41Å; G20-E23 PolarHBondContact O-N 2.74Å; G20-L24 PolarHBondContact O-N 2.97Å; G20-L24 VanDerWaalsContact O-N 3.16Å | ||
| 21 | K | 89.1 | Confident | 84.4 | Confident | 175 Ų | 175 | 99.5 Ų | 99.5 | 76% | 0.761 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -48.1 | -41.9 | 180 | -178.5 | -178.1 | 175.1 | -177.1 | 0 | 113.6 | E23 L24 V25 | K21-E23 VanDerWaalsContact C-N 3.35Å; K21-L24 PolarHBondContact O-N 3.29Å; K21-V25 WeakPolarHBondContact O-CG2 3.32Å; K21-V25 PolarHBondContact O-N 3.38Å; K21-V25 VanDerWaalsContact O-N 3.07Å |
| 22 | E | 91.3 | Very high | 85.7 | Confident | 151 Ų | 151 | 100.9 Ų | 100.9 | 71% | 0.706 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -68.1 | -33.2 | -179.9 | -63.9 | -172.6 | 172.6 | 0 | 0 | 113.2 | G20 R26 | G20-E22 PolarHBondContact O-N 2.65Å; G20-E22 VanDerWaalsContact O-N 3.11Å; E22-R26 WeakPolarHBondContact O-CB 3.48Å; E22-R26 PolarHBondContact O-N 2.96Å |
| 23 | E | 88 | Confident | 86.6 | Confident | 51 Ų | 51 | 100.1 Ų | 100.1 | 24% | 0.238 | 51% | 0.511 | C | S | . | . | H | α-helix | trans | -71.1 | -42.9 | 177.7 | -165.3 | 62 | -131.7 | 0 | 0 | 110.6 | L19 G20 K21 V25 R26 R27 R30 | L19-E23 HydrophobicContact CD2-CG 4Å; G20-E23 WeakPolarHBondContact O-CB 3.41Å; G20-E23 PolarHBondContact O-N 2.74Å; K21-E23 VanDerWaalsContact C-N 3.35Å; E23-V25 PolarHBondContact O-N 2.86Å; E23-R26 PolarHBondContact O-N 3Å; E23-R26 IonicContact OE1-CZ 2.74Å; E23-R26 IonicContact OE1-NH1 3.01Å; E23-R26 PolarHBondContact OE1-NH1 2.83Å; E23-R26 IonicContact OE2-CZ 3.44Å; E23-R26 IonicContact OE2-NH1 2.76Å; E23-R26 PolarHBondContact OE2-NH1 3.3Å; E23-R26 IonicContact OE2-NH2 2.6Å; E23-R26 PolarHBondContact OE2-NH2 3.05Å; E23-R27 WeakPolarHBondContact O-CB 3.3Å; E23-R27 WeakPolarHBondContact O-CG 3.36Å; E23-R27 PolarHBondContact O-N 3.36Å; E23-R27 IonicContact OE1-NE 3.97Å; E23-R30 IonicContact OE1-NH1 3.55Å |
| 24 | L | 89.1 | Confident | 87.5 | Confident | 60 Ų | 60 | 96.6 Ų | 96.6 | 31% | 0.314 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -59.3 | -44.4 | 173.5 | -69.5 | 172.5 | 0 | 0 | 0 | 111.5 | M16 L19 G20 K21 R27 L28 | M16-L24 HydrophobicContact CB-CD2 4.4Å; M16-L24 HydrophobicContact CG-CD2 4.32Å; L19-L24 HydrophobicContact CB-CD2 4.06Å; L19-L24 HydrophobicContact CB-CG 4.02Å; L19-L24 HydrophobicContact CD1-CD2 3.89Å; G20-L24 PolarHBondContact O-N 2.97Å; G20-L24 VanDerWaalsContact O-N 3.16Å; K21-L24 PolarHBondContact O-N 3.29Å; L24-R27 PolarHBondContact O-N 2.89Å; L24-L28 WeakPolarHBondContact O-CB 3.42Å; L24-L28 PolarHBondContact O-N 3.07Å |
| 25 | V | 92.4 | Very high | 88.5 | Confident | 59 Ų | 59 | 97.4 Ų | 97.4 | 36% | 0.358 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -64.1 | -42.4 | 176.5 | 171.4 | 0 | 0 | 0 | 0 | 111.7 | K21 E23 R29 | K21-V25 WeakPolarHBondContact O-CG2 3.32Å; K21-V25 PolarHBondContact O-N 3.38Å; K21-V25 VanDerWaalsContact O-N 3.07Å; E23-V25 PolarHBondContact O-N 2.86Å; V25-R29 WeakPolarHBondContact O-CG 3.36Å; V25-R29 PolarHBondContact O-N 3.47Å |
| 26 | R | 92.7 | Very high | 89.5 | Confident | 99 Ų | 99 | 98.1 Ų | 98.1 | 37% | 0.374 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -64.5 | -39.9 | 176.9 | -85.3 | -174.1 | -78.8 | 100.7 | -1.9 | 111.9 | E22 E23 R30 | E22-R26 WeakPolarHBondContact O-CB 3.48Å; E22-R26 PolarHBondContact O-N 2.96Å; E23-R26 PolarHBondContact O-N 3Å; E23-R26 IonicContact OE1-CZ 2.74Å; E23-R26 IonicContact OE1-NH1 3.01Å; E23-R26 PolarHBondContact OE1-NH1 2.83Å; E23-R26 IonicContact OE2-CZ 3.44Å; E23-R26 IonicContact OE2-NH1 2.76Å; E23-R26 PolarHBondContact OE2-NH1 3.3Å; E23-R26 IonicContact OE2-NH2 2.6Å; E23-R26 PolarHBondContact OE2-NH2 3.05Å; R26-R30 WeakPolarHBondContact O-CG 3.49Å; R26-R30 PolarHBondContact O-N 3.4Å |
| 27 | R | 88.4 | Confident | 90.6 | Very high | 93 Ų | 93 | 97 Ų | 97 | 35% | 0.351 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -66.4 | -48.3 | 175.6 | -72.9 | -179.3 | -177.7 | -143.4 | 1.9 | 111.9 | E23 L24 R29 R30 E31 | E23-R27 WeakPolarHBondContact O-CB 3.3Å; E23-R27 WeakPolarHBondContact O-CG 3.36Å; E23-R27 PolarHBondContact O-N 3.36Å; E23-R27 IonicContact OE1-NE 3.97Å; L24-R27 PolarHBondContact O-N 2.89Å; R27-R29 VanDerWaalsContact C-N 3.29Å; R27-R29 PolarHBondContact O-N 3.31Å; R27-R30 WeakPolarHBondContact O-CB 3.4Å; R27-R30 PolarHBondContact O-N 3.27Å; R27-E31 PolarHBondContact O-N 2.99Å |
| 28 | L | 90.9 | Very high | 91.5 | Very high | 99 Ų | 99 | 95.8 Ų | 95.8 | 52% | 0.518 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -54.4 | -45.8 | 176.3 | -179.8 | 64.8 | 0 | 0 | 0 | 111.5 | L24 R30 E31 E32 | L24-L28 WeakPolarHBondContact O-CB 3.42Å; L24-L28 PolarHBondContact O-N 3.07Å; L28-R30 VanDerWaalsContact C-N 3.32Å; L28-R30 PolarHBondContact O-N 3.15Å; L28-E31 PolarHBondContact O-N 3Å; L28-E32 HydrophobicContact CD1-CG 4.29Å; L28-E32 HydrophobicContact CG-CG 4.38Å; L28-E32 WeakPolarHBondContact O-CB 3.5Å; L28-E32 VanDerWaalsContact O-CG 3.3Å; L28-E32 WeakPolarHBondContact O-CG 3.34Å; L28-E32 PolarHBondContact O-N 2.89Å |
| 29 | R | 94.8 | Very high | 92.2 | Very high | 169 Ų | 169 | 96.4 Ų | 96.4 | 64% | 0.638 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -62.8 | -35.2 | 176.8 | -73.9 | 178.6 | -179.7 | -178.5 | 1.4 | 113.5 | V25 R27 A33 | V25-R29 WeakPolarHBondContact O-CG 3.36Å; V25-R29 PolarHBondContact O-N 3.47Å; R27-R29 VanDerWaalsContact C-N 3.29Å; R27-R29 PolarHBondContact O-N 3.31Å; R29-A33 VanDerWaalsContact O-CB 3.28Å; R29-A33 WeakPolarHBondContact O-CB 3.32Å; R29-A33 PolarHBondContact O-N 3.27Å |
| 30 | R | 93.5 | Very high | 92.8 | Very high | 140 Ų | 140 | 97.9 Ų | 97.9 | 53% | 0.528 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -67.9 | -45.5 | 176 | -72 | 171.7 | -171 | 141.7 | -2 | 110.7 | E23 R26 R27 L28 A33 A34 | E23-R30 IonicContact OE1-NH1 3.55Å; R26-R30 WeakPolarHBondContact O-CG 3.49Å; R26-R30 PolarHBondContact O-N 3.4Å; R27-R30 WeakPolarHBondContact O-CB 3.4Å; R27-R30 PolarHBondContact O-N 3.27Å; L28-R30 VanDerWaalsContact C-N 3.32Å; L28-R30 PolarHBondContact O-N 3.15Å; R30-A33 PolarHBondContact O-N 2.85Å; R30-A34 WeakPolarHBondContact O-CB 3.43Å; R30-A34 PolarHBondContact O-N 2.91Å |
| 31 | E | 91 | Very high | 93.3 | Very high | 105 Ų | 105 | 100.3 Ų | 100.3 | 49% | 0.491 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -63.2 | -44.5 | 176.3 | -75.3 | -57.2 | 137.7 | 0 | 0 | 112.1 | L8 R27 L28 A33 A34 R35 | L8-E31 WeakPolarHBondContact CD2-OE2 3.35Å; R27-E31 PolarHBondContact O-N 2.99Å; L28-E31 PolarHBondContact O-N 3Å; E31-A33 VanDerWaalsContact C-N 3.34Å; E31-A33 PolarHBondContact O-N 3.43Å; E31-A34 PolarHBondContact O-N 3.47Å; E31-R35 WeakPolarHBondContact O-CB 3.33Å; E31-R35 PolarHBondContact O-N 3.19Å |
| 32 | E | 94.1 | Very high | 93.6 | Very high | 100 Ų | 100 | 99.6 Ų | 99.6 | 47% | 0.467 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -59.6 | -43.8 | 174.1 | -75 | 174.9 | 168.6 | 0 | 0 | 111.6 | L28 R35 L36 | L28-E32 HydrophobicContact CD1-CG 4.29Å; L28-E32 HydrophobicContact CG-CG 4.38Å; L28-E32 WeakPolarHBondContact O-CB 3.5Å; L28-E32 VanDerWaalsContact O-CG 3.3Å; L28-E32 WeakPolarHBondContact O-CG 3.34Å; L28-E32 PolarHBondContact O-N 2.89Å; E32-R35 PolarHBondContact O-N 2.91Å; E32-L36 WeakPolarHBondContact O-CB 3.39Å; E32-L36 VanDerWaalsContact O-CG 3.27Å; E32-L36 WeakPolarHBondContact O-CG 3.28Å; E32-L36 PolarHBondContact O-N 2.97Å |
| 33 | A | 94.9 | Very high | 93.9 | Very high | 59 Ų | 59 | 93.7 Ų | 93.7 | 49% | 0.488 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -64.8 | -41.7 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | R29 R30 E31 L36 A37 | R29-A33 VanDerWaalsContact O-CB 3.28Å; R29-A33 WeakPolarHBondContact O-CB 3.32Å; R29-A33 PolarHBondContact O-N 3.27Å; R30-A33 PolarHBondContact O-N 2.85Å; E31-A33 VanDerWaalsContact C-N 3.34Å; E31-A33 PolarHBondContact O-N 3.43Å; A33-L36 PolarHBondContact O-N 3.28Å; A33-A37 WeakPolarHBondContact O-CB 3.49Å; A33-A37 PolarHBondContact O-N 2.88Å |
| 34 | A | 93.8 | Very high | 94.4 | Very high | 56 Ų | 56 | 98.4 Ų | 98.4 | 46% | 0.463 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -64 | -43.5 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.5 | R30 E31 A37 A38 | R30-A34 WeakPolarHBondContact O-CB 3.43Å; R30-A34 PolarHBondContact O-N 2.91Å; E31-A34 PolarHBondContact O-N 3.47Å; A34-A37 PolarHBondContact O-N 3.44Å; A34-A38 WeakPolarHBondContact O-CB 3.37Å; A34-A38 PolarHBondContact O-N 3.31Å |
| 35 | R | 95.1 | Very high | 94.8 | Very high | 185 Ų | 185 | 101.2 Ų | 101.2 | 70% | 0.698 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -64.7 | -42.1 | 177.1 | -162.5 | 174.3 | -173.1 | 145.5 | 1.6 | 111.9 | E31 E32 A38 L39 | E31-R35 WeakPolarHBondContact O-CB 3.33Å; E31-R35 PolarHBondContact O-N 3.19Å; E32-R35 PolarHBondContact O-N 2.91Å; R35-A38 PolarHBondContact O-N 3Å; R35-L39 WeakPolarHBondContact O-CG 3.27Å; R35-L39 PolarHBondContact O-N 2.9Å |
| 36 | L | 96.4 | Very high | 95.1 | Very high | 111 Ų | 111 | 103 Ų | 103 | 58% | 0.581 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -62.8 | -43.1 | 173.1 | -74.7 | 171 | 0 | 0 | 0 | 111.7 | E32 A33 A38 L39 V40 | E32-L36 WeakPolarHBondContact O-CB 3.39Å; E32-L36 VanDerWaalsContact O-CG 3.27Å; E32-L36 WeakPolarHBondContact O-CG 3.28Å; E32-L36 PolarHBondContact O-N 2.97Å; A33-L36 PolarHBondContact O-N 3.28Å; L36-A38 PolarHBondContact O-N 2.95Å; L36-L39 PolarHBondContact O-N 3.45Å; L36-V40 WeakPolarHBondContact O-CG2 3.35Å; L36-V40 PolarHBondContact O-N 3.49Å |
| 37 | A | 95.7 | Very high | 95.4 | Very high | 54 Ų | 54 | 105.1 Ų | 105.1 | 45% | 0.446 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -61.4 | -44.2 | 176 | 0 | 0 | 0 | 0 | 0 | 111.7 | A33 A34 L39 V40 Q41 | A33-A37 WeakPolarHBondContact O-CB 3.49Å; A33-A37 PolarHBondContact O-N 2.88Å; A34-A37 PolarHBondContact O-N 3.44Å; A37-L39 PolarHBondContact O-N 3.32Å; A37-V40 PolarHBondContact O-N 3.25Å; A37-Q41 WeakPolarHBondContact O-CG 3.4Å; A37-Q41 PolarHBondContact O-N 3.43Å |
| 38 | A | 96.1 | Very high | 95.8 | Very high | 60 Ų | 60 | 104 Ų | 104 | 50% | 0.496 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -61.6 | -41.5 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | A34 R35 L36 V40 Q41 R42 | A34-A38 WeakPolarHBondContact O-CB 3.37Å; A34-A38 PolarHBondContact O-N 3.31Å; R35-A38 PolarHBondContact O-N 3Å; L36-A38 PolarHBondContact O-N 2.95Å; A38-V40 PolarHBondContact O-N 2.99Å; A38-Q41 PolarHBondContact O-N 3.42Å; A38-R42 WeakPolarHBondContact O-CB 3.45Å; A38-R42 PolarHBondContact O-N 3.31Å |
| 39 | L | 96.7 | Very high | 96.2 | Very high | 102 Ų | 102 | 103.6 Ų | 103.6 | 53% | 0.534 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -62.2 | -41.7 | 174.8 | -73.5 | 172 | 0 | 0 | 0 | 112.1 | R35 L36 A37 R42 G43 | R35-L39 WeakPolarHBondContact O-CG 3.27Å; R35-L39 PolarHBondContact O-N 2.9Å; L36-L39 PolarHBondContact O-N 3.45Å; A37-L39 PolarHBondContact O-N 3.32Å; L39-R42 PolarHBondContact O-N 3Å; L39-G43 PolarHBondContact O-N 3.01Å |
| 40 | V | 97.3 | Very high | 96.4 | Very high | 77 Ų | 77 | 99.9 Ų | 99.9 | 47% | 0.467 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -63.5 | -44.5 | 175.3 | 171.5 | 0 | 0 | 0 | 0 | 111.2 | L36 A37 A38 G43 R44 | L36-V40 WeakPolarHBondContact O-CG2 3.35Å; L36-V40 PolarHBondContact O-N 3.49Å; A37-V40 PolarHBondContact O-N 3.25Å; A38-V40 PolarHBondContact O-N 2.99Å; V40-G43 PolarHBondContact O-N 3Å; V40-R44 WeakPolarHBondContact O-CG 3.37Å; V40-R44 PolarHBondContact O-N 3.49Å |
| 41 | Q | 97 | Very high | 96.6 | Very high | 101 Ų | 101 | 100.6 Ų | 100.6 | 47% | 0.472 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -62.6 | -44.1 | 177.3 | -67.8 | -58.3 | -23.7 | 0 | 0 | 111.9 | A37 A38 G43 R44 L45 | A37-Q41 WeakPolarHBondContact O-CG 3.4Å; A37-Q41 PolarHBondContact O-N 3.43Å; A38-Q41 PolarHBondContact O-N 3.42Å; Q41-G43 VanDerWaalsContact C-N 3.28Å; Q41-G43 PolarHBondContact O-N 3.23Å; Q41-R44 PolarHBondContact O-N 2.93Å; Q41-R44 VanDerWaalsContact O-N 3.16Å; Q41-L45 WeakPolarHBondContact O-CG 3.34Å; Q41-L45 PolarHBondContact O-N 3.37Å |
| 42 | R | 97.1 | Very high | 96.9 | Very high | 161 Ų | 161 | 100.1 Ų | 100.1 | 61% | 0.608 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -59.4 | -40.3 | 174.3 | -174.7 | -175.9 | 167.2 | -177.3 | -4.8 | 111.7 | A38 L39 L45 M46 | A38-R42 WeakPolarHBondContact O-CB 3.45Å; A38-R42 PolarHBondContact O-N 3.31Å; L39-R42 PolarHBondContact O-N 3Å; R42-L45 PolarHBondContact O-N 3.21Å; R42-M46 HydrophobicContact CG-CE 3.84Å; R42-M46 PolarHBondContact O-N 2.95Å |
| 43 | G | 97.8 | Very high | 97.2 | Very high | 27 Ų | 27 | 99.8 Ų | 99.8 | 28% | 0.278 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -60.1 | -44.5 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | L39 V40 Q41 M46 Q47 | L39-G43 PolarHBondContact O-N 3.01Å; V40-G43 PolarHBondContact O-N 3Å; Q41-G43 VanDerWaalsContact C-N 3.28Å; Q41-G43 PolarHBondContact O-N 3.23Å; G43-M46 PolarHBondContact O-N 3.47Å; G43-Q47 WeakPolarHBondContact O-CG 3.38Å; G43-Q47 PolarHBondContact O-N 2.91Å |
| 44 | R | 97.7 | Very high | 97.3 | Very high | 149 Ų | 149 | 103.6 Ų | 103.6 | 56% | 0.562 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -63.2 | -44.7 | 176.1 | -67.6 | 176.5 | -173.4 | -167.6 | 1.6 | 112.3 | V40 Q41 M46 Q47 E48 | V40-R44 WeakPolarHBondContact O-CG 3.37Å; V40-R44 PolarHBondContact O-N 3.49Å; Q41-R44 PolarHBondContact O-N 2.93Å; Q41-R44 VanDerWaalsContact O-N 3.16Å; R44-M46 VanDerWaalsContact C-N 3.35Å; R44-M46 PolarHBondContact O-N 3.38Å; R44-Q47 WeakPolarHBondContact O-CB 3.37Å; R44-Q47 PolarHBondContact O-N 3.47Å; R44-E48 PolarHBondContact O-N 2.96Å |
| 45 | L | 98.1 | Very high | 97.6 | Very high | 120 Ų | 120 | 102.8 Ų | 102.8 | 63% | 0.628 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -61.3 | -43.1 | 176.7 | -70.5 | 172.5 | 0 | 0 | 0 | 111.6 | Q41 R42 Q47 E48 V49 | Q41-L45 WeakPolarHBondContact O-CG 3.34Å; Q41-L45 PolarHBondContact O-N 3.37Å; R42-L45 PolarHBondContact O-N 3.21Å; L45-Q47 VanDerWaalsContact C-N 3.35Å; L45-Q47 PolarHBondContact O-N 3.48Å; L45-E48 PolarHBondContact O-N 2.96Å; L45-V49 WeakPolarHBondContact O-CG2 3.47Å; L45-V49 PolarHBondContact O-N 2.95Å |
| 46 | M | 98.1 | Very high | 97.7 | Very high | 97 Ų | 97 | 98.7 Ų | 98.7 | 48% | 0.478 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -62.2 | -40.9 | 175.1 | -83.9 | -168 | -87.8 | 0 | 0 | 112.5 | R42 G43 R44 E48 N50 | R42-M46 HydrophobicContact CG-CE 3.84Å; R42-M46 PolarHBondContact O-N 2.95Å; G43-M46 PolarHBondContact O-N 3.47Å; R44-M46 VanDerWaalsContact C-N 3.35Å; R44-M46 PolarHBondContact O-N 3.38Å; M46-E48 VanDerWaalsContact C-N 3.33Å; M46-E48 PolarHBondContact O-N 3.28Å; M46-N50 WeakPolarHBondContact O-CB 3.32Å; M46-N50 PolarHBondContact O-N 3.39Å; M46-N50 PolarHBondContact O-ND2 3.23Å |
| 47 | Q | 98.4 | Very high | 97.8 | Very high | 142 Ų | 142 | 96.7 Ų | 96.7 | 66% | 0.664 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -61.5 | -42.5 | 175.5 | -73.8 | 172.4 | -11.6 | 0 | 0 | 111.7 | G43 R44 L45 N50 R51 | G43-Q47 WeakPolarHBondContact O-CG 3.38Å; G43-Q47 PolarHBondContact O-N 2.91Å; R44-Q47 WeakPolarHBondContact O-CB 3.37Å; R44-Q47 PolarHBondContact O-N 3.47Å; L45-Q47 VanDerWaalsContact C-N 3.35Å; L45-Q47 PolarHBondContact O-N 3.48Å; Q47-N50 PolarHBondContact O-N 2.99Å; Q47-R51 WeakPolarHBondContact O-CB 3.48Å; Q47-R51 PolarHBondContact O-N 3.4Å |
| 48 | E | 98.1 | Very high | 98 | Very high | 71 Ų | 71 | 95.1 Ų | 95.1 | 33% | 0.332 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -67.2 | -44.3 | 179.3 | -178.2 | 54.5 | -155.1 | 0 | 0 | 112.3 | R44 L45 M46 N50 R51 Q52 | R44-E48 PolarHBondContact O-N 2.96Å; L45-E48 PolarHBondContact O-N 2.96Å; M46-E48 VanDerWaalsContact C-N 3.33Å; M46-E48 PolarHBondContact O-N 3.28Å; E48-N50 VanDerWaalsContact C-N 3.31Å; E48-N50 PolarHBondContact O-N 3.41Å; E48-R51 WeakPolarHBondContact O-CB 3.49Å; E48-R51 PolarHBondContact O-N 2.87Å; E48-R51 IonicContact OE1-CZ 3.75Å; E48-R51 IonicContact OE1-NE 2.65Å; E48-R51 PolarHBondContact OE1-NE 3.05Å; E48-R51 IonicContact OE1-NH2 2.74Å; E48-R51 PolarHBondContact OE1-NH2 3.16Å; E48-R51 IonicContact OE2-CZ 3.35Å; E48-R51 IonicContact OE2-NE 3.11Å; E48-R51 PolarHBondContact OE2-NE 3.23Å; E48-R51 IonicContact OE2-NH2 3.46Å; E48-R51 PolarHBondContact OE2-NH2 3.37Å; E48-Q52 WeakPolarHBondContact O-CG 3.44Å; E48-Q52 PolarHBondContact O-N 3.34Å; E48-Q52 PolarHBondContact OE1-NE2 2.97Å |
| 49 | V | 98.3 | Very high | 98.1 | Very high | 90 Ų | 90 | 97.4 Ų | 97.4 | 55% | 0.545 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -59.2 | -43.9 | 174.3 | 170.8 | 0 | 0 | 0 | 0 | 110.8 | L45 R51 Q52 L53 | L45-V49 WeakPolarHBondContact O-CG2 3.47Å; L45-V49 PolarHBondContact O-N 2.95Å; V49-R51 VanDerWaalsContact C-N 3.35Å; V49-R51 PolarHBondContact O-N 3.44Å; V49-Q52 PolarHBondContact O-N 2.91Å; V49-L53 WeakPolarHBondContact O-CB 3.28Å; V49-L53 PolarHBondContact O-N 3.18Å |
| 50 | N | 98.4 | Very high | 98.2 | Very high | 91 Ų | 91 | 96.4 Ų | 96.4 | 49% | 0.487 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -63.8 | -39.9 | 176.9 | -79.4 | -28.1 | 0 | 0 | 0 | 112.3 | M46 Q47 E48 L53 Q54 | M46-N50 WeakPolarHBondContact O-CB 3.32Å; M46-N50 PolarHBondContact O-N 3.39Å; M46-N50 PolarHBondContact O-ND2 3.23Å; Q47-N50 PolarHBondContact O-N 2.99Å; E48-N50 VanDerWaalsContact C-N 3.31Å; E48-N50 PolarHBondContact O-N 3.41Å; N50-L53 PolarHBondContact O-N 3.5Å; N50-Q54 WeakPolarHBondContact O-CB 3.39Å; N50-Q54 VanDerWaalsContact O-CG 3.32Å; N50-Q54 WeakPolarHBondContact O-CG 3.44Å; N50-Q54 PolarHBondContact O-N 2.98Å |
| 51 | R | 98.5 | Very high | 98.3 | Very high | 154 Ų | 154 | 100.7 Ų | 100.7 | 58% | 0.581 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -61.3 | -46.5 | 176.2 | -171.3 | -172.8 | 73 | 82.8 | 0.6 | 111.2 | Q47 E48 V49 Q54 G55 | Q47-R51 WeakPolarHBondContact O-CB 3.48Å; Q47-R51 PolarHBondContact O-N 3.4Å; E48-R51 WeakPolarHBondContact O-CB 3.49Å; E48-R51 PolarHBondContact O-N 2.87Å; E48-R51 IonicContact OE1-CZ 3.75Å; E48-R51 IonicContact OE1-NE 2.65Å; E48-R51 PolarHBondContact OE1-NE 3.05Å; E48-R51 IonicContact OE1-NH2 2.74Å; E48-R51 PolarHBondContact OE1-NH2 3.16Å; E48-R51 IonicContact OE2-CZ 3.35Å; E48-R51 IonicContact OE2-NE 3.11Å; E48-R51 PolarHBondContact OE2-NE 3.23Å; E48-R51 IonicContact OE2-NH2 3.46Å; E48-R51 PolarHBondContact OE2-NH2 3.37Å; V49-R51 VanDerWaalsContact C-N 3.35Å; V49-R51 PolarHBondContact O-N 3.44Å; R51-Q54 PolarHBondContact O-N 3.05Å; R51-G55 PolarHBondContact O-N 3.44Å; R51-G55 VanDerWaalsContact O-N 3.08Å |
| 52 | Q | 98.5 | Very high | 98.3 | Very high | 95 Ų | 95 | 102.3 Ų | 102.3 | 44% | 0.444 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -64.5 | -44.6 | 177.9 | -69.1 | 177.1 | 3.5 | 0 | 0 | 111.7 | E48 V49 Q54 G55 H56 | E48-Q52 WeakPolarHBondContact O-CG 3.44Å; E48-Q52 PolarHBondContact O-N 3.34Å; E48-Q52 PolarHBondContact OE1-NE2 2.97Å; V49-Q52 PolarHBondContact O-N 2.91Å; Q52-Q54 VanDerWaalsContact C-N 3.31Å; Q52-Q54 PolarHBondContact O-N 2.96Å; Q52-G55 WeakPolarHBondContact O-CA 3.19Å; Q52-G55 PolarHBondContact O-N 2.93Å; Q52-G55 VanDerWaalsContact O-N 3.1Å; Q52-H56 PolarHBondContact O-CD2 2.97Å; Q52-H56 PolarHBondContact O-N 3.31Å |
| 53 | L | 98.6 | Very high | 98.4 | Very high | 93 Ų | 93 | 100.1 Ų | 100.1 | 49% | 0.487 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -59.3 | -42.7 | 176.9 | -178.3 | 64 | 0 | 0 | 0 | 111.7 | V49 N50 G55 H56 L57 | V49-L53 WeakPolarHBondContact O-CB 3.28Å; V49-L53 PolarHBondContact O-N 3.18Å; N50-L53 PolarHBondContact O-N 3.5Å; L53-G55 VanDerWaalsContact C-N 3.32Å; L53-G55 PolarHBondContact O-N 3.43Å; L53-H56 PolarHBondContact O-N 3.37Å; L53-L57 HydrophobicContact CG-CD1 4.27Å; L53-L57 WeakPolarHBondContact O-CB 3.4Å; L53-L57 VanDerWaalsContact O-CG 3.28Å; L53-L57 WeakPolarHBondContact O-CG 3.49Å; L53-L57 PolarHBondContact O-N 3.48Å |
| 54 | Q | 98.5 | Very high | 98.5 | Very high | 140 Ų | 140 | 104.9 Ų | 104.9 | 65% | 0.654 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -63.2 | -38.4 | 175.6 | -75.3 | -179.2 | -4.2 | 0 | 0 | 112.3 | N50 R51 Q52 L57 G58 | N50-Q54 WeakPolarHBondContact O-CB 3.39Å; N50-Q54 VanDerWaalsContact O-CG 3.32Å; N50-Q54 WeakPolarHBondContact O-CG 3.44Å; N50-Q54 PolarHBondContact O-N 2.98Å; R51-Q54 PolarHBondContact O-N 3.05Å; Q52-Q54 VanDerWaalsContact C-N 3.31Å; Q52-Q54 PolarHBondContact O-N 2.96Å; Q54-L57 PolarHBondContact O-N 3.1Å; Q54-G58 PolarHBondContact O-N 3.39Å |
| 55 | G | 98.5 | Very high | 98.5 | Very high | 38 Ų | 38 | 102.7 Ų | 102.7 | 39% | 0.392 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -58.6 | -54.3 | 172.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | R51 Q52 L53 L57 G58 E59 | R51-G55 PolarHBondContact O-N 3.44Å; R51-G55 VanDerWaalsContact O-N 3.08Å; Q52-G55 WeakPolarHBondContact O-CA 3.19Å; Q52-G55 PolarHBondContact O-N 2.93Å; Q52-G55 VanDerWaalsContact O-N 3.1Å; L53-G55 VanDerWaalsContact C-N 3.32Å; L53-G55 PolarHBondContact O-N 3.43Å; G55-L57 VanDerWaalsContact C-N 3.3Å; G55-L57 PolarHBondContact O-N 3.08Å; G55-G58 WeakPolarHBondContact O-CA 3.44Å; G55-G58 PolarHBondContact O-N 3.4Å; G55-E59 PolarHBondContact O-N 3.42Å |
| 56 | H | 98.6 | Very high | 98.5 | Very high | 100 Ų | 100 | 101.3 Ų | 101.3 | 46% | 0.463 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -61.1 | -36.6 | 178.3 | -65.9 | -39.2 | 0 | 0 | 0 | 112.9 | Q52 L53 G58 E59 I60 | Q52-H56 PolarHBondContact O-CD2 2.97Å; Q52-H56 PolarHBondContact O-N 3.31Å; L53-H56 PolarHBondContact O-N 3.37Å; H56-G58 VanDerWaalsContact C-N 3.28Å; H56-G58 PolarHBondContact O-N 2.96Å; H56-E59 IonicContact ND1-OE2 3.25Å; H56-E59 PolarHBondContact ND1-OE2 2.85Å; H56-E59 PolarHBondContact O-N 2.92Å; H56-I60 WeakPolarHBondContact O-CB 3.24Å; H56-I60 WeakPolarHBondContact O-CD1 3.46Å; H56-I60 WeakPolarHBondContact O-CG1 3.37Å; H56-I60 PolarHBondContact O-N 3.4Å |
| 57 | L | 98.8 | Very high | 98.6 | Very high | 69 Ų | 69 | 100.8 Ų | 100.8 | 36% | 0.361 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -63.9 | -34.3 | 173.4 | -74 | 173 | 0 | 0 | 0 | 112.3 | L53 Q54 G55 R61 | L53-L57 HydrophobicContact CG-CD1 4.27Å; L53-L57 WeakPolarHBondContact O-CB 3.4Å; L53-L57 VanDerWaalsContact O-CG 3.28Å; L53-L57 WeakPolarHBondContact O-CG 3.49Å; L53-L57 PolarHBondContact O-N 3.48Å; Q54-L57 PolarHBondContact O-N 3.1Å; G55-L57 VanDerWaalsContact C-N 3.3Å; G55-L57 PolarHBondContact O-N 3.08Å; L57-R61 WeakPolarHBondContact O-CD 3.38Å; L57-R61 VanDerWaalsContact O-CG 3.24Å; L57-R61 WeakPolarHBondContact O-CG 3.22Å; L57-R61 PolarHBondContact O-N 2.88Å |
| 58 | G | 98.6 | Very high | 98.6 | Very high | 21 Ų | 21 | 102.6 Ų | 102.6 | 22% | 0.216 | 50% | 0.495 | C | S | . | . | H | α-helix | trans | -62.6 | -54.1 | 171.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | Q54 G55 H56 I60 R61 E62 | Q54-G58 PolarHBondContact O-N 3.39Å; G55-G58 WeakPolarHBondContact O-CA 3.44Å; G55-G58 PolarHBondContact O-N 3.4Å; H56-G58 VanDerWaalsContact C-N 3.28Å; H56-G58 PolarHBondContact O-N 2.96Å; G58-I60 VanDerWaalsContact C-N 3.3Å; G58-I60 PolarHBondContact O-N 2.67Å; G58-R61 WeakPolarHBondContact O-CB 3.48Å; G58-R61 PolarHBondContact O-N 3.21Å; G58-E62 PolarHBondContact O-N 3.09Å |
| 59 | E | 98.6 | Very high | 98.6 | Very high | 107 Ų | 107 | 106 Ų | 106 | 50% | 0.5 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -56.1 | -43.7 | 178.5 | -67.5 | 168.8 | -179.9 | 0 | 0 | 111.8 | G55 H56 R61 E62 L63 | G55-E59 PolarHBondContact O-N 3.42Å; H56-E59 IonicContact ND1-OE2 3.25Å; H56-E59 PolarHBondContact ND1-OE2 2.85Å; H56-E59 PolarHBondContact O-N 2.92Å; E59-R61 VanDerWaalsContact C-N 3.29Å; E59-R61 PolarHBondContact O-N 3.28Å; E59-E62 PolarHBondContact O-N 3.4Å; E59-L63 WeakPolarHBondContact O-CB 3.43Å; E59-L63 WeakPolarHBondContact O-CG 3.28Å; E59-L63 PolarHBondContact O-N 3.48Å |
| 60 | I | 98.6 | Very high | 98.7 | Very high | 81 Ų | 81 | 106.1 Ų | 106.1 | 42% | 0.415 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -60.7 | -38.3 | 176.8 | -70.9 | 164.8 | 0 | 0 | 0 | 111.4 | H56 G58 K64 | H56-I60 WeakPolarHBondContact O-CB 3.24Å; H56-I60 WeakPolarHBondContact O-CD1 3.46Å; H56-I60 WeakPolarHBondContact O-CG1 3.37Å; H56-I60 PolarHBondContact O-N 3.4Å; G58-I60 VanDerWaalsContact C-N 3.3Å; G58-I60 PolarHBondContact O-N 2.67Å; I60-K64 HydrophobicContact CG2-CD 4.15Å; I60-K64 WeakPolarHBondContact O-CB 3.3Å; I60-K64 WeakPolarHBondContact O-CG 3.36Å; I60-K64 PolarHBondContact O-N 3.48Å |
| 61 | R | 98.8 | Very high | 98.7 | Very high | 167 Ų | 167 | 106.3 Ų | 106.3 | 63% | 0.63 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -68.8 | -43 | 177.9 | -70.1 | 166.2 | -168.6 | 152.7 | 2.9 | 111.2 | L57 G58 E59 K64 Q65 | L57-R61 WeakPolarHBondContact O-CD 3.38Å; L57-R61 VanDerWaalsContact O-CG 3.24Å; L57-R61 WeakPolarHBondContact O-CG 3.22Å; L57-R61 PolarHBondContact O-N 2.88Å; G58-R61 WeakPolarHBondContact O-CB 3.48Å; G58-R61 PolarHBondContact O-N 3.21Å; E59-R61 VanDerWaalsContact C-N 3.29Å; E59-R61 PolarHBondContact O-N 3.28Å; R61-K64 WeakPolarHBondContact O-CB 3.4Å; R61-K64 PolarHBondContact O-N 3.01Å; R61-Q65 PolarHBondContact O-N 3.34Å |
| 62 | E | 98.6 | Very high | 98.7 | Very high | 136 Ų | 136 | 100.9 Ų | 100.9 | 64% | 0.636 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -63.7 | -47.1 | 177.9 | -69.5 | 177.9 | -174.3 | 0 | 0 | 111.5 | G58 E59 K64 Q65 L66 | G58-E62 PolarHBondContact O-N 3.09Å; E59-E62 PolarHBondContact O-N 3.4Å; E62-K64 VanDerWaalsContact C-N 3.3Å; E62-K64 PolarHBondContact O-N 3.36Å; E62-Q65 WeakPolarHBondContact O-CB 3.49Å; E62-Q65 PolarHBondContact O-N 3.41Å; E62-L66 PolarHBondContact O-N 3.07Å |
| 63 | L | 98.8 | Very high | 98.7 | Very high | 114 Ų | 114 | 101.3 Ų | 101.3 | 60% | 0.597 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -59.5 | -40.6 | 175.4 | -74.1 | 172.8 | 0 | 0 | 0 | 111.9 | E59 Q65 L66 N67 | E59-L63 WeakPolarHBondContact O-CB 3.43Å; E59-L63 WeakPolarHBondContact O-CG 3.28Å; E59-L63 PolarHBondContact O-N 3.48Å; L63-Q65 VanDerWaalsContact C-N 3.33Å; L63-Q65 PolarHBondContact O-N 2.89Å; L63-L66 PolarHBondContact O-N 3.47Å; L63-N67 VanDerWaalsContact O-CB 3.3Å; L63-N67 WeakPolarHBondContact O-CB 3.45Å; L63-N67 PolarHBondContact O-N 3.05Å |
| 64 | K | 98.8 | Very high | 98.7 | Very high | 127 Ų | 127 | 100.4 Ų | 100.4 | 55% | 0.552 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -61.8 | -40.1 | 173.8 | -79.5 | 173.7 | 179.2 | 178.9 | 0 | 112.1 | I60 R61 E62 R68 | I60-K64 HydrophobicContact CG2-CD 4.15Å; I60-K64 WeakPolarHBondContact O-CB 3.3Å; I60-K64 WeakPolarHBondContact O-CG 3.36Å; I60-K64 PolarHBondContact O-N 3.48Å; R61-K64 WeakPolarHBondContact O-CB 3.4Å; R61-K64 PolarHBondContact O-N 3.01Å; E62-K64 VanDerWaalsContact C-N 3.3Å; E62-K64 PolarHBondContact O-N 3.36Å; K64-R68 WeakPolarHBondContact O-CG 3.33Å; K64-R68 PolarHBondContact O-N 3.26Å; K64-R68 VanDerWaalsContact O-N 3.09Å |
| 65 | Q | 98.7 | Very high | 98.7 | Very high | 103 Ų | 103 | 101.3 Ų | 101.3 | 48% | 0.481 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -67.6 | -44.8 | 177.6 | -171.6 | 177.9 | 17.2 | 0 | 0 | 111.6 | R61 E62 L63 N67 R68 R69 | R61-Q65 PolarHBondContact O-N 3.34Å; E62-Q65 WeakPolarHBondContact O-CB 3.49Å; E62-Q65 PolarHBondContact O-N 3.41Å; L63-Q65 VanDerWaalsContact C-N 3.33Å; L63-Q65 PolarHBondContact O-N 2.89Å; Q65-N67 VanDerWaalsContact C-N 3.34Å; Q65-N67 PolarHBondContact O-N 2.87Å; Q65-R68 PolarHBondContact O-N 3.02Å; Q65-R69 PolarHBondContact O-N 2.89Å; Q65-R69 VanDerWaalsContact O-N 3.07Å |
| 66 | L | 98.8 | Very high | 98.7 | Very high | 92 Ų | 92 | 105.7 Ų | 105.7 | 48% | 0.482 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -61 | -44.4 | 176.5 | -176.4 | 63.5 | 0 | 0 | 0 | 111.1 | E62 L63 R68 R69 L70 | E62-L66 PolarHBondContact O-N 3.07Å; L63-L66 PolarHBondContact O-N 3.47Å; L66-R68 VanDerWaalsContact C-N 3.33Å; L66-R68 PolarHBondContact O-N 3.3Å; L66-R69 PolarHBondContact O-N 3.01Å; L66-R69 VanDerWaalsContact O-N 3.17Å; L66-L70 HydrophobicContact CG-CD1 4.22Å; L66-L70 WeakPolarHBondContact O-CG 3.4Å; L66-L70 PolarHBondContact O-N 2.98Å |
| 67 | N | 98.8 | Very high | 98.7 | Very high | 85 Ų | 85 | 105.8 Ų | 105.8 | 46% | 0.455 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -60.8 | -41.7 | 177.6 | -165.5 | -79.7 | 0 | 0 | 0 | 111.9 | L63 Q65 R69 L70 Q71 | L63-N67 VanDerWaalsContact O-CB 3.3Å; L63-N67 WeakPolarHBondContact O-CB 3.45Å; L63-N67 PolarHBondContact O-N 3.05Å; Q65-N67 VanDerWaalsContact C-N 3.34Å; Q65-N67 PolarHBondContact O-N 2.87Å; N67-R69 PolarHBondContact O-N 2.84Å; N67-L70 PolarHBondContact O-N 3.25Å; N67-Q71 WeakPolarHBondContact O-CB 3.27Å; N67-Q71 VanDerWaalsContact O-CG 3.28Å; N67-Q71 WeakPolarHBondContact O-CG 3.38Å; N67-Q71 PolarHBondContact O-N 3.31Å; N67-Q71 PolarHBondContact OD1-NE2 3.01Å |
| 68 | R | 98.8 | Very high | 98.7 | Very high | 181 Ų | 181 | 110.1 Ų | 110.1 | 68% | 0.683 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -61.4 | -41.4 | 174.8 | -74.4 | 173.4 | -177.8 | 174 | -0.5 | 112.6 | K64 Q65 L66 Q71 A72 | K64-R68 WeakPolarHBondContact O-CG 3.33Å; K64-R68 PolarHBondContact O-N 3.26Å; K64-R68 VanDerWaalsContact O-N 3.09Å; Q65-R68 PolarHBondContact O-N 3.02Å; L66-R68 VanDerWaalsContact C-N 3.33Å; L66-R68 PolarHBondContact O-N 3.3Å; R68-Q71 PolarHBondContact O-N 2.93Å; R68-A72 PolarHBondContact O-N 3.07Å |
| 69 | R | 98.8 | Very high | 98.8 | Very high | 143 Ų | 143 | 114.3 Ų | 114.3 | 54% | 0.54 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -63.2 | -48.7 | 175.8 | -70.1 | 178.3 | -177.3 | 171.1 | 2 | 111.1 | Q65 L66 N67 Q71 A72 E73 | Q65-R69 PolarHBondContact O-N 2.89Å; Q65-R69 VanDerWaalsContact O-N 3.07Å; L66-R69 PolarHBondContact O-N 3.01Å; L66-R69 VanDerWaalsContact O-N 3.17Å; N67-R69 PolarHBondContact O-N 2.84Å; R69-Q71 VanDerWaalsContact C-N 3.27Å; R69-Q71 PolarHBondContact O-N 3.31Å; R69-A72 WeakPolarHBondContact O-CB 3.45Å; R69-A72 PolarHBondContact O-N 3.41Å; R69-E73 PolarHBondContact O-N 2.92Å |
| 70 | L | 98.9 | Very high | 98.8 | Very high | 92 Ų | 92 | 113.4 Ų | 113.4 | 48% | 0.482 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -59.4 | -37.7 | 175.9 | -70.8 | 172.7 | 0 | 0 | 0 | 112.2 | L66 N67 N74 | L66-L70 HydrophobicContact CG-CD1 4.22Å; L66-L70 WeakPolarHBondContact O-CG 3.4Å; L66-L70 PolarHBondContact O-N 2.98Å; N67-L70 PolarHBondContact O-N 3.25Å; L70-N74 VanDerWaalsContact O-CB 3.24Å; L70-N74 WeakPolarHBondContact O-CB 3.28Å; L70-N74 PolarHBondContact O-N 2.95Å |
| 71 | Q | 98.8 | Very high | 98.8 | Very high | 94 Ų | 94 | 113.2 Ų | 113.2 | 44% | 0.439 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -65.9 | -38 | 174.4 | -75.2 | 179.8 | 3.5 | 0 | 0 | 112.5 | N67 R68 R69 R75 | N67-Q71 WeakPolarHBondContact O-CB 3.27Å; N67-Q71 VanDerWaalsContact O-CG 3.28Å; N67-Q71 WeakPolarHBondContact O-CG 3.38Å; N67-Q71 PolarHBondContact O-N 3.31Å; N67-Q71 PolarHBondContact OD1-NE2 3.01Å; R68-Q71 PolarHBondContact O-N 2.93Å; R69-Q71 VanDerWaalsContact C-N 3.27Å; R69-Q71 PolarHBondContact O-N 3.31Å; Q71-R75 VanDerWaalsContact O-CG 3.28Å; Q71-R75 WeakPolarHBondContact O-CG 3.5Å; Q71-R75 PolarHBondContact O-N 3.01Å |
| 72 | A | 98.8 | Very high | 98.8 | Very high | 41 Ų | 41 | 109.1 Ų | 109.1 | 34% | 0.339 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -65.3 | -50.7 | 175.1 | 0 | 0 | 0 | 0 | 0 | 110.9 | R68 R69 N74 R75 E76 | R68-A72 PolarHBondContact O-N 3.07Å; R69-A72 WeakPolarHBondContact O-CB 3.45Å; R69-A72 PolarHBondContact O-N 3.41Å; A72-N74 VanDerWaalsContact C-N 3.27Å; A72-N74 PolarHBondContact O-N 3.3Å; A72-R75 WeakPolarHBondContact O-CA 3.39Å; A72-R75 WeakPolarHBondContact O-CB 3.49Å; A72-R75 PolarHBondContact O-N 3.3Å; A72-E76 WeakPolarHBondContact O-CG 3.24Å; A72-E76 PolarHBondContact O-N 3.36Å |
| 73 | E | 98.8 | Very high | 98.8 | Very high | 104 Ų | 104 | 108 Ų | 108 | 49% | 0.486 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -58 | -40.2 | 175.4 | -68.8 | 171.4 | -164.8 | 0 | 0 | 111.6 | R69 R75 E76 L77 | R69-E73 PolarHBondContact O-N 2.92Å; E73-R75 VanDerWaalsContact C-N 3.31Å; E73-R75 PolarHBondContact O-N 3.37Å; E73-E76 PolarHBondContact O-N 2.92Å; E73-L77 WeakPolarHBondContact O-CG 3.44Å; E73-L77 PolarHBondContact O-N 3.46Å |
| 74 | N | 98.8 | Very high | 98.8 | Very high | 74 Ų | 74 | 107.1 Ų | 107.1 | 40% | 0.396 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -65.8 | -33.6 | 176.9 | -158.4 | -96 | 0 | 0 | 0 | 112.5 | L70 A72 R78 | L70-N74 VanDerWaalsContact O-CB 3.24Å; L70-N74 WeakPolarHBondContact O-CB 3.28Å; L70-N74 PolarHBondContact O-N 2.95Å; A72-N74 VanDerWaalsContact C-N 3.27Å; A72-N74 PolarHBondContact O-N 3.3Å; N74-R78 VanDerWaalsContact O-CG 3.27Å; N74-R78 WeakPolarHBondContact O-CG 3.46Å; N74-R78 PolarHBondContact O-N 3.03Å; N74-R78 VanDerWaalsContact OD1-CZ 3.27Å; N74-R78 PolarHBondContact OD1-NE 3.45Å; N74-R78 PolarHBondContact OD1-NH2 2.99Å |
| 75 | R | 98.8 | Very high | 98.8 | Very high | 158 Ų | 158 | 104.4 Ų | 104.4 | 60% | 0.596 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -68.8 | -47 | 173 | -71.3 | 168.4 | -172.1 | 176.4 | 2.5 | 110.7 | Q71 A72 E73 L77 R78 D79 | Q71-R75 VanDerWaalsContact O-CG 3.28Å; Q71-R75 WeakPolarHBondContact O-CG 3.5Å; Q71-R75 PolarHBondContact O-N 3.01Å; A72-R75 WeakPolarHBondContact O-CA 3.39Å; A72-R75 WeakPolarHBondContact O-CB 3.49Å; A72-R75 PolarHBondContact O-N 3.3Å; E73-R75 VanDerWaalsContact C-N 3.31Å; E73-R75 PolarHBondContact O-N 3.37Å; R75-L77 VanDerWaalsContact C-N 3.28Å; R75-L77 PolarHBondContact O-N 2.86Å; R75-R78 WeakPolarHBondContact O-CA 3.42Å; R75-R78 WeakPolarHBondContact O-CB 3.48Å; R75-R78 PolarHBondContact O-N 3.26Å; R75-D79 PolarHBondContact O-N 2.86Å |
| 76 | E | 98.8 | Very high | 98.8 | Very high | 130 Ų | 130 | 102.3 Ų | 102.3 | 61% | 0.607 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -57.7 | -40.7 | 176.8 | -70 | 174.3 | -168.7 | 0 | 0 | 112.1 | A72 E73 R78 D79 L80 | A72-E76 WeakPolarHBondContact O-CG 3.24Å; A72-E76 PolarHBondContact O-N 3.36Å; E73-E76 PolarHBondContact O-N 2.92Å; E76-R78 VanDerWaalsContact C-N 3.33Å; E76-R78 PolarHBondContact O-N 3.03Å; E76-D79 PolarHBondContact O-N 3.3Å; E76-L80 WeakPolarHBondContact O-CB 3.4Å; E76-L80 PolarHBondContact O-N 3.49Å |
| 77 | L | 98.9 | Very high | 98.8 | Very high | 103 Ų | 103 | 100.9 Ų | 100.9 | 54% | 0.539 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -62.9 | -38.3 | 174.5 | -73.5 | 174.4 | 0 | 0 | 0 | 112.5 | E73 R75 L80 C81 | E73-L77 WeakPolarHBondContact O-CG 3.44Å; E73-L77 PolarHBondContact O-N 3.46Å; R75-L77 VanDerWaalsContact C-N 3.28Å; R75-L77 PolarHBondContact O-N 2.86Å; L77-L80 PolarHBondContact O-N 3.17Å; L77-C81 PolarHBondContact O-N 3.4Å; L77-C81 PolarHBondContact O-SG 3.46Å |
| 78 | R | 98.8 | Very high | 98.8 | Very high | 159 Ų | 159 | 103.5 Ų | 103.5 | 60% | 0.6 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -66.1 | -42.9 | 175.6 | -68.3 | 167.2 | -165.9 | -161.8 | 0.6 | 111 | N74 R75 E76 L80 C81 C82 | N74-R78 VanDerWaalsContact O-CG 3.27Å; N74-R78 WeakPolarHBondContact O-CG 3.46Å; N74-R78 PolarHBondContact O-N 3.03Å; N74-R78 VanDerWaalsContact OD1-CZ 3.27Å; N74-R78 PolarHBondContact OD1-NE 3.45Å; N74-R78 PolarHBondContact OD1-NH2 2.99Å; R75-R78 WeakPolarHBondContact O-CA 3.42Å; R75-R78 WeakPolarHBondContact O-CB 3.48Å; R75-R78 PolarHBondContact O-N 3.26Å; E76-R78 VanDerWaalsContact C-N 3.33Å; E76-R78 PolarHBondContact O-N 3.03Å; R78-L80 VanDerWaalsContact C-N 3.32Å; R78-L80 PolarHBondContact O-N 3.22Å; R78-C81 WeakPolarHBondContact O-CB 3.41Å; R78-C81 PolarHBondContact O-N 3.48Å; R78-C82 PolarHBondContact O-N 3.27Å; R78-C82 PolarHBondContact O-SG 3.3Å; R78-C82 VanDerWaalsContact O-SG 3.4Å |
| 79 | D | 98.8 | Very high | 98.8 | Very high | 110 Ų | 110 | 99.6 Ų | 99.6 | 59% | 0.588 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -63.6 | -41.3 | 178 | -64.3 | -21.4 | 0 | 0 | 0 | 111 | R75 E76 C81 C82 F83 | R75-D79 PolarHBondContact O-N 2.86Å; E76-D79 PolarHBondContact O-N 3.3Å; D79-C81 PolarHBondContact O-N 2.99Å; D79-C82 WeakPolarHBondContact O-CB 3.32Å; D79-C82 PolarHBondContact O-N 3.49Å; D79-F83 PolarHBondContact O-N 2.9Å |
| 80 | L | 98.8 | Very high | 98.8 | Very high | 88 Ų | 88 | 99.4 Ų | 99.4 | 46% | 0.461 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -61.7 | -43.1 | 174 | -177.6 | 61.9 | 0 | 0 | 0 | 111.8 | E76 L77 R78 C82 F83 L84 | E76-L80 WeakPolarHBondContact O-CB 3.4Å; E76-L80 PolarHBondContact O-N 3.49Å; L77-L80 PolarHBondContact O-N 3.17Å; R78-L80 VanDerWaalsContact C-N 3.32Å; R78-L80 PolarHBondContact O-N 3.22Å; L80-C82 VanDerWaalsContact C-N 3.35Å; L80-C82 PolarHBondContact O-N 2.88Å; L80-F83 HydrophobicContact CD1-CD1 4.41Å; L80-F83 PolarHBondContact O-N 2.76Å; L80-L84 HydrophobicContact CD1-CD1 4.34Å; L80-L84 HydrophobicContact CD1-CG 4.22Å; L80-L84 HydrophobicContact CG-CD1 4.07Å; L80-L84 HydrophobicContact CG-CG 4.38Å; L80-L84 WeakPolarHBondContact O-CB 3.33Å; L80-L84 WeakPolarHBondContact O-CG 3.38Å; L80-L84 PolarHBondContact O-N 3.2Å |
| 81 | C | 98.8 | Very high | 98.8 | Very high | 77 Ų | 77 | 97 Ų | 97 | 52% | 0.52 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -58.1 | -46.4 | 174.5 | -74.8 | 0 | 0 | 0 | 0 | 111.7 | L77 R78 D79 F83 L84 D85 | L77-C81 PolarHBondContact O-N 3.4Å; L77-C81 PolarHBondContact O-SG 3.46Å; R78-C81 WeakPolarHBondContact O-CB 3.41Å; R78-C81 PolarHBondContact O-N 3.48Å; D79-C81 PolarHBondContact O-N 2.99Å; C81-F83 VanDerWaalsContact C-N 3.33Å; C81-F83 PolarHBondContact O-N 2.92Å; C81-L84 PolarHBondContact O-N 2.96Å; C81-D85 PolarHBondContact O-N 3.07Å |
| 82 | C | 98.7 | Very high | 98.8 | Very high | 81 Ų | 81 | 99.1 Ų | 99.1 | 55% | 0.547 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -59.8 | -42.4 | 176.6 | -69.2 | 0 | 0 | 0 | 0 | 112.4 | R78 D79 L80 S86 | R78-C82 PolarHBondContact O-N 3.27Å; R78-C82 PolarHBondContact O-SG 3.3Å; R78-C82 VanDerWaalsContact O-SG 3.4Å; D79-C82 WeakPolarHBondContact O-CB 3.32Å; D79-C82 PolarHBondContact O-N 3.49Å; L80-C82 VanDerWaalsContact C-N 3.35Å; L80-C82 PolarHBondContact O-N 2.88Å; C82-S86 PolarHBondContact O-N 2.86Å; C82-S86 VanDerWaalsContact O-N 3.12Å; C82-S86 PolarHBondContact O-OG 3.35Å |
| 83 | F | 98.8 | Very high | 98.8 | Very high | 113 Ų | 113 | 103.4 Ų | 103.4 | 50% | 0.496 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -61.5 | -50.9 | 175.1 | 173.6 | -98.4 | 0 | 0 | 0 | 111.5 | D79 L80 C81 D85 S86 E87 | D79-F83 PolarHBondContact O-N 2.9Å; L80-F83 HydrophobicContact CD1-CD1 4.41Å; L80-F83 PolarHBondContact O-N 2.76Å; C81-F83 VanDerWaalsContact C-N 3.33Å; C81-F83 PolarHBondContact O-N 2.92Å; F83-D85 VanDerWaalsContact C-N 3.31Å; F83-D85 PolarHBondContact O-N 3.12Å; F83-S86 WeakPolarHBondContact O-CA 3.3Å; F83-S86 VanDerWaalsContact O-CB 3.3Å; F83-S86 WeakPolarHBondContact O-CB 3.46Å; F83-S86 PolarHBondContact O-N 3.36Å; F83-E87 HydrophobicContact CD1-CG 4.11Å; F83-E87 HydrophobicContact CE1-CG 3.62Å; F83-E87 HydrophobicContact CE2-CG 4.22Å; F83-E87 HydrophobicContact CZ-CG 3.68Å; F83-E87 PolarHBondContact O-N 3.3Å |
| 84 | L | 98.9 | Very high | 98.8 | Very high | 94 Ų | 94 | 101.3 Ų | 101.3 | 49% | 0.492 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -63.2 | -35.5 | -179.2 | -69.6 | 175.7 | 0 | 0 | 0 | 112.6 | L80 C81 S86 E87 R88 | L80-L84 HydrophobicContact CD1-CD1 4.34Å; L80-L84 HydrophobicContact CD1-CG 4.22Å; L80-L84 HydrophobicContact CG-CD1 4.07Å; L80-L84 HydrophobicContact CG-CG 4.38Å; L80-L84 WeakPolarHBondContact O-CB 3.33Å; L80-L84 WeakPolarHBondContact O-CG 3.38Å; L80-L84 PolarHBondContact O-N 3.2Å; C81-L84 PolarHBondContact O-N 2.96Å; L84-S86 VanDerWaalsContact C-N 3.33Å; L84-E87 PolarHBondContact O-N 3.33Å; L84-R88 VanDerWaalsContact O-CB 3.31Å; L84-R88 WeakPolarHBondContact O-CB 3.31Å; L84-R88 PolarHBondContact O-N 3.01Å |
| 85 | D | 98.8 | Very high | 98.8 | Very high | 70 Ų | 70 | 100.4 Ų | 100.4 | 37% | 0.374 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -64.8 | -39.7 | 173.4 | -92.6 | -37.8 | 0 | 0 | 0 | 112.1 | C81 F83 R88 Q89 | C81-D85 PolarHBondContact O-N 3.07Å; F83-D85 VanDerWaalsContact C-N 3.31Å; F83-D85 PolarHBondContact O-N 3.12Å; D85-R88 PolarHBondContact O-N 3.44Å; D85-R88 IonicContact OD1-CZ 3.42Å; D85-R88 IonicContact OD1-NE 2.76Å; D85-R88 PolarHBondContact OD1-NE 3.42Å; D85-R88 IonicContact OD1-NH2 2.74Å; D85-R88 PolarHBondContact OD1-NH2 3.13Å; D85-Q89 WeakPolarHBondContact O-CG 3.32Å; D85-Q89 PolarHBondContact O-N 3.46Å |
| 86 | S | 98.8 | Very high | 98.8 | Very high | 60 Ų | 60 | 99.6 Ų | 99.6 | 42% | 0.42 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -62.4 | -46.4 | 173.8 | -58.3 | 0 | 0 | 0 | 0 | 110.8 | C82 F83 L84 R88 Q89 R90 | C82-S86 PolarHBondContact O-N 2.86Å; C82-S86 VanDerWaalsContact O-N 3.12Å; C82-S86 PolarHBondContact O-OG 3.35Å; F83-S86 WeakPolarHBondContact O-CA 3.3Å; F83-S86 VanDerWaalsContact O-CB 3.3Å; F83-S86 WeakPolarHBondContact O-CB 3.46Å; F83-S86 PolarHBondContact O-N 3.36Å; L84-S86 VanDerWaalsContact C-N 3.33Å; S86-R88 PolarHBondContact O-N 2.93Å; S86-Q89 PolarHBondContact O-N 2.6Å; S86-R90 WeakPolarHBondContact O-CG 3.5Å; S86-R90 PolarHBondContact O-N 2.9Å |
| 87 | E | 98.8 | Very high | 98.8 | Very high | 62 Ų | 62 | 99.4 Ų | 99.4 | 29% | 0.29 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -58.6 | -46.9 | 175.2 | -68.6 | -47.3 | 84.2 | 0 | 0 | 112.4 | F83 L84 Q89 R90 G91 | F83-E87 HydrophobicContact CD1-CG 4.11Å; F83-E87 HydrophobicContact CE1-CG 3.62Å; F83-E87 HydrophobicContact CE2-CG 4.22Å; F83-E87 HydrophobicContact CZ-CG 3.68Å; F83-E87 PolarHBondContact O-N 3.3Å; L84-E87 PolarHBondContact O-N 3.33Å; E87-Q89 VanDerWaalsContact C-N 3.27Å; E87-Q89 PolarHBondContact O-N 2.74Å; E87-R90 PolarHBondContact O-N 2.89Å; E87-R90 VanDerWaalsContact O-N 3.13Å; E87-R90 IonicContact OE1-CZ 3.52Å; E87-R90 IonicContact OE1-NE 2.88Å; E87-R90 PolarHBondContact OE1-NE 3.42Å; E87-R90 IonicContact OE1-NH2 3.66Å; E87-R90 PolarHBondContact OE1-NH2 2.89Å; E87-R90 IonicContact OE2-CZ 2.97Å; E87-R90 IonicContact OE2-NE 4Å; E87-R90 IonicContact OE2-NH2 3.85Å; E87-R90 PolarHBondContact OE2-NH2 2.74Å; E87-G91 PolarHBondContact O-N 3.36Å |
| 88 | R | 98.8 | Very high | 98.8 | Very high | 139 Ų | 139 | 103.2 Ų | 103.2 | 53% | 0.525 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -58.5 | -42 | 177.9 | -173.9 | 176.1 | 67.1 | 156.2 | -3.7 | 111.1 | L84 D85 S86 R92 | L84-R88 VanDerWaalsContact O-CB 3.31Å; L84-R88 WeakPolarHBondContact O-CB 3.31Å; L84-R88 PolarHBondContact O-N 3.01Å; D85-R88 PolarHBondContact O-N 3.44Å; D85-R88 IonicContact OD1-CZ 3.42Å; D85-R88 IonicContact OD1-NE 2.76Å; D85-R88 PolarHBondContact OD1-NE 3.42Å; D85-R88 IonicContact OD1-NH2 2.74Å; D85-R88 PolarHBondContact OD1-NH2 3.13Å; S86-R88 PolarHBondContact O-N 2.93Å; R88-R92 WeakPolarHBondContact O-CG 3.4Å; R88-R92 PolarHBondContact O-N 3.46Å |
| 89 | Q | 98.8 | Very high | 98.8 | Very high | 99 Ų | 99 | 102.1 Ų | 102.1 | 46% | 0.463 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -67.9 | -40.8 | 175.8 | -69.8 | 177.2 | 33.4 | 0 | 0 | 112.3 | D85 S86 E87 R92 R93 | D85-Q89 WeakPolarHBondContact O-CG 3.32Å; D85-Q89 PolarHBondContact O-N 3.46Å; S86-Q89 PolarHBondContact O-N 2.6Å; E87-Q89 VanDerWaalsContact C-N 3.27Å; E87-Q89 PolarHBondContact O-N 2.74Å; Q89-R92 PolarHBondContact O-N 3.16Å; Q89-R93 PolarHBondContact O-N 3.35Å |
| 90 | R | 98.8 | Very high | 98.8 | Very high | 139 Ų | 139 | 101.2 Ų | 101.2 | 53% | 0.525 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -59.2 | -46.7 | 173.6 | -68.3 | -161.3 | -63.4 | 160.8 | -3.7 | 111.1 | S86 E87 R92 R93 A94 | S86-R90 WeakPolarHBondContact O-CG 3.5Å; S86-R90 PolarHBondContact O-N 2.9Å; E87-R90 PolarHBondContact O-N 2.89Å; E87-R90 VanDerWaalsContact O-N 3.13Å; E87-R90 IonicContact OE1-CZ 3.52Å; E87-R90 IonicContact OE1-NE 2.88Å; E87-R90 PolarHBondContact OE1-NE 3.42Å; E87-R90 IonicContact OE1-NH2 3.66Å; E87-R90 PolarHBondContact OE1-NH2 2.89Å; E87-R90 IonicContact OE2-CZ 2.97Å; E87-R90 IonicContact OE2-NE 4Å; E87-R90 IonicContact OE2-NH2 3.85Å; E87-R90 PolarHBondContact OE2-NH2 2.74Å; R90-R92 PolarHBondContact O-N 3.03Å; R90-R93 PolarHBondContact O-N 3.06Å; R90-R93 VanDerWaalsContact O-N 3.16Å; R90-A94 PolarHBondContact O-N 2.89Å |
| 91 | G | 98.8 | Very high | 98.8 | Very high | 42 Ų | 42 | 102.6 Ų | 102.6 | 43% | 0.433 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -58.7 | -43.7 | 176.2 | 0 | 0 | 0 | 0 | 0 | 113 | E87 R93 A94 A95 | E87-G91 PolarHBondContact O-N 3.36Å; G91-R93 PolarHBondContact O-N 3.43Å; G91-A94 PolarHBondContact O-N 3.47Å; G91-A95 WeakPolarHBondContact O-CB 3.4Å; G91-A95 PolarHBondContact O-N 2.81Å |
| 92 | R | 98.8 | Very high | 98.8 | Very high | 138 Ų | 138 | 100.6 Ų | 100.6 | 52% | 0.521 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -63.3 | -39.1 | 175.1 | -71.9 | -179.7 | -173.2 | -163 | 1.5 | 112.9 | R88 Q89 R90 R96 | R88-R92 WeakPolarHBondContact O-CG 3.4Å; R88-R92 PolarHBondContact O-N 3.46Å; Q89-R92 PolarHBondContact O-N 3.16Å; R90-R92 PolarHBondContact O-N 3.03Å; R92-R96 WeakPolarHBondContact O-CG 3.49Å; R92-R96 PolarHBondContact O-N 3.18Å |
| 93 | R | 98.8 | Very high | 98.8 | Very high | 131 Ų | 131 | 101.1 Ų | 101.1 | 49% | 0.494 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -64.7 | -47.1 | 175.2 | -75.3 | -176 | -77.7 | -109.1 | -1.6 | 110.8 | Q89 R90 G91 A95 R96 Q97 | Q89-R93 PolarHBondContact O-N 3.35Å; R90-R93 PolarHBondContact O-N 3.06Å; R90-R93 VanDerWaalsContact O-N 3.16Å; G91-R93 PolarHBondContact O-N 3.43Å; R93-A95 PolarHBondContact O-N 3.34Å; R93-R96 PolarHBondContact O-N 3.21Å; R93-Q97 WeakPolarHBondContact O-CG 3.35Å; R93-Q97 PolarHBondContact O-N 3.38Å |
| 94 | A | 98.8 | Very high | 98.8 | Very high | 61 Ų | 61 | 101.9 Ų | 101.9 | 50% | 0.504 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -59.4 | -45.7 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | R90 G91 R96 Q97 W98 | R90-A94 PolarHBondContact O-N 2.89Å; G91-A94 PolarHBondContact O-N 3.47Å; A94-R96 VanDerWaalsContact C-N 3.34Å; A94-R96 PolarHBondContact O-N 3.03Å; A94-Q97 PolarHBondContact O-N 3.26Å; A94-W98 WeakPolarHBondContact O-CB 3.42Å; A94-W98 PolarHBondContact O-N 2.97Å |
| 95 | A | 98.8 | Very high | 98.8 | Very high | 54 Ų | 54 | 99.2 Ų | 99.2 | 45% | 0.446 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -59.5 | -42 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | G91 R93 W98 Q99 | G91-A95 WeakPolarHBondContact O-CB 3.4Å; G91-A95 PolarHBondContact O-N 2.81Å; R93-A95 PolarHBondContact O-N 3.34Å; A95-W98 WeakPolarHBondContact O-CB 3.4Å; A95-W98 PolarHBondContact O-N 3.03Å; A95-Q99 WeakPolarHBondContact O-CG 3.49Å; A95-Q99 PolarHBondContact O-N 3.3Å |
| 96 | R | 98.8 | Very high | 98.8 | Very high | 142 Ų | 142 | 97.8 Ų | 97.8 | 54% | 0.536 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -63 | -45.9 | 175.1 | -77.5 | -175.4 | -103.3 | -100 | 8.7 | 112.2 | R92 R93 A94 W98 Q99 L100 | R92-R96 WeakPolarHBondContact O-CG 3.49Å; R92-R96 PolarHBondContact O-N 3.18Å; R93-R96 PolarHBondContact O-N 3.21Å; A94-R96 VanDerWaalsContact C-N 3.34Å; A94-R96 PolarHBondContact O-N 3.03Å; R96-W98 VanDerWaalsContact C-N 3.27Å; R96-W98 PolarHBondContact O-N 3.27Å; R96-Q99 PolarHBondContact O-N 3.43Å; R96-L100 WeakPolarHBondContact O-CG 3.39Å; R96-L100 PolarHBondContact O-N 2.86Å |
| 97 | Q | 98.7 | Very high | 98.7 | Very high | 126 Ų | 126 | 102.3 Ų | 102.3 | 59% | 0.589 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -61.9 | -39.2 | 176.5 | -67.5 | -59.9 | -31 | 0 | 0 | 111.4 | R93 A94 Q99 L100 F101 | R93-Q97 WeakPolarHBondContact O-CG 3.35Å; R93-Q97 PolarHBondContact O-N 3.38Å; A94-Q97 PolarHBondContact O-N 3.26Å; Q97-Q99 PolarHBondContact O-N 3.33Å; Q97-L100 PolarHBondContact O-N 2.84Å; Q97-F101 WeakPolarHBondContact O-CB 3.42Å; Q97-F101 PolarHBondContact O-N 3.25Å |
| 98 | W | 98.7 | Very high | 98.7 | Very high | 183 Ų | 183 | 101.3 Ų | 101.3 | 69% | 0.693 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -63.5 | -41.1 | 176 | -169.7 | -105.3 | 0 | 0 | 0 | 112.8 | A94 A95 R96 F101 G102 | A94-W98 WeakPolarHBondContact O-CB 3.42Å; A94-W98 PolarHBondContact O-N 2.97Å; A95-W98 WeakPolarHBondContact O-CB 3.4Å; A95-W98 PolarHBondContact O-N 3.03Å; R96-W98 VanDerWaalsContact C-N 3.27Å; R96-W98 PolarHBondContact O-N 3.27Å; W98-F101 HydrophobicContact CE3-CD1 4.26Å; W98-F101 HydrophobicContact CH2-CD1 4.47Å; W98-F101 HydrophobicContact CH2-CE1 4.4Å; W98-F101 HydrophobicContact CZ3-CD1 4.15Å; W98-F101 HydrophobicContact CZ3-CE1 4.36Å; W98-F101 PolarHBondContact O-N 2.76Å; W98-G102 PolarHBondContact O-N 2.81Å |
| 99 | Q | 98.7 | Very high | 98.7 | Very high | 136 Ų | 136 | 98.6 Ų | 98.6 | 64% | 0.636 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -64.4 | -41.4 | 174.7 | -73.8 | 179.8 | -34.5 | 0 | 0 | 112.4 | A95 R96 Q97 G102 T103 | A95-Q99 WeakPolarHBondContact O-CG 3.49Å; A95-Q99 PolarHBondContact O-N 3.3Å; R96-Q99 PolarHBondContact O-N 3.43Å; Q97-Q99 PolarHBondContact O-N 3.33Å; Q99-G102 PolarHBondContact O-N 3.45Å; Q99-T103 WeakPolarHBondContact O-CB 3.35Å; Q99-T103 PolarHBondContact O-N 2.78Å; Q99-T103 PolarHBondContact O-OG1 3.46Å |
| 100 | L | 98.7 | Very high | 98.7 | Very high | 90 Ų | 90 | 101.1 Ų | 101.1 | 47% | 0.471 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -62.6 | -49.2 | 175.4 | -70.9 | 170.7 | 0 | 0 | 0 | 110.8 | R96 Q97 G102 T103 Q104 | R96-L100 WeakPolarHBondContact O-CG 3.39Å; R96-L100 PolarHBondContact O-N 2.86Å; Q97-L100 PolarHBondContact O-N 2.84Å; L100-G102 PolarHBondContact O-N 2.89Å; L100-T103 PolarHBondContact O-N 3.37Å; L100-Q104 WeakPolarHBondContact O-CG 3.26Å; L100-Q104 PolarHBondContact O-N 3.5Å |
| 101 | F | 98.8 | Very high | 98.7 | Very high | 118 Ų | 118 | 99.6 Ų | 99.6 | 52% | 0.518 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -55.7 | -50.3 | 175.2 | 172.2 | -100.3 | 0 | 0 | 0 | 111.4 | Q97 W98 T103 Q104 A105 | Q97-F101 WeakPolarHBondContact O-CB 3.42Å; Q97-F101 PolarHBondContact O-N 3.25Å; W98-F101 HydrophobicContact CE3-CD1 4.26Å; W98-F101 HydrophobicContact CH2-CD1 4.47Å; W98-F101 HydrophobicContact CH2-CE1 4.4Å; W98-F101 HydrophobicContact CZ3-CD1 4.15Å; W98-F101 HydrophobicContact CZ3-CE1 4.36Å; W98-F101 PolarHBondContact O-N 2.76Å; F101-T103 VanDerWaalsContact C-N 3.29Å; F101-T103 PolarHBondContact O-N 3.06Å; F101-Q104 PolarHBondContact O-N 2.92Å; F101-A105 HydrophobicContact CE1-CB 4.47Å; F101-A105 HydrophobicContact CZ-CB 4.37Å; F101-A105 VanDerWaalsContact O-CB 3.26Å; F101-A105 WeakPolarHBondContact O-CB 3.48Å; F101-A105 PolarHBondContact O-N 3.22Å |
| 102 | G | 98.7 | Very high | 98.7 | Very high | 35 Ų | 35 | 102.8 Ų | 102.8 | 36% | 0.361 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -59.4 | -40.3 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | W98 Q99 L100 S106 | W98-G102 PolarHBondContact O-N 2.81Å; Q99-G102 PolarHBondContact O-N 3.45Å; L100-G102 PolarHBondContact O-N 2.89Å; G102-S106 WeakPolarHBondContact O-CB 3.45Å; G102-S106 PolarHBondContact O-N 2.94Å |
| 103 | T | 98.7 | Very high | 98.7 | Very high | 91 Ų | 91 | 100.7 Ų | 100.7 | 56% | 0.558 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -63.6 | -49.9 | 176.3 | -55 | 0 | 0 | 0 | 0 | 111.1 | Q99 L100 F101 S106 R107 | Q99-T103 WeakPolarHBondContact O-CB 3.35Å; Q99-T103 PolarHBondContact O-N 2.78Å; Q99-T103 PolarHBondContact O-OG1 3.46Å; L100-T103 PolarHBondContact O-N 3.37Å; F101-T103 VanDerWaalsContact C-N 3.29Å; F101-T103 PolarHBondContact O-N 3.06Å; T103-S106 PolarHBondContact O-N 3.33Å; T103-S106 PolarHBondContact O-OG 3.23Å; T103-R107 PolarHBondContact O-N 2.97Å |
| 104 | Q | 98.7 | Very high | 98.7 | Very high | 129 Ų | 129 | 96.2 Ų | 96.2 | 60% | 0.603 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -63.5 | -45.6 | 179.9 | -70.4 | 174.6 | 4.1 | 0 | 0 | 111.9 | L100 F101 S106 R107 A108 | L100-Q104 WeakPolarHBondContact O-CG 3.26Å; L100-Q104 PolarHBondContact O-N 3.5Å; F101-Q104 PolarHBondContact O-N 2.92Å; Q104-S106 VanDerWaalsContact C-N 3.35Å; Q104-S106 PolarHBondContact O-N 3.14Å; Q104-R107 WeakPolarHBondContact O-CB 3.47Å; Q104-R107 PolarHBondContact O-N 3.44Å; Q104-R107 VanDerWaalsContact O-N 3.14Å; Q104-A108 PolarHBondContact O-N 2.79Å |
| 105 | A | 98.8 | Very high | 98.7 | Very high | 38 Ų | 38 | 94.6 Ų | 94.6 | 31% | 0.314 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -60 | -44.6 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | F101 R107 A108 V109 | F101-A105 HydrophobicContact CE1-CB 4.47Å; F101-A105 HydrophobicContact CZ-CB 4.37Å; F101-A105 VanDerWaalsContact O-CB 3.26Å; F101-A105 WeakPolarHBondContact O-CB 3.48Å; F101-A105 PolarHBondContact O-N 3.22Å; A105-R107 VanDerWaalsContact C-N 3.26Å; A105-R107 PolarHBondContact O-N 2.87Å; A105-A108 PolarHBondContact O-N 3.16Å; A105-V109 WeakPolarHBondContact O-CG2 3.46Å; A105-V109 PolarHBondContact O-N 3.36Å |
| 106 | S | 98.7 | Very high | 98.7 | Very high | 41 Ų | 41 | 95.7 Ų | 95.7 | 29% | 0.287 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -62.2 | -35.3 | 176.8 | 81.8 | 0 | 0 | 0 | 0 | 112.6 | G102 T103 Q104 R110 | G102-S106 WeakPolarHBondContact O-CB 3.45Å; G102-S106 PolarHBondContact O-N 2.94Å; T103-S106 PolarHBondContact O-N 3.33Å; T103-S106 PolarHBondContact O-OG 3.23Å; Q104-S106 VanDerWaalsContact C-N 3.35Å; Q104-S106 PolarHBondContact O-N 3.14Å; S106-R110 WeakPolarHBondContact O-CG 3.42Å; S106-R110 PolarHBondContact O-N 3.46Å; S106-R110 VanDerWaalsContact O-N 3.17Å; S106-R110 PolarHBondContact O-NH1 2.95Å; S106-R110 PolarHBondContact OG-NH1 2.83Å; S106-R110 PolarHBondContact OG-NH2 3.33Å; S106-R110 VanDerWaalsContact OG-NH2 3.08Å |
| 107 | R | 98.7 | Very high | 98.7 | Very high | 154 Ų | 154 | 97 Ų | 97 | 58% | 0.581 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -69.4 | -49.1 | 178.2 | 179 | 178.9 | 175.8 | 169 | 0.7 | 110.6 | T103 Q104 A105 V109 R110 E111 | T103-R107 PolarHBondContact O-N 2.97Å; Q104-R107 WeakPolarHBondContact O-CB 3.47Å; Q104-R107 PolarHBondContact O-N 3.44Å; Q104-R107 VanDerWaalsContact O-N 3.14Å; A105-R107 VanDerWaalsContact C-N 3.26Å; A105-R107 PolarHBondContact O-N 2.87Å; R107-V109 VanDerWaalsContact C-N 3.32Å; R107-V109 PolarHBondContact O-N 3.11Å; R107-R110 PolarHBondContact O-N 3.05Å; R107-R110 VanDerWaalsContact O-N 3.11Å; R107-E111 HydrophobicContact CG-CG 4.46Å; R107-E111 WeakPolarHBondContact CG-OE1 3.37Å; R107-E111 IonicContact CZ-OE1 2.85Å; R107-E111 IonicContact NE-OE1 2.67Å; R107-E111 PolarHBondContact NE-OE1 3.24Å; R107-E111 IonicContact NH2-OE1 3.44Å; R107-E111 PolarHBondContact NH2-OE1 2.88Å; R107-E111 WeakPolarHBondContact O-CG 3.26Å; R107-E111 PolarHBondContact O-N 3.08Å |
| 108 | A | 98.8 | Very high | 98.7 | Very high | 42 Ų | 42 | 97 Ų | 97 | 35% | 0.347 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -55.3 | -48.6 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.1 | Q104 A105 R110 E111 D112 | Q104-A108 PolarHBondContact O-N 2.79Å; A105-A108 PolarHBondContact O-N 3.16Å; A108-R110 VanDerWaalsContact C-N 3.32Å; A108-R110 PolarHBondContact O-N 3.31Å; A108-E111 PolarHBondContact O-N 3.4Å; A108-E111 VanDerWaalsContact O-N 3.16Å; A108-D112 VanDerWaalsContact O-CG 3.32Å; A108-D112 PolarHBondContact O-N 3.03Å |
| 109 | V | 98.8 | Very high | 98.7 | Very high | 82 Ų | 82 | 94.8 Ų | 94.8 | 50% | 0.497 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -60.2 | -39.8 | 177.8 | 173 | 0 | 0 | 0 | 0 | 112.2 | A105 R107 L113 | A105-V109 WeakPolarHBondContact O-CG2 3.46Å; A105-V109 PolarHBondContact O-N 3.36Å; R107-V109 VanDerWaalsContact C-N 3.32Å; R107-V109 PolarHBondContact O-N 3.11Å; V109-L113 HydrophobicContact CG1-CD1 3.91Å; V109-L113 HydrophobicContact CG1-CG 4.37Å; V109-L113 WeakPolarHBondContact O-CB 3.34Å; V109-L113 VanDerWaalsContact O-CG 3.26Å; V109-L113 WeakPolarHBondContact O-CG 3.33Å; V109-L113 PolarHBondContact O-N 3.35Å |
| 110 | R | 98.8 | Very high | 98.7 | Very high | 151 Ų | 151 | 91.8 Ų | 91.8 | 57% | 0.57 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -66.5 | -41 | 176.8 | -78.6 | -170.8 | -64.7 | -83.7 | -3.1 | 112.4 | S106 R107 A108 G114 | S106-R110 WeakPolarHBondContact O-CG 3.42Å; S106-R110 PolarHBondContact O-N 3.46Å; S106-R110 VanDerWaalsContact O-N 3.17Å; S106-R110 PolarHBondContact O-NH1 2.95Å; S106-R110 PolarHBondContact OG-NH1 2.83Å; S106-R110 PolarHBondContact OG-NH2 3.33Å; S106-R110 VanDerWaalsContact OG-NH2 3.08Å; R107-R110 PolarHBondContact O-N 3.05Å; R107-R110 VanDerWaalsContact O-N 3.11Å; A108-R110 VanDerWaalsContact C-N 3.32Å; A108-R110 PolarHBondContact O-N 3.31Å; R110-G114 PolarHBondContact O-N 2.95Å |
| 111 | E | 98.7 | Very high | 98.7 | Very high | 107 Ų | 107 | 90.2 Ų | 90.2 | 50% | 0.5 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -64.1 | -45.6 | 177 | -71.5 | 171.2 | 176.8 | 0 | 0 | 110.5 | R107 A108 G114 G115 | R107-E111 HydrophobicContact CG-CG 4.46Å; R107-E111 WeakPolarHBondContact CG-OE1 3.37Å; R107-E111 IonicContact CZ-OE1 2.85Å; R107-E111 IonicContact NE-OE1 2.67Å; R107-E111 PolarHBondContact NE-OE1 3.24Å; R107-E111 IonicContact NH2-OE1 3.44Å; R107-E111 PolarHBondContact NH2-OE1 2.88Å; R107-E111 WeakPolarHBondContact O-CG 3.26Å; R107-E111 PolarHBondContact O-N 3.08Å; A108-E111 PolarHBondContact O-N 3.4Å; A108-E111 VanDerWaalsContact O-N 3.16Å; E111-G114 PolarHBondContact O-N 3.28Å; E111-G115 PolarHBondContact O-N 3.42Å |
| 112 | D | 98.7 | Very high | 98.7 | Very high | 110 Ų | 110 | 88.8 Ų | 88.8 | 59% | 0.588 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -61.2 | -47.2 | 176.7 | -69.7 | -21.6 | 0 | 0 | 0 | 112.1 | A108 G114 G115 C116 | A108-D112 VanDerWaalsContact O-CG 3.32Å; A108-D112 PolarHBondContact O-N 3.03Å; D112-G114 PolarHBondContact O-N 2.92Å; D112-G115 PolarHBondContact O-N 2.97Å; D112-C116 PolarHBondContact O-N 3.17Å; D112-C116 PolarHBondContact O-SG 2.97Å |
| 113 | L | 98.8 | Very high | 98.7 | Very high | 93 Ų | 93 | 92 Ų | 92 | 49% | 0.487 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -62.3 | -42.7 | 176.5 | -74.4 | 172.4 | 0 | 0 | 0 | 111.6 | V109 G115 C116 W117 | V109-L113 HydrophobicContact CG1-CD1 3.91Å; V109-L113 HydrophobicContact CG1-CG 4.37Å; V109-L113 WeakPolarHBondContact O-CB 3.34Å; V109-L113 VanDerWaalsContact O-CG 3.26Å; V109-L113 WeakPolarHBondContact O-CG 3.33Å; V109-L113 PolarHBondContact O-N 3.35Å; L113-G115 VanDerWaalsContact C-N 3.31Å; L113-G115 PolarHBondContact O-N 3.02Å; L113-C116 WeakPolarHBondContact O-CB 3.44Å; L113-C116 PolarHBondContact O-N 3.44Å; L113-W117 PolarHBondContact O-N 3.26Å |
| 114 | G | 98.6 | Very high | 98.7 | Very high | 37 Ų | 37 | 92.6 Ų | 92.6 | 38% | 0.381 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -57.9 | -43.7 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | R110 E111 D112 C116 W117 Q118 | R110-G114 PolarHBondContact O-N 2.95Å; E111-G114 PolarHBondContact O-N 3.28Å; D112-G114 PolarHBondContact O-N 2.92Å; G114-C116 PolarHBondContact O-N 3.49Å; G114-W117 PolarHBondContact O-N 2.95Å; G114-Q118 PolarHBondContact O-N 2.97Å |
| 115 | G | 98.6 | Very high | 98.7 | Very high | 27 Ų | 27 | 87.8 Ų | 87.8 | 28% | 0.278 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -63 | -39.3 | 174.5 | 0 | 0 | 0 | 0 | 0 | 113.2 | E111 D112 L113 K119 | E111-G115 PolarHBondContact O-N 3.42Å; D112-G115 PolarHBondContact O-N 2.97Å; L113-G115 VanDerWaalsContact C-N 3.31Å; L113-G115 PolarHBondContact O-N 3.02Å; G115-K119 WeakPolarHBondContact O-CG 3.34Å; G115-K119 PolarHBondContact O-N 3.5Å; G115-K119 VanDerWaalsContact O-N 3.09Å |
| 116 | C | 98.7 | Very high | 98.7 | Very high | 78 Ų | 78 | 92.7 Ų | 92.7 | 53% | 0.527 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -64.1 | -44.2 | 173.9 | -72 | 0 | 0 | 0 | 0 | 112.2 | D112 L113 G114 Q118 K119 L120 | D112-C116 PolarHBondContact O-N 3.17Å; D112-C116 PolarHBondContact O-SG 2.97Å; L113-C116 WeakPolarHBondContact O-CB 3.44Å; L113-C116 PolarHBondContact O-N 3.44Å; G114-C116 PolarHBondContact O-N 3.49Å; C116-Q118 PolarHBondContact O-N 3.49Å; C116-K119 PolarHBondContact O-N 2.9Å; C116-L120 PolarHBondContact O-N 3.43Å |
| 117 | W | 98.6 | Very high | 98.7 | Very high | 169 Ų | 169 | 96.6 Ų | 96.6 | 64% | 0.64 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -61.6 | -42.7 | 176.6 | -77.1 | 117.5 | 0 | 0 | 0 | 112.4 | L113 G114 L120 A121 | L113-W117 PolarHBondContact O-N 3.26Å; G114-W117 PolarHBondContact O-N 2.95Å; W117-L120 HydrophobicContact CE3-CD2 3.91Å; W117-L120 HydrophobicContact CZ3-CD2 3.75Å; W117-L120 PolarHBondContact O-N 3.29Å; W117-A121 PolarHBondContact O-N 3.39Å |
| 118 | Q | 98.7 | Very high | 98.7 | Very high | 127 Ų | 127 | 94 Ų | 94 | 59% | 0.593 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -61.1 | -46.8 | 176.4 | -176.3 | 175.2 | -1.1 | 0 | 0 | 111.5 | G114 C116 L120 A121 E122 | G114-Q118 PolarHBondContact O-N 2.97Å; C116-Q118 PolarHBondContact O-N 3.49Å; Q118-L120 VanDerWaalsContact C-N 3.29Å; Q118-L120 PolarHBondContact O-N 3.26Å; Q118-A121 PolarHBondContact O-N 3.04Å; Q118-E122 WeakPolarHBondContact O-CG 3.35Å; Q118-E122 PolarHBondContact O-N 3.32Å |
| 119 | K | 98.7 | Very high | 98.7 | Very high | 136 Ų | 136 | 97.4 Ų | 97.4 | 59% | 0.591 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -61.4 | -37.9 | 176.4 | -72.3 | 173.2 | -175.8 | 175.2 | 0 | 112.4 | G115 C116 E122 L123 | G115-K119 WeakPolarHBondContact O-CG 3.34Å; G115-K119 PolarHBondContact O-N 3.5Å; G115-K119 VanDerWaalsContact O-N 3.09Å; C116-K119 PolarHBondContact O-N 2.9Å; K119-E122 PolarHBondContact O-N 3.18Å; K119-L123 VanDerWaalsContact O-CG 3.32Å; K119-L123 WeakPolarHBondContact O-CG 3.48Å; K119-L123 PolarHBondContact O-N 3.03Å |
| 120 | L | 98.8 | Very high | 98.7 | Very high | 73 Ų | 73 | 98.7 Ų | 98.7 | 38% | 0.382 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -62.4 | -48.1 | 177.1 | -172.9 | 67.5 | 0 | 0 | 0 | 110.8 | C116 W117 Q118 E122 L123 E124 | C116-L120 PolarHBondContact O-N 3.43Å; W117-L120 HydrophobicContact CE3-CD2 3.91Å; W117-L120 HydrophobicContact CZ3-CD2 3.75Å; W117-L120 PolarHBondContact O-N 3.29Å; Q118-L120 VanDerWaalsContact C-N 3.29Å; Q118-L120 PolarHBondContact O-N 3.26Å; L120-E122 VanDerWaalsContact C-N 3.33Å; L120-E122 PolarHBondContact O-N 2.94Å; L120-L123 PolarHBondContact O-N 2.96Å; L120-L123 VanDerWaalsContact O-N 3.16Å; L120-E124 WeakPolarHBondContact O-CG 3.32Å; L120-E124 PolarHBondContact O-N 3.46Å |
| 121 | A | 98.7 | Very high | 98.6 | Very high | 56 Ų | 56 | 96.2 Ų | 96.2 | 46% | 0.463 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -61.5 | -39.4 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | W117 Q118 E124 G125 | W117-A121 PolarHBondContact O-N 3.39Å; Q118-A121 PolarHBondContact O-N 3.04Å; A121-E124 PolarHBondContact O-N 3.34Å; A121-G125 PolarHBondContact O-N 3.09Å |
| 122 | E | 98.7 | Very high | 98.6 | Very high | 89 Ų | 89 | 98.1 Ų | 98.1 | 42% | 0.416 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -62.3 | -41.9 | 174.2 | -72.8 | 174.3 | -163.9 | 0 | 0 | 112.3 | Q118 K119 L120 R126 | Q118-E122 WeakPolarHBondContact O-CG 3.35Å; Q118-E122 PolarHBondContact O-N 3.32Å; K119-E122 PolarHBondContact O-N 3.18Å; L120-E122 VanDerWaalsContact C-N 3.33Å; L120-E122 PolarHBondContact O-N 2.94Å; E122-R126 WeakPolarHBondContact O-CG 3.32Å; E122-R126 PolarHBondContact O-N 2.99Å; E122-R126 VanDerWaalsContact O-N 3.08Å |
| 123 | L | 98.8 | Very high | 98.6 | Very high | 102 Ų | 102 | 98.6 Ų | 98.6 | 53% | 0.534 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -69.1 | -40 | 177.9 | -71.2 | 173.6 | 0 | 0 | 0 | 112.1 | K119 L120 R126 Q127 | K119-L123 VanDerWaalsContact O-CG 3.32Å; K119-L123 WeakPolarHBondContact O-CG 3.48Å; K119-L123 PolarHBondContact O-N 3.03Å; L120-L123 PolarHBondContact O-N 2.96Å; L120-L123 VanDerWaalsContact O-N 3.16Å; L123-R126 PolarHBondContact O-N 3.08Å; L123-Q127 WeakPolarHBondContact O-CB 3.41Å; L123-Q127 PolarHBondContact O-N 3.29Å |
| 124 | E | 98.6 | Very high | 98.6 | Very high | 103 Ų | 103 | 97.7 Ų | 97.7 | 48% | 0.481 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -59.9 | -47.2 | 173.8 | -73.4 | 172.6 | 168.4 | 0 | 0 | 110.9 | L120 A121 R126 Q127 E128 | L120-E124 WeakPolarHBondContact O-CG 3.32Å; L120-E124 PolarHBondContact O-N 3.46Å; A121-E124 PolarHBondContact O-N 3.34Å; E124-R126 PolarHBondContact O-N 3.45Å; E124-Q127 WeakPolarHBondContact O-CB 3.37Å; E124-Q127 PolarHBondContact O-N 3.41Å; E124-Q127 VanDerWaalsContact O-N 3.17Å; E124-E128 PolarHBondContact O-N 3.16Å |
| 125 | G | 98.6 | Very high | 98.6 | Very high | 28 Ų | 28 | 100.5 Ų | 100.5 | 29% | 0.289 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -59.1 | -46.6 | 176.4 | 0 | 0 | 0 | 0 | 0 | 113 | A121 Q127 E128 E129 | A121-G125 PolarHBondContact O-N 3.09Å; G125-Q127 VanDerWaalsContact C-N 3.3Å; G125-Q127 PolarHBondContact O-N 2.89Å; G125-E128 PolarHBondContact O-N 3.4Å; G125-E129 PolarHBondContact O-N 3.49Å |
| 126 | R | 98.6 | Very high | 98.5 | Very high | 141 Ų | 141 | 101.4 Ų | 101.4 | 53% | 0.532 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -61.2 | -38.6 | 175.2 | -72.7 | 175.5 | -173.8 | 167.8 | 8.1 | 112.4 | E122 L123 E124 E128 E129 L130 | E122-R126 WeakPolarHBondContact O-CG 3.32Å; E122-R126 PolarHBondContact O-N 2.99Å; E122-R126 VanDerWaalsContact O-N 3.08Å; L123-R126 PolarHBondContact O-N 3.08Å; E124-R126 PolarHBondContact O-N 3.45Å; R126-E128 VanDerWaalsContact C-N 3.33Å; R126-E129 PolarHBondContact O-N 2.98Å; R126-L130 WeakPolarHBondContact O-CB 3.45Å; R126-L130 WeakPolarHBondContact O-CG 3.3Å; R126-L130 PolarHBondContact O-N 3.04Å |
| 127 | Q | 98.6 | Very high | 98.5 | Very high | 123 Ų | 123 | 102.6 Ų | 102.6 | 58% | 0.575 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -63.1 | -41.4 | 177 | -176.9 | 177.9 | -8.4 | 0 | 0 | 111.1 | L123 E124 G125 L130 L131 | L123-Q127 WeakPolarHBondContact O-CB 3.41Å; L123-Q127 PolarHBondContact O-N 3.29Å; E124-Q127 WeakPolarHBondContact O-CB 3.37Å; E124-Q127 PolarHBondContact O-N 3.41Å; E124-Q127 VanDerWaalsContact O-N 3.17Å; G125-Q127 VanDerWaalsContact C-N 3.3Å; G125-Q127 PolarHBondContact O-N 2.89Å; Q127-L130 PolarHBondContact O-N 3.2Å; Q127-L131 HydrophobicContact CG-CD1 4.46Å; Q127-L131 VanDerWaalsContact O-CG 3.3Å; Q127-L131 WeakPolarHBondContact O-CG 3.48Å; Q127-L131 PolarHBondContact O-N 2.92Å |
| 128 | E | 98.6 | Very high | 98.4 | Very high | 100 Ų | 100 | 100 Ų | 100 | 47% | 0.467 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -65.2 | -41.9 | 175.5 | -65.8 | -176 | -174.1 | 0 | 0 | 112.9 | E124 G125 R126 L131 R132 | E124-E128 PolarHBondContact O-N 3.16Å; G125-E128 PolarHBondContact O-N 3.4Å; R126-E128 VanDerWaalsContact C-N 3.33Å; E128-L131 PolarHBondContact O-N 2.86Å; E128-R132 WeakPolarHBondContact O-CG 3.48Å; E128-R132 PolarHBondContact O-N 2.98Å; E128-R132 IonicContact OE2-CZ 3.59Å; E128-R132 IonicContact OE2-NH1 3.48Å; E128-R132 IonicContact OE2-NH2 3.21Å; E128-R132 PolarHBondContact OE2-NH2 2.96Å |
| 129 | E | 98.6 | Very high | 98.3 | Very high | 114 Ų | 114 | 100.2 Ų | 100.2 | 53% | 0.533 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -58.5 | -49.9 | 175 | -72.9 | 171.5 | 175.6 | 0 | 0 | 111 | G125 R126 L131 R132 E133 | G125-E129 PolarHBondContact O-N 3.49Å; R126-E129 PolarHBondContact O-N 2.98Å; E129-L131 VanDerWaalsContact C-N 3.28Å; E129-L131 PolarHBondContact O-N 3.39Å; E129-R132 WeakPolarHBondContact O-CB 3.41Å; E129-R132 PolarHBondContact O-N 3.4Å; E129-R132 VanDerWaalsContact O-N 3.09Å; E129-E133 WeakPolarHBondContact O-CG 3.27Å; E129-E133 PolarHBondContact O-N 3.26Å |
| 130 | L | 98.6 | Very high | 98.1 | Very high | 109 Ų | 109 | 98.9 Ų | 98.9 | 57% | 0.571 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -59.2 | -38.2 | 176.2 | -72.9 | 172.3 | 0 | 0 | 0 | 112.3 | R126 Q127 N134 | R126-L130 WeakPolarHBondContact O-CB 3.45Å; R126-L130 WeakPolarHBondContact O-CG 3.3Å; R126-L130 PolarHBondContact O-N 3.04Å; Q127-L130 PolarHBondContact O-N 3.2Å; L130-N134 WeakPolarHBondContact O-CB 3.41Å; L130-N134 PolarHBondContact O-N 2.95Å |
| 131 | L | 98.4 | Very high | 97.9 | Very high | 99 Ų | 99 | 99.6 Ų | 99.6 | 52% | 0.518 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -65.1 | -42.5 | 175 | -75.2 | 173.2 | 0 | 0 | 0 | 111.8 | Q127 E128 E129 N134 L135 | Q127-L131 HydrophobicContact CG-CD1 4.46Å; Q127-L131 VanDerWaalsContact O-CG 3.3Å; Q127-L131 WeakPolarHBondContact O-CG 3.48Å; Q127-L131 PolarHBondContact O-N 2.92Å; E128-L131 PolarHBondContact O-N 2.86Å; E129-L131 VanDerWaalsContact C-N 3.28Å; E129-L131 PolarHBondContact O-N 3.39Å; L131-N134 PolarHBondContact O-N 3.32Å; L131-L135 VanDerWaalsContact O-CG 3.29Å; L131-L135 WeakPolarHBondContact O-CG 3.43Å; L131-L135 PolarHBondContact O-N 3.02Å |
| 132 | R | 98.6 | Very high | 97.6 | Very high | 147 Ų | 147 | 102.7 Ų | 102.7 | 56% | 0.555 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -62.8 | -47.6 | 176 | -70.8 | 179.9 | -167.5 | 96.7 | 5.8 | 111.4 | E128 E129 N134 L135 A136 | E128-R132 WeakPolarHBondContact O-CG 3.48Å; E128-R132 PolarHBondContact O-N 2.98Å; E128-R132 IonicContact OE2-CZ 3.59Å; E128-R132 IonicContact OE2-NH1 3.48Å; E128-R132 IonicContact OE2-NH2 3.21Å; E128-R132 PolarHBondContact OE2-NH2 2.96Å; E129-R132 WeakPolarHBondContact O-CB 3.41Å; E129-R132 PolarHBondContact O-N 3.4Å; E129-R132 VanDerWaalsContact O-N 3.09Å; R132-N134 VanDerWaalsContact C-N 3.32Å; R132-N134 PolarHBondContact O-N 3.17Å; R132-L135 PolarHBondContact O-N 3.41Å; R132-A136 PolarHBondContact O-N 2.88Å |
| 133 | E | 98.3 | Very high | 97.3 | Very high | 119 Ų | 119 | 100.8 Ų | 100.8 | 56% | 0.556 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -59.7 | -43.4 | 176 | -70.7 | 178.2 | 176.7 | 0 | 0 | 111.4 | E129 L135 A136 L137 | E129-E133 WeakPolarHBondContact O-CG 3.27Å; E129-E133 PolarHBondContact O-N 3.26Å; E133-L135 VanDerWaalsContact C-N 3.34Å; E133-L135 PolarHBondContact O-N 3.45Å; E133-A136 PolarHBondContact O-N 2.89Å; E133-L137 WeakPolarHBondContact O-CB 3.29Å; E133-L137 VanDerWaalsContact O-CG 3.27Å; E133-L137 WeakPolarHBondContact O-CG 3.47Å; E133-L137 PolarHBondContact O-N 3.09Å |
| 134 | N | 98 | Very high | 96.9 | Very high | 74 Ų | 74 | 100.7 Ų | 100.7 | 40% | 0.396 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -63.7 | -38.3 | 178.1 | -166 | -95.5 | 0 | 0 | 0 | 112.6 | L130 L131 R132 K138 | L130-N134 WeakPolarHBondContact O-CB 3.41Å; L130-N134 PolarHBondContact O-N 2.95Å; L131-N134 PolarHBondContact O-N 3.32Å; R132-N134 VanDerWaalsContact C-N 3.32Å; R132-N134 PolarHBondContact O-N 3.17Å; N134-K138 VanDerWaalsContact O-CG 3.31Å; N134-K138 WeakPolarHBondContact O-CG 3.2Å; N134-K138 PolarHBondContact O-N 2.89Å; N134-K138 WeakPolarHBondContact OD1-CE 3.09Å; N134-K138 PolarHBondContact OD1-NZ 2.96Å |
| 135 | L | 98.1 | Very high | 96.4 | Very high | 97 Ų | 97 | 98 Ų | 98 | 51% | 0.508 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -66.4 | -47.2 | 174.7 | -71.6 | 167.2 | 0 | 0 | 0 | 111.3 | L131 R132 E133 L137 K138 E139 | L131-L135 VanDerWaalsContact O-CG 3.29Å; L131-L135 WeakPolarHBondContact O-CG 3.43Å; L131-L135 PolarHBondContact O-N 3.02Å; R132-L135 PolarHBondContact O-N 3.41Å; E133-L135 VanDerWaalsContact C-N 3.34Å; E133-L135 PolarHBondContact O-N 3.45Å; L135-L137 VanDerWaalsContact C-N 3.3Å; L135-L137 PolarHBondContact O-N 3.34Å; L135-K138 WeakPolarHBondContact O-CB 3.41Å; L135-K138 PolarHBondContact O-N 2.98Å; L135-K138 VanDerWaalsContact O-N 3.1Å; L135-E139 WeakPolarHBondContact O-CG 3.45Å; L135-E139 PolarHBondContact O-N 3.27Å |
| 136 | A | 97.4 | Very high | 95.5 | Very high | 46 Ų | 46 | 104.1 Ų | 104.1 | 38% | 0.38 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -59.5 | -41.1 | 176 | 0 | 0 | 0 | 0 | 0 | 112 | R132 E133 E139 L140 | R132-A136 PolarHBondContact O-N 2.88Å; E133-A136 PolarHBondContact O-N 2.89Å; A136-E139 PolarHBondContact O-N 2.87Å; A136-L140 WeakPolarHBondContact O-CG 3.34Å; A136-L140 PolarHBondContact O-N 3.34Å |
| 137 | L | 97.8 | Very high | 94 | Very high | 102 Ų | 102 | 105.1 Ų | 105.1 | 53% | 0.534 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -63 | -41.6 | 174 | -73.8 | 172 | 0 | 0 | 0 | 112.1 | E133 L135 E139 L140 C141 | E133-L137 WeakPolarHBondContact O-CB 3.29Å; E133-L137 VanDerWaalsContact O-CG 3.27Å; E133-L137 WeakPolarHBondContact O-CG 3.47Å; E133-L137 PolarHBondContact O-N 3.09Å; L135-L137 VanDerWaalsContact C-N 3.3Å; L135-L137 PolarHBondContact O-N 3.34Å; L137-E139 VanDerWaalsContact C-N 3.35Å; L137-L140 PolarHBondContact O-N 3.1Å; L137-C141 WeakPolarHBondContact O-CB 3.37Å; L137-C141 PolarHBondContact O-N 3.44Å; L137-C141 PolarHBondContact O-SG 3.39Å |
| 138 | K | 96.9 | Very high | 92.2 | Very high | 116 Ų | 116 | 109.8 Ų | 109.8 | 50% | 0.504 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -61.3 | -43.3 | 175 | -77.9 | 166.1 | 173.8 | 157.8 | 0 | 111.6 | N134 L135 C141 L142 | N134-K138 VanDerWaalsContact O-CG 3.31Å; N134-K138 WeakPolarHBondContact O-CG 3.2Å; N134-K138 PolarHBondContact O-N 2.89Å; N134-K138 WeakPolarHBondContact OD1-CE 3.09Å; N134-K138 PolarHBondContact OD1-NZ 2.96Å; L135-K138 WeakPolarHBondContact O-CB 3.41Å; L135-K138 PolarHBondContact O-N 2.98Å; L135-K138 VanDerWaalsContact O-N 3.1Å; K138-C141 PolarHBondContact O-N 3.48Å; K138-L142 WeakPolarHBondContact O-CG 3.31Å; K138-L142 PolarHBondContact O-N 3.39Å |
| 139 | E | 96.3 | Very high | 90.2 | Very high | 131 Ų | 131 | 106.4 Ų | 106.4 | 61% | 0.612 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -62.6 | -44.5 | 176.6 | -70.5 | 172.7 | 178.7 | 0 | 0 | 111.9 | L135 A136 L137 C141 L142 A143 | L135-E139 WeakPolarHBondContact O-CG 3.45Å; L135-E139 PolarHBondContact O-N 3.27Å; A136-E139 PolarHBondContact O-N 2.87Å; L137-E139 VanDerWaalsContact C-N 3.35Å; E139-C141 PolarHBondContact O-N 3.29Å; E139-L142 PolarHBondContact O-N 2.95Å; E139-A143 PolarHBondContact O-N 2.94Å |
| 140 | L | 95.3 | Very high | 88.1 | Confident | 108 Ų | 108 | 107.4 Ų | 107.4 | 57% | 0.565 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -60.2 | -44.2 | 174.5 | -72.9 | 171.7 | 0 | 0 | 0 | 112 | A136 L137 L142 A143 L144 | A136-L140 WeakPolarHBondContact O-CG 3.34Å; A136-L140 PolarHBondContact O-N 3.34Å; L137-L140 PolarHBondContact O-N 3.1Å; L140-L142 VanDerWaalsContact C-N 3.31Å; L140-L142 PolarHBondContact O-N 2.98Å; L140-A143 PolarHBondContact O-N 2.8Å; L140-L144 WeakPolarHBondContact O-CB 3.32Å; L140-L144 WeakPolarHBondContact O-CG 3.44Å; L140-L144 PolarHBondContact O-N 3.37Å |
| 141 | C | 94.1 | Very high | 86.1 | Confident | 88 Ų | 88 | 114 Ų | 114 | 60% | 0.595 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -61.8 | -38.7 | 175.9 | -73.1 | 0 | 0 | 0 | 0 | 112.3 | L137 K138 E139 G145 | L137-C141 WeakPolarHBondContact O-CB 3.37Å; L137-C141 PolarHBondContact O-N 3.44Å; L137-C141 PolarHBondContact O-SG 3.39Å; K138-C141 PolarHBondContact O-N 3.48Å; E139-C141 PolarHBondContact O-N 3.29Å; C141-G145 PolarHBondContact O-N 3.21Å |
| 142 | L | 93.5 | Very high | 83.5 | Confident | 120 Ų | 120 | 112.9 Ų | 112.9 | 63% | 0.628 | 59% | 0.594 | S | S | * | * | H | α-helix | trans | -65.4 | -48.5 | 175.2 | -72.3 | 171.1 | 0 | 0 | 0 | 111.3 | K138 E139 L140 L144 G145 E146 | K138-L142 WeakPolarHBondContact O-CG 3.31Å; K138-L142 PolarHBondContact O-N 3.39Å; E139-L142 PolarHBondContact O-N 2.95Å; L140-L142 VanDerWaalsContact C-N 3.31Å; L140-L142 PolarHBondContact O-N 2.98Å; L142-L144 PolarHBondContact O-N 3.37Å; L142-G145 CarbonylContact O-C 3.56Å; L142-G145 WeakPolarHBondContact O-CA 3.45Å; L142-G145 PolarHBondContact O-N 3.47Å; L142-E146 WeakPolarHBondContact O-CG 3.44Å; L142-E146 PolarHBondContact O-N 3.35Å |
| 143 | A | 91.1 | Very high | 80.7 | Confident | 50 Ų | 50 | 109.1 Ų | 109.1 | 41% | 0.413 | 60% | 0.6 | S | S | . | * | H | α-helix | trans | -60.4 | -42.8 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | E139 L140 G145 E146 E147 | E139-A143 PolarHBondContact O-N 2.94Å; L140-A143 PolarHBondContact O-N 2.8Å; A143-G145 VanDerWaalsContact C-N 3.35Å; A143-E146 PolarHBondContact O-N 3.04Å; A143-E147 PolarHBondContact O-N 3.27Å |
| 144 | L | 91.5 | Very high | 78.4 | Confident | 100 Ų | 100 | 110.3 Ų | 110.3 | 52% | 0.524 | 62% | 0.618 | S | S | . | * | H | α-helix | trans | -64.2 | -39.3 | 172.8 | -70.4 | 172.1 | 0 | 0 | 0 | 111.7 | L140 L142 E146 E147 W148 | L140-L144 WeakPolarHBondContact O-CB 3.32Å; L140-L144 WeakPolarHBondContact O-CG 3.44Å; L140-L144 PolarHBondContact O-N 3.37Å; L142-L144 PolarHBondContact O-N 3.37Å; L144-E146 VanDerWaalsContact C-N 3.29Å; L144-E146 PolarHBondContact O-N 2.92Å; L144-E147 PolarHBondContact O-N 3.45Å; L144-W148 WeakPolarHBondContact O-CB 3.4Å; L144-W148 PolarHBondContact O-N 2.94Å |
| 145 | G | 87.3 | Confident | 75.9 | Confident | 45 Ų | 45 | 110.5 Ų | 110.5 | 46% | 0.464 | 64% | 0.638 | S | S | . | * | H | α-helix | trans | -63 | -32.6 | 174.3 | 0 | 0 | 0 | 0 | 0 | 113.5 | C141 L142 A143 G149 | C141-G145 PolarHBondContact O-N 3.21Å; L142-G145 CarbonylContact O-C 3.56Å; L142-G145 WeakPolarHBondContact O-CA 3.45Å; L142-G145 PolarHBondContact O-N 3.47Å; A143-G145 VanDerWaalsContact C-N 3.35Å; G145-G149 WeakPolarHBondContact O-CA 3.37Å; G145-G149 PolarHBondContact O-N 2.96Å |
| 146 | E | 79.4 | Confident | 73.1 | Confident | 158 Ų | 158 | 109.7 Ų | 109.7 | 74% | 0.738 | 65% | 0.652 | S | S | * | * | H | α-helix | trans | -73.6 | -41.1 | 175.1 | -71.1 | 177.2 | 171.2 | 0 | 0 | 112.2 | L142 A143 L144 W148 G149 | L142-E146 WeakPolarHBondContact O-CG 3.44Å; L142-E146 PolarHBondContact O-N 3.35Å; A143-E146 PolarHBondContact O-N 3.04Å; L144-E146 VanDerWaalsContact C-N 3.29Å; L144-E146 PolarHBondContact O-N 2.92Å; E146-W148 VanDerWaalsContact C-N 3.3Å; E146-W148 PolarHBondContact O-N 2.92Å; E146-G149 PolarHBondContact O-N 3.06Å |
| 147 | E | 68.4 | Low | 70.9 | Confident | 162 Ų | 162 | 112.9 Ų | 112.9 | 76% | 0.757 | 68% | 0.679 | S | S | * | * | H | α-helix | trans | -69.2 | -26.9 | 175.8 | -73.2 | -155.3 | 161.1 | 0 | 0 | 113.4 | A143 L144 | A143-E147 PolarHBondContact O-N 3.27Å; L144-E147 PolarHBondContact O-N 3.45Å |
| 148 | W | 59.5 | Low | 68.4 | Low | 220 Ų | 220 | 112 Ų | 112 | 83% | 0.833 | 70% | 0.695 | S | S | * | * | S | Bend | trans | -103.4 | 0.7 | 178.8 | -63.4 | 61.2 | 0 | 0 | 0 | 112.6 | L144 E146 | L144-W148 WeakPolarHBondContact O-CB 3.4Å; L144-W148 PolarHBondContact O-N 2.94Å; E146-W148 VanDerWaalsContact C-N 3.3Å; E146-W148 PolarHBondContact O-N 2.92Å |
| 149 | G | 57.5 | Low | 65.8 | Low | 30 Ų | 30 | 110.2 Ų | 110.2 | 31% | 0.309 | 71% | 0.709 | S | S | . | * | S | Bend | trans | -72.2 | 156 | 169.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | G145 E146 R151 | G145-G149 WeakPolarHBondContact O-CA 3.37Å; G145-G149 PolarHBondContact O-N 2.96Å; E146-G149 PolarHBondContact O-N 3.06Å; G149-R151 PolarHBondContact O-N 3.02Å |
| 150 | P | 54.3 | Low | 63.7 | Low | 135 Ų | 135 | 110.5 Ų | 110.5 | 88% | 0.877 | 73% | 0.725 | S | S | * | * | trans | -64 | 98.4 | -139.9 | 27.7 | -34.9 | 0 | 0 | 0 | 113.3 | G152 | P150-G152 PolarHBondContact O-N 3.39Š| ||
| 151 | R | 55.5 | Low | 61.3 | Low | 247 Ų | 247 | 108.7 Ų | 108.7 | 93% | 0.932 | 73% | 0.733 | S | S | * | * | trans | -70.3 | 80.3 | 157.6 | -167 | 171.3 | 165.9 | -156.4 | -3.9 | 108.6 | G149 | G149-R151 PolarHBondContact O-N 3.02Š| ||
| 152 | G | 45.7 | Very low | 58.8 | Low | 76 Ų | 76 | 109.6 Ų | 109.6 | 78% | 0.784 | 75% | 0.747 | S | S | * | * | S | Bend | trans | 59.8 | 106.7 | 153.9 | 0 | 0 | 0 | 0 | 0 | 118.8 | P150 | P150-G152 PolarHBondContact O-N 3.39Š|
| 153 | G | 39.2 | Very low | 56.3 | Low | 67 Ų | 67 | 107.3 Ų | 107.3 | 69% | 0.691 | 75% | 0.752 | S | S | * | * | trans | -179.9 | 112.5 | 152.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | G155 | G153-G155 PolarHBondContact O-N 3.42Š| ||
| 154 | P | 49.5 | Very low | 54.2 | Low | 145 Ų | 145 | 111 Ų | 111 | 94% | 0.942 | 77% | 0.772 | S | S | * | * | trans | -79.2 | 103.2 | 171.1 | 31.9 | -26.8 | 0 | 0 | 0 | 107.6 | ||||
| 155 | G | 44.8 | Very low | 52.3 | Low | 78 Ų | 78 | 110.6 Ų | 110.6 | 80% | 0.804 | 78% | 0.783 | S | S | * | * | trans | 176.8 | 121.1 | 175.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | G153 | G153-G155 PolarHBondContact O-N 3.42Š| ||
| 156 | G | 40.8 | Very low | 50.7 | Low | 79 Ų | 79 | 114 Ų | 114 | 81% | 0.814 | 80% | 0.798 | S | S | * | * | trans | 111.4 | 75.6 | 156.2 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 157 | A | 50.5 | Low | 49 | Very low | 113 Ų | 113 | 114.9 Ų | 114.9 | 93% | 0.934 | 80% | 0.801 | S | S | * | * | trans | -56.9 | 147.7 | 145.9 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 158 | G | 46.3 | Very low | 48.3 | Very low | 85 Ų | 85 | 116 Ų | 116 | 88% | 0.876 | 81% | 0.812 | S | S | * | * | trans | 128.8 | 98.2 | 160.2 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 159 | G | 41.8 | Very low | 47.8 | Very low | 78 Ų | 78 | 108.7 Ų | 108.7 | 80% | 0.804 | 80% | 0.798 | S | S | * | * | trans | -172.8 | 37.5 | 174.7 | 0 | 0 | 0 | 0 | 0 | 114 | G161 | G159-G161 PolarHBondContact O-N 3.42Š| ||
| 160 | S | 51.3 | Low | 47.9 | Very low | 136 Ų | 136 | 115.1 Ų | 115.1 | 95% | 0.951 | 83% | 0.825 | S | S | * | * | trans | -69.7 | 111.8 | 160.9 | -58.6 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 161 | G | 45.8 | Very low | 48.1 | Very low | 70 Ų | 70 | 114.2 Ų | 114.2 | 72% | 0.722 | 82% | 0.818 | S | S | * | * | trans | -175.1 | 114 | 177.1 | 0 | 0 | 0 | 0 | 0 | 114.1 | G159 | G159-G161 PolarHBondContact O-N 3.42Š| ||
| 162 | A | 40.5 | Very low | 48 | Very low | 107 Ų | 107 | 108.2 Ų | 108.2 | 88% | 0.884 | 81% | 0.811 | S | S | * | * | trans | 82.7 | 110.3 | 161.4 | 0 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 163 | G | 42.4 | Very low | 48.6 | Very low | 72 Ų | 72 | 111 Ų | 111 | 74% | 0.742 | 82% | 0.818 | S | S | * | * | trans | -68.5 | -171.2 | 156.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 164 | P | 47.1 | Very low | 49.4 | Very low | 127 Ų | 127 | 110.5 Ų | 110.5 | 83% | 0.825 | 81% | 0.812 | S | S | * | * | cis | -131.4 | 165.2 | 32.4 | 40.1 | -23.2 | 0 | 0 | 0 | 114.3 | ||||
| 165 | A | 51.4 | Low | 49.8 | Very low | 93 Ų | 93 | 109.8 Ų | 109.8 | 77% | 0.769 | 81% | 0.808 | S | S | * | * | trans | -79.2 | 151.4 | 148.2 | 0 | 0 | 0 | 0 | 0 | 107.2 | ||||
| 166 | P | 51.9 | Low | 50.7 | Low | 117 Ų | 117 | 117.5 Ų | 117.5 | 76% | 0.76 | 81% | 0.812 | S | S | * | * | cis | -142 | 169 | 35.1 | 37.8 | -17.7 | 0 | 0 | 0 | 114.5 | ||||
| 167 | E | 45.3 | Very low | 51.8 | Low | 175 Ų | 175 | 120.6 Ų | 120.6 | 82% | 0.818 | 81% | 0.811 | S | S | * | * | trans | 179.2 | 69.8 | 138.7 | -97.4 | -162.1 | 160.8 | 0 | 0 | 110.4 | A169 | E167-A169 HydrophobicContact CG-CB 4.23Å; E167-A169 PolarHBondContact O-N 3.45Å | ||
| 168 | L | 53.8 | Low | 52.3 | Low | 187 Ų | 187 | 122.9 Ų | 122.9 | 98% | 0.979 | 81% | 0.806 | S | S | * | * | trans | -87.9 | 72 | 142.1 | -75.1 | 170.2 | 0 | 0 | 0 | 106.4 | ||||
| 169 | A | 48.2 | Very low | 52.9 | Low | 66 Ų | 66 | 121.7 Ų | 121.7 | 55% | 0.545 | 79% | 0.794 | S | S | . | * | trans | -113.6 | 87.1 | 171.5 | 0 | 0 | 0 | 0 | 0 | 107.6 | E167 | E167-A169 HydrophobicContact CG-CB 4.23Å; E167-A169 PolarHBondContact O-N 3.45Å | ||
| 170 | L | 59.5 | Low | 54.2 | Low | 165 Ų | 165 | 125.3 Ų | 125.3 | 86% | 0.864 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -52.2 | 127.2 | 155.2 | -72.3 | 159.3 | 0 | 0 | 0 | 107.1 | ||
| 171 | P | 59.4 | Low | 54.1 | Low | 115 Ų | 115 | 122.5 Ų | 122.5 | 75% | 0.747 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -61.9 | 136.1 | 172.5 | -1.2 | 8.4 | 0 | 0 | 0 | 108.8 | C173 | P171-C173 PolarHBondContact O-N 3.4Š|
| 172 | P | 53.3 | Low | 54.5 | Low | 121 Ų | 121 | 124.3 Ų | 124.3 | 79% | 0.786 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -63.4 | 134.5 | 176.3 | 21.6 | -24.5 | 0 | 0 | 0 | 109 | G174 | P172-G174 PolarHBondContact O-N 2.9Š|
| 173 | C | 56.8 | Low | 55.4 | Low | 135 Ų | 135 | 124.7 Ų | 124.7 | 91% | 0.912 | 79% | 0.785 | S | S | * | * | trans | -46 | 104.2 | 167.4 | -62.5 | 0 | 0 | 0 | 0 | 109.4 | P171 | P171-C173 PolarHBondContact O-N 3.4Š| ||
| 174 | G | 56.5 | Low | 55.8 | Low | 56 Ų | 56 | 126.9 Ų | 126.9 | 58% | 0.577 | 79% | 0.789 | S | S | * | * | trans | -65.4 | 157.5 | 170 | 0 | 0 | 0 | 0 | 0 | 110.6 | P172 R176 | P172-G174 PolarHBondContact O-N 2.9Å; G174-R176 PolarHBondContact O-N 2.86Å | ||
| 175 | P | 57.4 | Low | 56.1 | Low | 131 Ų | 131 | 127.6 Ų | 127.6 | 85% | 0.851 | 79% | 0.791 | S | S | * | * | trans | -62.4 | 129.9 | -175.8 | 26.7 | -31.6 | 0 | 0 | 0 | 109.6 | D177 | P175-D177 PolarHBondContact O-N 2.9Š| ||
| 176 | R | 65.2 | Low | 55.7 | Low | 239 Ų | 239 | 126.4 Ų | 126.4 | 90% | 0.902 | 79% | 0.788 | S | S | * | * | trans | -56.3 | 102 | 169 | -76 | 173 | 154.4 | -169.4 | -6.7 | 108.8 | G174 | G174-R176 PolarHBondContact O-N 2.86Š| ||
| 177 | D | 63.8 | Low | 55.7 | Low | 145 Ų | 145 | 126.8 Ų | 126.8 | 78% | 0.775 | 79% | 0.794 | S | S | * | * | trans | -93.6 | 99.1 | 159.4 | -172.1 | 17.2 | 0 | 0 | 0 | 107.5 | P175 | P175-D177 PolarHBondContact O-N 2.9Š| ||
| 178 | L | 60.6 | Low | 56 | Low | 160 Ų | 160 | 125.1 Ų | 125.1 | 84% | 0.838 | 80% | 0.795 | S | S | * | * | trans | -121.4 | 89.2 | 164.3 | -69.5 | 179.7 | 0 | 0 | 0 | 106 | ||||
| 179 | G | 59.6 | Low | 55.5 | Low | 60 Ų | 60 | 119.6 Ų | 119.6 | 62% | 0.619 | 78% | 0.784 | S | S | * | * | trans | -49.9 | 145 | 175.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | G181 | G179-G181 VanDerWaalsContact C-N 3.26Å; G179-G181 PolarHBondContact O-N 2.86Å | ||
| 180 | D | 68.6 | Low | 55.5 | Low | 154 Ų | 154 | 121.9 Ų | 121.9 | 82% | 0.824 | 80% | 0.795 | S | S | * | * | trans | -75.4 | 73.4 | 168.6 | 58.8 | -16.9 | 0 | 0 | 0 | 110.3 | S182 | D180-S182 PolarHBondContact O-N 3.32Š| ||
| 181 | G | 49.8 | Very low | 55.3 | Low | 77 Ų | 77 | 119.9 Ų | 119.9 | 79% | 0.794 | 79% | 0.792 | S | S | * | * | trans | -74.3 | 72.1 | 173.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | G179 | G179-G181 VanDerWaalsContact C-N 3.26Å; G179-G181 PolarHBondContact O-N 2.86Å | ||
| 182 | S | 53.5 | Low | 54.9 | Low | 108 Ų | 108 | 122 Ų | 122 | 76% | 0.755 | 80% | 0.797 | S | S | * | * | trans | -69 | 128.4 | 163.2 | -68.7 | 0 | 0 | 0 | 0 | 109.6 | D180 | D180-S182 PolarHBondContact O-N 3.32Š| ||
| 183 | S | 59.3 | Low | 54.7 | Low | 115 Ų | 115 | 124.6 Ų | 124.6 | 80% | 0.804 | 80% | 0.799 | S | S | * | * | trans | -140.1 | 106.3 | 165.5 | -77.8 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 184 | S | 50.9 | Low | 54.3 | Low | 119 Ų | 119 | 125.5 Ų | 125.5 | 83% | 0.832 | 79% | 0.794 | S | S | * | * | trans | -68.7 | 125.6 | 166.2 | -49.7 | 0 | 0 | 0 | 0 | 110 | ||||
| 185 | T | 53.8 | Low | 53.9 | Low | 141 Ų | 141 | 128.8 Ų | 128.8 | 87% | 0.865 | 81% | 0.805 | S | S | * | * | trans | -137.9 | 134.8 | 156.8 | 62.2 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 186 | G | 43 | Very low | 53.5 | Low | 69 Ų | 69 | 130.8 Ų | 130.8 | 71% | 0.711 | 81% | 0.808 | S | S | * | * | trans | 107.5 | 58.4 | 161.1 | 0 | 0 | 0 | 0 | 0 | 117.5 | V188 | G186-V188 PolarHBondContact O-N 3.22Š| ||
| 187 | S | 50.9 | Low | 52.4 | Low | 125 Ų | 125 | 123.8 Ų | 123.8 | 87% | 0.874 | 80% | 0.801 | S | S | * | * | trans | -61.7 | 119.1 | 154.7 | -177.6 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 188 | V | 52.3 | Low | 51.2 | Low | 140 Ų | 140 | 122.8 Ų | 122.8 | 85% | 0.848 | 80% | 0.804 | S | S | * | * | trans | -125.3 | 114.7 | 164.5 | -71.8 | 0 | 0 | 0 | 0 | 109.7 | G186 | G186-V188 PolarHBondContact O-N 3.22Š| ||
| 189 | G | 42.1 | Very low | 50.8 | Low | 71 Ų | 71 | 120.6 Ų | 120.6 | 73% | 0.732 | 80% | 0.802 | S | S | * | * | trans | 88.4 | 83.9 | 149.1 | 0 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 190 | S | 48.5 | Very low | 50.8 | Low | 113 Ų | 113 | 122.9 Ų | 122.9 | 79% | 0.79 | 81% | 0.806 | S | S | * | * | trans | -70.4 | 139.1 | 144.5 | -75.3 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 191 | P | 56.9 | Low | 50 | Low | 123 Ų | 123 | 122.5 Ų | 122.5 | 80% | 0.799 | 80% | 0.804 | S | S | * | * | trans | -95.8 | 114.5 | 147.6 | 28 | -15.6 | 0 | 0 | 0 | 108.7 | ||||
| 192 | D | 51.1 | Low | 49.8 | Very low | 160 Ų | 160 | 130.4 Ų | 130.4 | 86% | 0.856 | 83% | 0.828 | S | S | * | * | trans | -59.3 | 145.9 | 170 | -92.3 | -41 | 0 | 0 | 0 | 111.8 | ||||
| 193 | Q | 47.6 | Very low | 49.7 | Very low | 176 Ų | 176 | 131.6 Ų | 131.6 | 82% | 0.822 | 83% | 0.832 | S | S | * | * | trans | -79.1 | 124.9 | 169.5 | -68.3 | 177.2 | 43.7 | 0 | 0 | 110.4 | ||||
| 194 | L | 48.3 | Very low | 49.2 | Very low | 153 Ų | 153 | 132.4 Ų | 132.4 | 80% | 0.801 | 83% | 0.833 | S | S | * | * | trans | 60.5 | 140.5 | 144.3 | -50.9 | 179 | 0 | 0 | 0 | 119.8 | ||||
| 195 | P | 48.3 | Very low | 49.1 | Very low | 125 Ų | 125 | 133.2 Ų | 133.2 | 81% | 0.812 | 83% | 0.833 | S | S | * | * | -135.3 | 149.7 | 105.7 | 33.5 | -20.3 | 0 | 0 | 0 | 114.6 | |||||
| 196 | L | 49.4 | Very low | 48.8 | Very low | 174 Ų | 174 | 132.7 Ų | 132.7 | 91% | 0.911 | 83% | 0.831 | S | S | * | * | trans | -43.4 | 136.8 | 160.3 | -79.3 | 128 | 0 | 0 | 0 | 112.9 | ||||
| 197 | A | 41.3 | Very low | 49.1 | Very low | 92 Ų | 92 | 136.7 Ų | 136.7 | 76% | 0.76 | 84% | 0.839 | S | S | * | * | trans | -158.3 | 114.2 | 139.8 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 198 | C | 38.9 | Very low | 49 | Very low | 124 Ų | 124 | 137.5 Ų | 137.5 | 84% | 0.838 | 84% | 0.837 | S | S | * | * | trans | 51.2 | 113.2 | 137.4 | -61.8 | 0 | 0 | 0 | 0 | 121.1 | ||||
| 199 | S | 52 | Low | 48.8 | Very low | 114 Ų | 114 | 137.3 Ų | 137.3 | 80% | 0.797 | 84% | 0.836 | S | S | * | * | trans | -55.7 | 157.8 | 138.1 | -39.9 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 200 | P | 60.2 | Low | 49.3 | Very low | 108 Ų | 108 | 142.4 Ų | 142.4 | 70% | 0.701 | 84% | 0.844 | S | S | * | * | -147.3 | 169 | 77.9 | 39.2 | -20.5 | 0 | 0 | 0 | 116.9 | |||||
| 201 | D | 52.8 | Low | 49.4 | Very low | 145 Ų | 145 | 144.8 Ų | 144.8 | 78% | 0.775 | 85% | 0.848 | S | S | * | * | trans | 60.3 | 107.2 | 155 | -59.6 | -46.4 | 0 | 0 | 0 | 121.5 | ||||
| 202 | D | 45.7 | Very low | 48.7 | Very low | 244 Ų | 244 | 146.8 Ų | 146.8 | 100% | 1.305 | 85% | 0.853 | S | S | * | * | -169.1 | 0 | 103.8 | -105.5 | -52.7 | 0 | 0 | 0 | 110.1 |
Retrieved 202 of 202 residues in 609.3 ms
(Link to these results)