| 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 | 39.3 | Very low | 58 | Low | 226 Ų | 226 | 111.9 Ų | 111.9 | 100% | 1.113 | 65% | 0.649 | S | S | * | * | 0 | 107.7 | 0 | -176 | 169.4 | 127 | 0 | 0 | 108.1 | I3 | M1-I3 PolarHBondContact O-N 2.86Š| |||
| 2 | V | 46.4 | Very low | 59 | Low | 118 Ų | 118 | 106.7 Ų | 106.7 | 72% | 0.715 | 64% | 0.637 | S | S | * | * | trans | -81.7 | 111.4 | 171.7 | 178.1 | 0 | 0 | 0 | 0 | 105.7 | T4 Q5 | V2-T4 PolarHBondContact O-N 3.44Å; V2-T4 VanDerWaalsContact O-N 3.12Å; V2-Q5 HydrophobicContact CG1-CG 4.5Å | ||
| 3 | I | 54 | Low | 60.5 | Low | 145 Ų | 145 | 111.5 Ų | 111.5 | 74% | 0.744 | 65% | 0.648 | S | S | * | * | trans | -55.4 | 122.6 | 169.8 | -61 | 175.3 | 0 | 0 | 0 | 105.9 | M1 Q5 | M1-I3 PolarHBondContact O-N 2.86Å; I3-Q5 PolarHBondContact O-N 3.43Å | ||
| 4 | T | 53.7 | Low | 62.2 | Low | 131 Ų | 131 | 113.4 Ų | 113.4 | 80% | 0.804 | 65% | 0.654 | S | S | * | * | trans | -42.1 | 125.1 | -168.8 | 37.1 | 0 | 0 | 0 | 0 | 111.6 | V2 A6 | V2-T4 PolarHBondContact O-N 3.44Å; V2-T4 VanDerWaalsContact O-N 3.12Å; T4-A6 PolarHBondContact O-N 2.77Å | ||
| 5 | Q | 59.1 | Low | 63.8 | Low | 124 Ų | 124 | 115.7 Ų | 115.7 | 58% | 0.579 | 65% | 0.647 | S | S | * | * | P | Polyproline II helix | trans | -64 | 130.5 | 174.8 | -63.6 | -159.3 | -1.7 | 0 | 0 | 108.4 | V2 I3 | V2-Q5 HydrophobicContact CG1-CG 4.5Å; I3-Q5 PolarHBondContact O-N 3.43Å |
| 6 | A | 62.8 | Low | 65.5 | Low | 54 Ų | 54 | 112.9 Ų | 112.9 | 45% | 0.446 | 63% | 0.629 | S | S | . | * | P | Polyproline II helix | trans | -51.9 | 145.1 | 172.5 | 0 | 0 | 0 | 0 | 0 | 110.1 | T4 A8 | T4-A6 PolarHBondContact O-N 2.77Å; A6-A8 PolarHBondContact O-N 3.37Å |
| 7 | P | 68.4 | Low | 67 | Low | 89 Ų | 89 | 118.8 Ų | 118.8 | 58% | 0.578 | 64% | 0.64 | S | S | * | * | P | Polyproline II helix | trans | -47.2 | 137.2 | 179.5 | -26.5 | 31.8 | 0 | 0 | 0 | 111.7 | G9 I10 R11 | P7-G9 PolarHBondContact O-N 2.79Å; P7-I10 HydrophobicContact CB-CD1 4.38Å; P7-I10 HydrophobicContact CG-CD1 4.14Å; P7-I10 PolarHBondContact O-N 3.09Å; P7-R11 PolarHBondContact O-N 3.36Å; P7-R11 VanDerWaalsContact O-N 3.12Å |
| 8 | A | 62.3 | Low | 68.5 | Low | 90 Ų | 90 | 115.7 Ų | 115.7 | 74% | 0.744 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -52.7 | -35.7 | -170.8 | 0 | 0 | 0 | 0 | 0 | 113.7 | A6 R11 G12 | A6-A8 PolarHBondContact O-N 3.37Å; A8-R11 PolarHBondContact O-N 2.76Å; A8-G12 PolarHBondContact O-N 3.28Å; A8-G12 VanDerWaalsContact O-N 3.13Å |
| 9 | G | 62.9 | Low | 69.8 | Low | 51 Ų | 51 | 114.3 Ų | 114.3 | 53% | 0.526 | 62% | 0.62 | S | S | . | * | H | α-helix | trans | -62.8 | -42.9 | 175.7 | 0 | 0 | 0 | 0 | 0 | 113.6 | P7 H13 | P7-G9 PolarHBondContact O-N 2.79Å; G9-H13 PolarHBondContact O-ND1 3.1Å |
| 10 | I | 64.3 | Low | 71 | Confident | 91 Ų | 91 | 111.3 Ų | 111.3 | 47% | 0.467 | 60% | 0.604 | S | S | . | * | H | α-helix | trans | -71.1 | -38.8 | 178.8 | -63.7 | 172.8 | 0 | 0 | 0 | 110.3 | P7 G12 H13 L14 | P7-I10 HydrophobicContact CB-CD1 4.38Å; P7-I10 HydrophobicContact CG-CD1 4.14Å; P7-I10 PolarHBondContact O-N 3.09Å; I10-G12 VanDerWaalsContact C-N 3.31Å; I10-G12 PolarHBondContact O-N 3.4Å; I10-H13 PolarHBondContact O-N 3.42Å; I10-L14 HydrophobicContact CG2-CD1 3.75Å; I10-L14 HydrophobicContact CG2-CG 4.42Å; I10-L14 PolarHBondContact O-N 3.42Å; I10-L14 VanDerWaalsContact O-N 3.08Å |
| 11 | R | 64.2 | Low | 72.2 | Confident | 112 Ų | 112 | 107.9 Ų | 107.9 | 42% | 0.423 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -62.4 | -36.7 | 178.8 | -164.6 | -179.7 | -174.5 | -172.2 | 6.8 | 112.2 | P7 A8 H13 R15 | P7-R11 PolarHBondContact O-N 3.36Å; P7-R11 VanDerWaalsContact O-N 3.12Å; A8-R11 PolarHBondContact O-N 2.76Å; R11-H13 VanDerWaalsContact C-N 3.33Å; R11-H13 PolarHBondContact O-N 2.87Å; R11-R15 WeakPolarHBondContact O-CB 3.35Å; R11-R15 PolarHBondContact O-N 2.97Å; R11-R15 VanDerWaalsContact O-N 3.16Å |
| 12 | G | 70 | Confident | 74.8 | Confident | 49 Ų | 49 | 100.7 Ų | 100.7 | 51% | 0.505 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -63.5 | -36.1 | 177.5 | 0 | 0 | 0 | 0 | 0 | 113.7 | A8 I10 | A8-G12 PolarHBondContact O-N 3.28Å; A8-G12 VanDerWaalsContact O-N 3.13Å; I10-G12 VanDerWaalsContact C-N 3.31Å; I10-G12 PolarHBondContact O-N 3.4Å |
| 13 | H | 78.9 | Confident | 77.2 | Confident | 170 Ų | 170 | 96.1 Ų | 96.1 | 79% | 0.787 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -88.1 | -33.9 | -174.8 | -66.1 | 86.6 | 0 | 0 | 0 | 113.5 | G9 I10 R11 | G9-H13 PolarHBondContact O-ND1 3.1Å; I10-H13 PolarHBondContact O-N 3.42Å; R11-H13 VanDerWaalsContact C-N 3.33Å; R11-H13 PolarHBondContact O-N 2.87Å |
| 14 | L | 84.7 | Confident | 79.2 | Confident | 138 Ų | 138 | 90.2 Ų | 90.2 | 72% | 0.723 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -101 | -9.5 | -175.6 | -62.5 | 179.6 | 0 | 0 | 0 | 114.4 | I10 I16 | I10-L14 HydrophobicContact CG2-CD1 3.75Å; I10-L14 HydrophobicContact CG2-CG 4.42Å; I10-L14 PolarHBondContact O-N 3.42Å; I10-L14 VanDerWaalsContact O-N 3.08Å; L14-I16 PolarHBondContact O-N 3.44Å; L14-I16 VanDerWaalsContact O-N 3.15Å |
| 15 | R | 86.5 | Confident | 81.3 | Confident | 148 Ų | 148 | 88.9 Ų | 88.9 | 56% | 0.558 | 48% | 0.48 | S | S | * | . | trans | -69.2 | 115.6 | -177.7 | 173.9 | 178 | 151.4 | 122.2 | -3.9 | 111.1 | R11 R17 | R11-R15 WeakPolarHBondContact O-CB 3.35Å; R11-R15 PolarHBondContact O-N 2.97Å; R11-R15 VanDerWaalsContact O-N 3.16Å; R15-R17 PolarHBondContact O-N 3.47Å; R15-R17 VanDerWaalsContact O-N 3.17Å | ||
| 16 | I | 90.3 | Very high | 83 | Confident | 70 Ų | 70 | 83.5 Ų | 83.5 | 36% | 0.359 | 46% | 0.457 | S | S | . | . | trans | -63 | 115.5 | 170.2 | -59.6 | 174.6 | 0 | 0 | 0 | 109.6 | L14 A21 R22 L25 | L14-I16 PolarHBondContact O-N 3.44Å; L14-I16 VanDerWaalsContact O-N 3.15Å; I16-A21 HydrophobicContact CG2-CB 3.51Å; I16-R22 HydrophobicContact CB-CG 3.92Å; I16-R22 HydrophobicContact CG2-CG 3.85Å; I16-R22 WeakPolarHBondContact O-CD 3.48Å; I16-R22 PolarHBondContact O-NH1 3.28Å; I16-L25 HydrophobicContact CD1-CD2 4.05Å | ||
| 17 | R | 90.9 | Very high | 84.7 | Confident | 213 Ų | 213 | 80.9 Ų | 80.9 | 80% | 0.804 | 44% | 0.436 | S | S | * | . | trans | -82 | -33.8 | -178.7 | -62.3 | -177.5 | -175.9 | 179.6 | 0.8 | 113 | R15 L19 R22 | R15-R17 PolarHBondContact O-N 3.47Å; R15-R17 VanDerWaalsContact O-N 3.17Å; R17-L19 PolarHBondContact O-N 3.38Å; R17-R22 PolarHBondContact O-NH1 3Å | ||
| 18 | S | 94.5 | Very high | 86.2 | Confident | 64 Ų | 64 | 79.7 Ų | 79.7 | 45% | 0.448 | 42% | 0.422 | S | S | . | . | trans | -63.9 | 125.3 | 176.8 | 170.9 | 0 | 0 | 0 | 0 | 110.9 | L20 A21 R22 | S18-L20 PolarHBondContact OG-N 3.08Å; S18-A21 PolarHBondContact OG-N 3.13Å; S18-R22 WeakPolarHBondContact O-CG 3.43Å; S18-R22 PolarHBondContact O-N 3.17Å | ||
| 19 | L | 93.2 | Very high | 87.9 | Confident | 89 Ų | 89 | 79.7 Ų | 79.7 | 47% | 0.466 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -61.9 | -46.7 | 174.8 | 176 | 62 | 0 | 0 | 0 | 110.9 | R17 A21 R22 Q23 | R17-L19 PolarHBondContact O-N 3.38Å; L19-A21 VanDerWaalsContact C-N 3.33Å; L19-A21 PolarHBondContact O-N 3.44Å; L19-R22 PolarHBondContact O-N 3.25Å; L19-Q23 HydrophobicContact CD1-CG 4.2Å; L19-Q23 HydrophobicContact CG-CG 4.35Å; L19-Q23 VanDerWaalsContact O-CG 3.31Å; L19-Q23 WeakPolarHBondContact O-CG 3.41Å; L19-Q23 PolarHBondContact O-N 3.47Å |
| 20 | L | 94.2 | Very high | 89.6 | Confident | 54 Ų | 54 | 77.2 Ų | 77.2 | 28% | 0.283 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -59.1 | -44.6 | -179.5 | 179.1 | 61.3 | 0 | 0 | 0 | 111.5 | S18 R22 Q23 C24 K99 I102 Y103 | S18-L20 PolarHBondContact OG-N 3.08Å; L20-R22 VanDerWaalsContact C-N 3.32Å; L20-R22 PolarHBondContact O-N 3.16Å; L20-Q23 WeakPolarHBondContact O-CB 3.24Å; L20-Q23 PolarHBondContact O-N 3.38Å; L20-Q23 VanDerWaalsContact O-N 3.13Å; L20-C24 PolarHBondContact O-N 2.92Å; L20-C24 PolarHBondContact O-SG 3.41Å; L20-K99 HydrophobicContact CD1-CD 4.16Å; L20-K99 HydrophobicContact CD1-CG 4.25Å; L20-I102 HydrophobicContact CD1-CG2 4.39Å; L20-I102 HydrophobicContact CD2-CD1 3.81Å; L20-Y103 HydrophobicContact CD1-CE2 4.39Å |
| 21 | A | 95.3 | Very high | 91.2 | Very high | 40 Ų | 40 | 73 Ų | 73 | 33% | 0.331 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -62.8 | -38.4 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | I16 S18 L19 C24 L25 | I16-A21 HydrophobicContact CG2-CB 3.51Å; S18-A21 PolarHBondContact OG-N 3.13Å; L19-A21 VanDerWaalsContact C-N 3.33Å; L19-A21 PolarHBondContact O-N 3.44Å; A21-C24 PolarHBondContact O-N 3.04Å; A21-L25 PolarHBondContact O-N 2.98Å |
| 22 | R | 94.8 | Very high | 92.9 | Very high | 74 Ų | 74 | 70.3 Ų | 70.3 | 28% | 0.279 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -64.9 | -40.5 | 173.2 | -68.7 | -167.9 | -57.9 | -87.8 | -1.6 | 112.2 | I16 R17 S18 L19 L20 L25 A26 V76 | I16-R22 HydrophobicContact CB-CG 3.92Å; I16-R22 HydrophobicContact CG2-CG 3.85Å; I16-R22 WeakPolarHBondContact O-CD 3.48Å; I16-R22 PolarHBondContact O-NH1 3.28Å; R17-R22 PolarHBondContact O-NH1 3Å; S18-R22 WeakPolarHBondContact O-CG 3.43Å; S18-R22 PolarHBondContact O-N 3.17Å; L19-R22 PolarHBondContact O-N 3.25Å; L20-R22 VanDerWaalsContact C-N 3.32Å; L20-R22 PolarHBondContact O-N 3.16Å; R22-L25 PolarHBondContact O-N 3.27Å; R22-A26 PolarHBondContact O-N 3.12Å; R22-V76 HydrophobicContact CB-CG1 3.8Å; R22-V76 WeakPolarHBondContact O-CG1 2.96Å |
| 23 | Q | 95.8 | Very high | 94.2 | Very high | 23 Ų | 23 | 69.5 Ų | 69.5 | 11% | 0.107 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -62.7 | -47.3 | 176.5 | -68.8 | 177.4 | -44.2 | 0 | 0 | 111 | L19 L20 L25 A26 E27 Y103 | L19-Q23 HydrophobicContact CD1-CG 4.2Å; L19-Q23 HydrophobicContact CG-CG 4.35Å; L19-Q23 VanDerWaalsContact O-CG 3.31Å; L19-Q23 WeakPolarHBondContact O-CG 3.41Å; L19-Q23 PolarHBondContact O-N 3.47Å; L20-Q23 WeakPolarHBondContact O-CB 3.24Å; L20-Q23 PolarHBondContact O-N 3.38Å; L20-Q23 VanDerWaalsContact O-N 3.13Å; Q23-L25 VanDerWaalsContact C-N 3.34Å; Q23-L25 PolarHBondContact O-N 3.39Å; Q23-A26 PolarHBondContact O-N 3.46Å; Q23-E27 WeakPolarHBondContact O-CG 3.49Å; Q23-E27 PolarHBondContact O-N 3.18Å; Q23-Y103 HydrophobicContact CB-CE2 4.24Å; Q23-Y103 WeakPolarHBondContact CB-OH 3.32Å; Q23-Y103 PolarHBondContact NE2-OH 2.83Å |
| 24 | C | 97.1 | Very high | 95.2 | Very high | 21 Ų | 21 | 62 Ų | 62 | 14% | 0.142 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -59 | -43.4 | 175.6 | -65.6 | 0 | 0 | 0 | 0 | 111.9 | L20 A21 A26 E27 F28 V106 | L20-C24 PolarHBondContact O-N 2.92Å; L20-C24 PolarHBondContact O-SG 3.41Å; A21-C24 PolarHBondContact O-N 3.04Å; C24-A26 VanDerWaalsContact C-N 3.32Å; C24-A26 PolarHBondContact O-N 3.25Å; C24-E27 PolarHBondContact O-N 2.65Å; C24-F28 WeakPolarHBondContact O-CB 3.31Å; C24-F28 PolarHBondContact O-N 2.97Å; C24-V106 HydrophobicContact CB-CG1 4.35Å; C24-V106 HydrophobicContact CB-CG2 3.99Å; C24-V106 VanDerWaalsContact O-CG1 3.25Å; C24-V106 WeakPolarHBondContact O-CG1 3.3Å |
| 25 | L | 96.4 | Very high | 95.8 | Very high | 102 Ų | 102 | 55.4 Ų | 55.4 | 53% | 0.534 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -64.4 | -37.9 | 178.3 | -174.5 | 61.2 | 0 | 0 | 0 | 112.2 | I16 A21 R22 Q23 F28 L29 | I16-L25 HydrophobicContact CD1-CD2 4.05Å; A21-L25 PolarHBondContact O-N 2.98Å; R22-L25 PolarHBondContact O-N 3.27Å; Q23-L25 VanDerWaalsContact C-N 3.34Å; Q23-L25 PolarHBondContact O-N 3.39Å; L25-F28 PolarHBondContact O-N 2.82Å; L25-L29 WeakPolarHBondContact O-CB 3.19Å; L25-L29 PolarHBondContact O-N 3.15Å |
| 26 | A | 96.2 | Very high | 96.4 | Very high | 11 Ų | 11 | 50.7 Ų | 50.7 | 9% | 0.091 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -68.6 | -41.9 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | R22 Q23 C24 F28 L29 G30 V76 | R22-A26 PolarHBondContact O-N 3.12Å; Q23-A26 PolarHBondContact O-N 3.46Å; C24-A26 VanDerWaalsContact C-N 3.32Å; C24-A26 PolarHBondContact O-N 3.25Å; A26-F28 VanDerWaalsContact C-N 3.35Å; A26-L29 PolarHBondContact O-N 3.07Å; A26-G30 PolarHBondContact O-N 2.95Å; A26-V76 HydrophobicContact CB-CB 3.8Å; A26-V76 HydrophobicContact CB-CG1 3.98Å |
| 27 | E | 98.4 | Very high | 96.8 | Very high | 0 Ų | 0 | 50.9 Ų | 50.9 | 0% | 0 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -60.9 | -44.7 | 172.2 | -71.8 | -60 | 120.5 | 0 | 0 | 111.4 | Q23 C24 V31 S77 H80 L81 Y103 V106 Q107 | Q23-E27 WeakPolarHBondContact O-CG 3.49Å; Q23-E27 PolarHBondContact O-N 3.18Å; C24-E27 PolarHBondContact O-N 2.65Å; E27-V31 WeakPolarHBondContact O-CB 3.37Å; E27-V31 VanDerWaalsContact O-CG2 3.32Å; E27-V31 WeakPolarHBondContact O-CG2 3.41Å; E27-V31 PolarHBondContact O-N 3.1Å; E27-S77 VanDerWaalsContact OE1-CB 3.23Å; E27-S77 WeakPolarHBondContact OE1-CB 3.4Å; E27-S77 PolarHBondContact OE1-OG 2.8Å; E27-H80 PolarHBondContact OE1-N 2.82Å; E27-L81 WeakPolarHBondContact OE2-CA 3.48Å; E27-L81 PolarHBondContact OE2-N 3.48Å; E27-Y103 HydrophobicContact CG-CD1 3.73Å; E27-Y103 HydrophobicContact CG-CE1 3.75Å; E27-Y103 HydrophobicContact CG-CG 4.43Å; E27-V106 HydrophobicContact CB-CG1 4.07Å; E27-Q107 HydrophobicContact CB-CG 4.48Å; E27-Q107 PolarHBondContact OE2-NE2 3.12Å |
| 28 | F | 98.6 | Very high | 97.2 | Very high | 63 Ų | 63 | 41.5 Ų | 41.5 | 28% | 0.276 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -60.9 | -49.6 | 178 | -169.8 | -80.9 | 0 | 0 | 0 | 111.1 | C24 L25 A26 F32 V106 L109 S110 C113 | C24-F28 WeakPolarHBondContact O-CB 3.31Å; C24-F28 PolarHBondContact O-N 2.97Å; L25-F28 PolarHBondContact O-N 2.82Å; A26-F28 VanDerWaalsContact C-N 3.35Å; F28-F32 HydrophobicContact CE1-CD2 4.39Å; F28-F32 VanDerWaalsContact O-CB 3.25Å; F28-F32 WeakPolarHBondContact O-CB 3.48Å; F28-F32 PolarHBondContact O-N 3.34Å; F28-V106 HydrophobicContact CB-CG1 3.84Å; F28-V106 HydrophobicContact CD2-CG1 4.34Å; F28-L109 HydrophobicContact CE2-CD2 4.15Å; F28-L109 HydrophobicContact CE2-CG 4.01Å; F28-S110 WeakPolarHBondContact O-CB 3.46Å; F28-S110 PolarHBondContact O-OG 3.37Å; F28-C113 HydrophobicContact CZ-CB 4.12Å |
| 29 | L | 98.3 | Very high | 97.4 | Very high | 90 Ų | 90 | 38.4 Ų | 38.4 | 47% | 0.471 | 20% | 0.201 | S | C | . | . | H | α-helix | trans | -67.4 | -42.7 | -178.1 | -177.3 | 61.9 | 0 | 0 | 0 | 112 | L25 A26 F32 V33 V72 | L25-L29 WeakPolarHBondContact O-CB 3.19Å; L25-L29 PolarHBondContact O-N 3.15Å; A26-L29 PolarHBondContact O-N 3.07Å; L29-F32 PolarHBondContact O-N 3.25Å; L29-V33 HydrophobicContact CD1-CG2 4.42Å; L29-V33 WeakPolarHBondContact O-CG2 3.36Å; L29-V33 PolarHBondContact O-N 2.96Å; L29-V72 HydrophobicContact CB-CG1 4.42Å; L29-V72 HydrophobicContact CD2-CG1 3.71Å; L29-V72 HydrophobicContact CG-CG1 3.69Å |
| 30 | G | 98.3 | Very high | 97.7 | Very high | 0 Ų | 0 | 34.6 Ų | 34.6 | 0% | 0 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -62.9 | -47.2 | 179 | 0 | 0 | 0 | 0 | 0 | 112 | A26 F32 V33 L34 A69 | A26-G30 PolarHBondContact O-N 2.95Å; G30-F32 VanDerWaalsContact C-N 3.29Å; G30-F32 PolarHBondContact O-N 3.15Å; G30-V33 PolarHBondContact O-N 2.87Å; G30-L34 WeakPolarHBondContact O-CB 3.37Å; G30-L34 PolarHBondContact O-N 2.86Å; G30-A69 VanDerWaalsContact O-CB 3.3Å; G30-A69 WeakPolarHBondContact O-CB 3.42Å |
| 31 | V | 98.8 | Very high | 97.9 | Very high | 1 Ų | 1 | 32.8 Ų | 32.8 | 1% | 0.006 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -64.6 | -36.5 | 176.1 | 174.8 | 0 | 0 | 0 | 0 | 111 | E27 V33 L34 M35 L81 Q107 S110 A111 | E27-V31 WeakPolarHBondContact O-CB 3.37Å; E27-V31 VanDerWaalsContact O-CG2 3.32Å; E27-V31 WeakPolarHBondContact O-CG2 3.41Å; E27-V31 PolarHBondContact O-N 3.1Å; V31-V33 PolarHBondContact O-N 3.23Å; V31-L34 PolarHBondContact O-N 3.18Å; V31-M35 HydrophobicContact CG1-CG 3.91Å; V31-M35 WeakPolarHBondContact O-CB 3.41Å; V31-M35 VanDerWaalsContact O-CG 3.23Å; V31-M35 WeakPolarHBondContact O-CG 3.4Å; V31-M35 PolarHBondContact O-N 3.13Å; V31-L81 HydrophobicContact CG2-CB 3.95Å; V31-L81 HydrophobicContact CG2-CD2 4.1Å; V31-Q107 WeakPolarHBondContact CG1-O 3.37Å; V31-Q107 HydrophobicContact CG2-CB 4.12Å; V31-Q107 HydrophobicContact CG2-CG 3.91Å; V31-S110 WeakPolarHBondContact CB-OG 3.4Å; V31-A111 HydrophobicContact CG1-CB 3.87Å |
| 32 | F | 98.8 | Very high | 98.1 | Very high | 56 Ų | 56 | 31.7 Ų | 31.7 | 25% | 0.246 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -62.8 | -46.8 | 179.4 | -173.3 | -84.5 | 0 | 0 | 0 | 110.9 | F28 L29 G30 M35 L36 S110 C113 A114 A117 | F28-F32 HydrophobicContact CE1-CD2 4.39Å; F28-F32 VanDerWaalsContact O-CB 3.25Å; F28-F32 WeakPolarHBondContact O-CB 3.48Å; F28-F32 PolarHBondContact O-N 3.34Å; L29-F32 PolarHBondContact O-N 3.25Å; G30-F32 VanDerWaalsContact C-N 3.29Å; G30-F32 PolarHBondContact O-N 3.15Å; F32-M35 PolarHBondContact O-N 3.4Å; F32-L36 HydrophobicContact CE1-CD2 4.06Å; F32-L36 VanDerWaalsContact O-CB 3.26Å; F32-L36 WeakPolarHBondContact O-CB 3.29Å; F32-L36 PolarHBondContact O-N 3.49Å; F32-S110 WeakPolarHBondContact CA-OG 3.4Å; F32-S110 WeakPolarHBondContact CB-OG 3.26Å; F32-S110 PolarHBondContact N-OG 3.28Å; F32-C113 HydrophobicContact CD2-CB 4.38Å; F32-C113 HydrophobicContact CE2-CB 4.31Å; F32-A114 HydrophobicContact CD2-CB 3.76Å; F32-A114 HydrophobicContact CE2-CB 4.09Å; F32-A114 HydrophobicContact CG-CB 4.15Å; F32-A117 HydrophobicContact CE2-CB 4.2Å; F32-A117 HydrophobicContact CZ-CB 3.72Å |
| 33 | V | 98.7 | Very high | 98.3 | Very high | 32 Ų | 32 | 28.2 Ų | 28.2 | 19% | 0.194 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -63.6 | -45.5 | 176.3 | 171.6 | 0 | 0 | 0 | 0 | 111.4 | L29 G30 V31 M35 L37 I68 | L29-V33 HydrophobicContact CD1-CG2 4.42Å; L29-V33 WeakPolarHBondContact O-CG2 3.36Å; L29-V33 PolarHBondContact O-N 2.96Å; G30-V33 PolarHBondContact O-N 2.87Å; V31-V33 PolarHBondContact O-N 3.23Å; V33-M35 VanDerWaalsContact C-N 3.33Å; V33-M35 PolarHBondContact O-N 3.01Å; V33-L37 HydrophobicContact CG1-CD1 3.95Å; V33-L37 WeakPolarHBondContact O-CG 3.49Å; V33-L37 PolarHBondContact O-N 3.25Å; V33-I68 HydrophobicContact CG1-CG2 3.88Å |
| 34 | L | 98.7 | Very high | 98.4 | Very high | 12 Ų | 12 | 31.5 Ų | 31.5 | 6% | 0.063 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -53.9 | -51.7 | 176.1 | 170 | 59.9 | 0 | 0 | 0 | 110.9 | G30 V31 T38 A65 V66 A69 L81 | G30-L34 WeakPolarHBondContact O-CB 3.37Å; G30-L34 PolarHBondContact O-N 2.86Å; V31-L34 PolarHBondContact O-N 3.18Å; L34-T38 VanDerWaalsContact O-CB 3.24Å; L34-T38 WeakPolarHBondContact O-CB 3.35Å; L34-T38 PolarHBondContact O-N 3.05Å; L34-T38 PolarHBondContact O-OG1 3.38Å; L34-A65 HydrophobicContact CD1-CB 3.99Å; L34-V66 HydrophobicContact CD1-CB 4.34Å; L34-V66 HydrophobicContact CD1-CG2 3.5Å; L34-A69 HydrophobicContact CB-CB 3.74Å; L34-L81 HydrophobicContact CD2-CB 4.5Å |
| 35 | M | 98.9 | Very high | 98.5 | Very high | 1 Ų | 1 | 30.6 Ų | 30.6 | 1% | 0.005 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -72.9 | -41.5 | -173.5 | -68.1 | -52.3 | -54.6 | 0 | 0 | 112.5 | V31 F32 V33 L37 T38 Q39 A111 A114 R217 P221 | V31-M35 HydrophobicContact CG1-CG 3.91Å; V31-M35 WeakPolarHBondContact O-CB 3.41Å; V31-M35 VanDerWaalsContact O-CG 3.23Å; V31-M35 WeakPolarHBondContact O-CG 3.4Å; V31-M35 PolarHBondContact O-N 3.13Å; F32-M35 PolarHBondContact O-N 3.4Å; V33-M35 VanDerWaalsContact C-N 3.33Å; V33-M35 PolarHBondContact O-N 3.01Å; M35-L37 VanDerWaalsContact C-N 3.34Å; M35-L37 PolarHBondContact O-N 3.42Å; M35-T38 PolarHBondContact O-N 3.08Å; M35-Q39 HydrophobicContact CE-CG 3.86Å; M35-Q39 VanDerWaalsContact O-CB 3.29Å; M35-Q39 WeakPolarHBondContact O-CB 3.38Å; M35-Q39 WeakPolarHBondContact O-CG 3.38Å; M35-Q39 PolarHBondContact O-N 3.33Å; M35-Q39 PolarHBondContact O-OE1 3.27Å; M35-A111 HydrophobicContact CG-CB 3.8Å; M35-A111 HydrophobicContact SD-CB 4.48Å; M35-A114 HydrophobicContact CB-CB 3.52Å; M35-R217 HydrophobicContact CE-CB 4.37Å; M35-R217 HydrophobicContact CE-CG 3.89Å; M35-R217 WeakPolarHBondContact CE-O 3.47Å; M35-R217 HydrophobicContact SD-CB 3.68Å; M35-R217 HydrophobicContact SD-CG 3.47Å; M35-R217 WeakPolarHBondContact SD-CG 3.42Å; M35-P221 HydrophobicContact CE-CG 3.52Å |
| 36 | L | 98.9 | Very high | 98.6 | Very high | 49 Ų | 49 | 26.9 Ų | 26.9 | 26% | 0.257 | 14% | 0.143 | S | C | . | . | H | α-helix | trans | -59.9 | -45.2 | 178.8 | -175.6 | 65.9 | 0 | 0 | 0 | 111.6 | F32 G40 A117 | F32-L36 HydrophobicContact CE1-CD2 4.06Å; F32-L36 VanDerWaalsContact O-CB 3.26Å; F32-L36 WeakPolarHBondContact O-CB 3.29Å; F32-L36 PolarHBondContact O-N 3.49Å; L36-G40 WeakPolarHBondContact O-CA 3.43Å; L36-G40 PolarHBondContact O-N 3.42Å; L36-A117 HydrophobicContact CD1-CB 4.11Å |
| 37 | L | 98.9 | Very high | 98.7 | Very high | 74 Ų | 74 | 27.3 Ų | 27.3 | 39% | 0.387 | 15% | 0.145 | S | C | . | . | H | α-helix | trans | -70.7 | -41.5 | 178.6 | -66.1 | 176.2 | 0 | 0 | 0 | 112 | V33 M35 A41 A65 I68 | V33-L37 HydrophobicContact CG1-CD1 3.95Å; V33-L37 WeakPolarHBondContact O-CG 3.49Å; V33-L37 PolarHBondContact O-N 3.25Å; M35-L37 VanDerWaalsContact C-N 3.34Å; M35-L37 PolarHBondContact O-N 3.42Å; L37-A41 PolarHBondContact O-N 3.14Å; L37-A41 VanDerWaalsContact O-N 3.14Å; L37-A65 HydrophobicContact CB-CB 3.53Å; L37-A65 HydrophobicContact CD1-CB 4.12Å; L37-A65 HydrophobicContact CG-CB 4.47Å; L37-I68 HydrophobicContact CD1-CB 4.47Å; L37-I68 HydrophobicContact CD1-CD1 3.9Å |
| 38 | T | 98.8 | Very high | 98.8 | Very high | 15 Ų | 15 | 28.7 Ų | 28.7 | 9% | 0.092 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -64.1 | -52.2 | 179.5 | -59.6 | 0 | 0 | 0 | 0 | 111.1 | L34 M35 A41 V42 | L34-T38 VanDerWaalsContact O-CB 3.24Å; L34-T38 WeakPolarHBondContact O-CB 3.35Å; L34-T38 PolarHBondContact O-N 3.05Å; L34-T38 PolarHBondContact O-OG1 3.38Å; M35-T38 PolarHBondContact O-N 3.08Å; T38-A41 PolarHBondContact O-N 2.94Å; T38-V42 WeakPolarHBondContact O-CG2 3.26Å; T38-V42 PolarHBondContact O-N 3.39Å |
| 39 | Q | 98.9 | Very high | 98.7 | Very high | 0 Ų | 0 | 28.1 Ų | 28.1 | 0% | 0 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -71.5 | -36.8 | -178.3 | -61.3 | 169.6 | -27.7 | 0 | 0 | 111.5 | M35 A41 V42 A43 S115 T118 I145 F146 P221 | M35-Q39 HydrophobicContact CE-CG 3.86Å; M35-Q39 VanDerWaalsContact O-CB 3.29Å; M35-Q39 WeakPolarHBondContact O-CB 3.38Å; M35-Q39 WeakPolarHBondContact O-CG 3.38Å; M35-Q39 PolarHBondContact O-N 3.33Å; M35-Q39 PolarHBondContact O-OE1 3.27Å; Q39-A41 VanDerWaalsContact C-N 3.3Å; Q39-A41 PolarHBondContact O-N 3.09Å; Q39-V42 PolarHBondContact O-N 3.46Å; Q39-V42 VanDerWaalsContact O-N 3.15Å; Q39-A43 WeakPolarHBondContact O-CB 3.49Å; Q39-A43 PolarHBondContact O-N 3.06Å; Q39-S115 PolarHBondContact NE2-OG 3.03Å; Q39-T118 HydrophobicContact CB-CG2 3.79Å; Q39-T118 PolarHBondContact OE1-OG1 3.06Å; Q39-I145 WeakPolarHBondContact CG-O 3.13Å; Q39-F146 PolarHBondContact NE2-O 3.32Å; Q39-P221 VanDerWaalsContact NE2-CG 3.26Å |
| 40 | G | 98.9 | Very high | 98.7 | Very high | 9 Ų | 9 | 29.7 Ų | 29.7 | 9% | 0.093 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -59.2 | -40 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | L36 V42 A43 Q44 Y122 | L36-G40 WeakPolarHBondContact O-CA 3.43Å; L36-G40 PolarHBondContact O-N 3.42Å; G40-V42 PolarHBondContact O-N 3.26Å; G40-A43 PolarHBondContact O-N 2.95Å; G40-Q44 VanDerWaalsContact O-CB 3.29Å; G40-Q44 WeakPolarHBondContact O-CB 3.4Å; G40-Q44 PolarHBondContact O-N 3.46Å; G40-Y122 PolarHBondContact O-OH 2.93Å; G40-Y122 VanDerWaalsContact O-OH 3.08Å |
| 41 | A | 98.9 | Very high | 98.7 | Very high | 15 Ų | 15 | 34.9 Ų | 34.9 | 12% | 0.124 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -64.8 | -38.8 | 175 | 0 | 0 | 0 | 0 | 0 | 112.9 | L37 T38 Q39 A45 A61 | L37-A41 PolarHBondContact O-N 3.14Å; L37-A41 VanDerWaalsContact O-N 3.14Å; T38-A41 PolarHBondContact O-N 2.94Å; Q39-A41 VanDerWaalsContact C-N 3.3Å; Q39-A41 PolarHBondContact O-N 3.09Å; A41-A45 PolarHBondContact O-N 2.89Å; A41-A45 VanDerWaalsContact O-N 3.09Å; A41-A61 HydrophobicContact CB-CB 3.34Å |
| 42 | V | 98.9 | Very high | 98.7 | Very high | 18 Ų | 18 | 41.8 Ų | 41.8 | 11% | 0.109 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -69 | -45.4 | 175.4 | -174.4 | 0 | 0 | 0 | 0 | 110.7 | T38 Q39 G40 Q44 A45 V46 M58 I145 | T38-V42 WeakPolarHBondContact O-CG2 3.26Å; T38-V42 PolarHBondContact O-N 3.39Å; Q39-V42 PolarHBondContact O-N 3.46Å; Q39-V42 VanDerWaalsContact O-N 3.15Å; G40-V42 PolarHBondContact O-N 3.26Å; V42-Q44 VanDerWaalsContact C-N 3.31Å; V42-Q44 PolarHBondContact O-N 3.02Å; V42-A45 PolarHBondContact O-N 3.22Å; V42-V46 HydrophobicContact CG1-CG2 4.05Å; V42-V46 WeakPolarHBondContact O-CB 3.42Å; V42-V46 WeakPolarHBondContact O-CG2 3.25Å; V42-V46 PolarHBondContact O-N 3.06Å; V42-M58 HydrophobicContact CB-SD 3.99Å; V42-M58 HydrophobicContact CG1-SD 3.75Å; V42-M58 HydrophobicContact CG2-CB 4.43Å; V42-M58 HydrophobicContact CG2-CG 4.19Å; V42-M58 HydrophobicContact CG2-SD 3.85Å; V42-I145 HydrophobicContact CG1-CB 4.36Å; V42-I145 HydrophobicContact CG1-CG1 4.11Å |
| 43 | A | 98.9 | Very high | 98.7 | Very high | 1 Ų | 1 | 39.4 Ų | 39.4 | 1% | 0.008 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -56.3 | -46.8 | 174.8 | 0 | 0 | 0 | 0 | 0 | 110.8 | Q39 G40 A45 V46 T47 T118 Y122 I145 | Q39-A43 WeakPolarHBondContact O-CB 3.49Å; Q39-A43 PolarHBondContact O-N 3.06Å; G40-A43 PolarHBondContact O-N 2.95Å; A43-A45 PolarHBondContact O-N 3.44Å; A43-V46 PolarHBondContact O-N 3.43Å; A43-T47 WeakPolarHBondContact O-CB 3.29Å; A43-T47 WeakPolarHBondContact O-CG2 3.42Å; A43-T47 PolarHBondContact O-N 3.38Å; A43-T47 PolarHBondContact O-OG1 2.77Å; A43-T118 HydrophobicContact CB-CG2 4.41Å; A43-Y122 HydrophobicContact CB-CD1 3.61Å; A43-Y122 HydrophobicContact CB-CD2 3.73Å; A43-Y122 HydrophobicContact CB-CE1 3.79Å; A43-Y122 HydrophobicContact CB-CE2 3.9Å; A43-Y122 HydrophobicContact CB-CG 3.59Å; A43-I145 HydrophobicContact CB-CD1 4.33Å; A43-I145 HydrophobicContact CB-CG2 3.71Å |
| 44 | Q | 98.9 | Very high | 98.7 | Very high | 92 Ų | 92 | 40.9 Ų | 40.9 | 43% | 0.43 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -58 | -44.6 | 176.8 | -174.6 | 169.4 | -63.7 | 0 | 0 | 112.6 | G40 V42 S48 K52 Y122 | G40-Q44 VanDerWaalsContact O-CB 3.29Å; G40-Q44 WeakPolarHBondContact O-CB 3.4Å; G40-Q44 PolarHBondContact O-N 3.46Å; V42-Q44 VanDerWaalsContact C-N 3.31Å; V42-Q44 PolarHBondContact O-N 3.02Å; Q44-S48 WeakPolarHBondContact O-CB 3.34Å; Q44-S48 PolarHBondContact O-N 3.33Å; Q44-S48 PolarHBondContact O-OG 3Å; Q44-K52 HydrophobicContact CG-CB 3.89Å; Q44-K52 PolarHBondContact NE2-O 2.84Å; Q44-Y122 HydrophobicContact CB-CE1 4.24Å |
| 45 | A | 98.8 | Very high | 98.6 | Very high | 1 Ų | 1 | 46.3 Ų | 46.3 | 1% | 0.008 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -65.1 | -52.4 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.3 | A41 V42 A43 S48 E50 M58 | A41-A45 PolarHBondContact O-N 2.89Å; A41-A45 VanDerWaalsContact O-N 3.09Å; V42-A45 PolarHBondContact O-N 3.22Å; A43-A45 PolarHBondContact O-N 3.44Å; A45-S48 PolarHBondContact O-OG 2.96Å; A45-E50 WeakPolarHBondContact O-CA 3.39Å; A45-E50 PolarHBondContact O-N 3.45Å; A45-M58 HydrophobicContact CB-CE 4.18Å; A45-M58 HydrophobicContact CB-CG 3.93Å; A45-M58 HydrophobicContact CB-SD 3.81Å |
| 46 | V | 98.8 | Very high | 98.5 | Very high | 25 Ų | 25 | 50.6 Ų | 50.6 | 15% | 0.152 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -64.5 | -56.2 | -175.2 | 173.5 | 0 | 0 | 0 | 0 | 111.7 | V42 A43 S48 G49 Y129 T142 I145 | V42-V46 HydrophobicContact CG1-CG2 4.05Å; V42-V46 WeakPolarHBondContact O-CB 3.42Å; V42-V46 WeakPolarHBondContact O-CG2 3.25Å; V42-V46 PolarHBondContact O-N 3.06Å; A43-V46 PolarHBondContact O-N 3.43Å; V46-S48 PolarHBondContact O-N 3.33Å; V46-G49 PolarHBondContact O-N 3.12Å; V46-G49 VanDerWaalsContact O-N 3.07Å; V46-Y129 HydrophobicContact CG1-CD1 4.39Å; V46-Y129 HydrophobicContact CG1-CE1 3.85Å; V46-Y129 WeakPolarHBondContact O-CE2 3.11Å; V46-T142 HydrophobicContact CG1-CG2 4.19Å; V46-I145 HydrophobicContact CB-CD1 4.11Å; V46-I145 HydrophobicContact CB-CG1 4.14Å; V46-I145 HydrophobicContact CG1-CD1 4.04Å; V46-I145 HydrophobicContact CG1-CG1 4.35Å; V46-I145 HydrophobicContact CG2-CG1 4.1Å |
| 47 | T | 98.8 | Very high | 98.5 | Very high | 20 Ų | 20 | 50.8 Ų | 50.8 | 12% | 0.123 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -71.4 | -16.4 | -172.8 | 66.2 | 0 | 0 | 0 | 0 | 113.1 | A43 A125 L126 I145 | A43-T47 WeakPolarHBondContact O-CB 3.29Å; A43-T47 WeakPolarHBondContact O-CG2 3.42Å; A43-T47 PolarHBondContact O-N 3.38Å; A43-T47 PolarHBondContact O-OG1 2.77Å; T47-A125 HydrophobicContact CG2-CB 4.2Å; T47-L126 HydrophobicContact CG2-CD2 3.98Å; T47-L126 HydrophobicContact CG2-CG 4.21Å; T47-I145 HydrophobicContact CG2-CD1 4.4Å |
| 48 | S | 98.6 | Very high | 98.5 | Very high | 29 Ų | 29 | 49.2 Ų | 49.2 | 20% | 0.203 | 27% | 0.267 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -89.5 | 0.8 | 174.5 | 72.7 | 0 | 0 | 0 | 0 | 114.1 | Q44 A45 V46 E50 T51 K52 | Q44-S48 WeakPolarHBondContact O-CB 3.34Å; Q44-S48 PolarHBondContact O-N 3.33Å; Q44-S48 PolarHBondContact O-OG 3Å; A45-S48 PolarHBondContact O-OG 2.96Å; V46-S48 PolarHBondContact O-N 3.33Å; S48-E50 VanDerWaalsContact C-N 3.25Å; S48-E50 PolarHBondContact O-N 2.94Å; S48-T51 PolarHBondContact O-N 3Å; S48-T51 PolarHBondContact O-OG1 3.47Å; S48-T51 PolarHBondContact OG-N 2.93Å; S48-K52 PolarHBondContact OG-N 3.41Å |
| 49 | G | 98 | Very high | 98.5 | Very high | 50 Ų | 50 | 50.2 Ų | 50.2 | 52% | 0.515 | 27% | 0.27 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 59.2 | 40.8 | -171.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | V46 T51 | V46-G49 PolarHBondContact O-N 3.12Å; V46-G49 VanDerWaalsContact O-N 3.07Å; G49-T51 PolarHBondContact O-N 3.47Å; G49-T51 VanDerWaalsContact O-N 3.17Å |
| 50 | E | 98.2 | Very high | 98.5 | Very high | 124 Ų | 124 | 53.1 Ų | 53.1 | 58% | 0.579 | 29% | 0.286 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 62.4 | 12.1 | -177.2 | -57.4 | -165.7 | 100.8 | 0 | 0 | 117 | A45 S48 G53 | A45-E50 WeakPolarHBondContact O-CA 3.39Å; A45-E50 PolarHBondContact O-N 3.45Å; S48-E50 VanDerWaalsContact C-N 3.25Å; S48-E50 PolarHBondContact O-N 2.94Å; E50-G53 CarbonylContact C-O 3.29Å; E50-G53 VanDerWaalsContact C-O 3.29Å; E50-G53 WeakPolarHBondContact CA-O 3.36Å; E50-G53 WeakPolarHBondContact CB-O 3.42Å; E50-G53 VanDerWaalsContact O-O 3.1Å |
| 51 | T | 98.6 | Very high | 98.5 | Very high | 108 Ų | 108 | 54 Ų | 54 | 66% | 0.663 | 29% | 0.293 | S | S | * | . | S | Bend | trans | -80.2 | -15.5 | 178.4 | 63 | 0 | 0 | 0 | 0 | 113.9 | S48 G49 | S48-T51 PolarHBondContact O-N 3Å; S48-T51 PolarHBondContact O-OG1 3.47Å; S48-T51 PolarHBondContact OG-N 2.93Å; G49-T51 PolarHBondContact O-N 3.47Å; G49-T51 VanDerWaalsContact O-N 3.17Å |
| 52 | K | 98.4 | Very high | 98.4 | Very high | 147 Ų | 147 | 53.7 Ų | 53.7 | 64% | 0.639 | 29% | 0.291 | S | S | * | . | S | Bend | trans | -122.8 | 6.1 | 178.9 | -57.5 | -63.1 | 176.3 | -172 | 0 | 113.6 | Q44 S48 | Q44-K52 HydrophobicContact CG-CB 3.89Å; Q44-K52 PolarHBondContact NE2-O 2.84Å; S48-K52 PolarHBondContact OG-N 3.41Å |
| 53 | G | 98.3 | Very high | 98.4 | Very high | 6 Ų | 6 | 53 Ų | 53 | 6% | 0.062 | 29% | 0.287 | C | S | . | . | trans | -179.9 | 156.6 | 177.9 | 0 | 0 | 0 | 0 | 0 | 110.4 | E50 T57 | E50-G53 CarbonylContact C-O 3.29Å; E50-G53 VanDerWaalsContact C-O 3.29Å; E50-G53 WeakPolarHBondContact CA-O 3.36Å; E50-G53 WeakPolarHBondContact CB-O 3.42Å; E50-G53 VanDerWaalsContact O-O 3.1Å; G53-T57 WeakPolarHBondContact CA-OG1 3.47Å | ||
| 54 | N | 98 | Very high | 98.4 | Very high | 63 Ų | 63 | 57.2 Ų | 57.2 | 34% | 0.337 | 31% | 0.308 | S | S | . | . | trans | -146.5 | -176.1 | 176.3 | 60.5 | 29 | 0 | 0 | 0 | 109.6 | F56 T57 M58 | N54-F56 PolarHBondContact O-N 2.9Å; N54-F56 VanDerWaalsContact O-N 3.13Å; N54-F56 PolarHBondContact OD1-N 2.65Å; N54-F56 VanDerWaalsContact OD1-N 3.13Å; N54-T57 PolarHBondContact N-OG1 3.36Å; N54-T57 PolarHBondContact O-N 2.89Å; N54-T57 PolarHBondContact O-OG1 3.43Å; N54-T57 PolarHBondContact OD1-N 3.21Å; N54-M58 WeakPolarHBondContact O-CG 3.4Å; N54-M58 PolarHBondContact O-N 3.08Å | ||
| 55 | F | 96.9 | Very high | 98.4 | Very high | 125 Ų | 125 | 52.9 Ų | 52.9 | 55% | 0.548 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -48.8 | -43.3 | -178.9 | 84.8 | -86.9 | 0 | 0 | 0 | 113.8 | M58 F59 | F55-M58 HydrophobicContact CB-CE 4.39Å; F55-M58 PolarHBondContact O-N 3.45Å; F55-F59 HydrophobicContact CD2-CD2 4.48Å; F55-F59 HydrophobicContact CD2-CE2 4.32Å; F55-F59 WeakPolarHBondContact O-CD1 3.23Å; F55-F59 WeakPolarHBondContact O-CG 3.48Å; F55-F59 PolarHBondContact O-N 3.25Å |
| 56 | F | 98.4 | Very high | 98.4 | Very high | 91 Ų | 91 | 54 Ų | 54 | 40% | 0.399 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -66.3 | -45 | -178.9 | 176.3 | -99.8 | 0 | 0 | 0 | 111.2 | N54 M58 F59 L60 L203 | N54-F56 PolarHBondContact O-N 2.9Å; N54-F56 VanDerWaalsContact O-N 3.13Å; N54-F56 PolarHBondContact OD1-N 2.65Å; N54-F56 VanDerWaalsContact OD1-N 3.13Å; F56-M58 VanDerWaalsContact C-N 3.29Å; F56-M58 PolarHBondContact O-N 3.31Å; F56-F59 PolarHBondContact O-N 3.14Å; F56-L60 HydrophobicContact CE1-CD2 4.03Å; F56-L60 HydrophobicContact CZ-CD2 4.38Å; F56-L60 WeakPolarHBondContact O-CB 3.23Å; F56-L60 PolarHBondContact O-N 3.12Å; F56-L203 HydrophobicContact CD2-CD2 4.04Å; F56-L203 HydrophobicContact CE2-CD2 4.41Å |
| 57 | T | 98.3 | Very high | 98.4 | Very high | 53 Ų | 53 | 53.5 Ų | 53.5 | 33% | 0.325 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -63.9 | -35.4 | 177.5 | 62.7 | 0 | 0 | 0 | 0 | 112.3 | G53 N54 A61 | G53-T57 WeakPolarHBondContact CA-OG1 3.47Å; N54-T57 PolarHBondContact N-OG1 3.36Å; N54-T57 PolarHBondContact O-N 2.89Å; N54-T57 PolarHBondContact O-OG1 3.43Å; N54-T57 PolarHBondContact OD1-N 3.21Å; T57-A61 WeakPolarHBondContact O-CB 3.42Å; T57-A61 PolarHBondContact O-N 3.03Å |
| 58 | M | 98.6 | Very high | 98.3 | Very high | 42 Ų | 42 | 56.5 Ų | 56.5 | 21% | 0.207 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -63.9 | -44.8 | 176.2 | -67.6 | -172.1 | -82.9 | 0 | 0 | 110.8 | V42 A45 N54 F55 F56 G62 | V42-M58 HydrophobicContact CB-SD 3.99Å; V42-M58 HydrophobicContact CG1-SD 3.75Å; V42-M58 HydrophobicContact CG2-CB 4.43Å; V42-M58 HydrophobicContact CG2-CG 4.19Å; V42-M58 HydrophobicContact CG2-SD 3.85Å; A45-M58 HydrophobicContact CB-CE 4.18Å; A45-M58 HydrophobicContact CB-CG 3.93Å; A45-M58 HydrophobicContact CB-SD 3.81Å; N54-M58 WeakPolarHBondContact O-CG 3.4Å; N54-M58 PolarHBondContact O-N 3.08Å; F55-M58 HydrophobicContact CB-CE 4.39Å; F55-M58 PolarHBondContact O-N 3.45Å; F56-M58 VanDerWaalsContact C-N 3.29Å; F56-M58 PolarHBondContact O-N 3.31Å; M58-G62 PolarHBondContact O-N 3.36Å |
| 59 | F | 98.6 | Very high | 98.3 | Very high | 35 Ų | 35 | 55.1 Ų | 55.1 | 15% | 0.154 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -70.6 | -42 | -179.3 | -66 | 3.5 | 0 | 0 | 0 | 111.6 | F55 F56 S63 L199 G202 L203 F211 | F55-F59 HydrophobicContact CD2-CD2 4.48Å; F55-F59 HydrophobicContact CD2-CE2 4.32Å; F55-F59 WeakPolarHBondContact O-CD1 3.23Å; F55-F59 WeakPolarHBondContact O-CG 3.48Å; F55-F59 PolarHBondContact O-N 3.25Å; F56-F59 PolarHBondContact O-N 3.14Å; F59-S63 WeakPolarHBondContact O-CB 3.46Å; F59-S63 PolarHBondContact O-N 2.9Å; F59-L199 HydrophobicContact CB-CD1 4.32Å; F59-G202 WeakPolarHBondContact CD2-O 3.33Å; F59-G202 WeakPolarHBondContact CE2-O 3.47Å; F59-L203 HydrophobicContact CD2-CD2 4.01Å; F59-F211 HydrophobicContact CB-CZ 4.37Å; F59-F211 AromaticContact CD1-CE1 3.47Å; F59-F211 HydrophobicContact CD1-CE1 3.47Å; F59-F211 VanDerWaalsContact CD1-CE1 3.47Å; F59-F211 AromaticContact CD1-CZ 3.94Å; F59-F211 HydrophobicContact CD1-CZ 3.94Å; F59-F211 HydrophobicContact CD2-CE1 4.21Å; F59-F211 HydrophobicContact CE1-CD1 4.37Å; F59-F211 AromaticContact CE1-CE1 3.55Å; F59-F211 HydrophobicContact CE1-CE1 3.55Å; F59-F211 HydrophobicContact CE1-CZ 4.45Å; F59-F211 HydrophobicContact CE2-CE1 4.27Å; F59-F211 AromaticContact CG-CE1 3.83Å; F59-F211 HydrophobicContact CG-CE1 3.83Å; F59-F211 HydrophobicContact CG-CZ 4.12Å; F59-F211 HydrophobicContact CZ-CD1 4.47Å; F59-F211 AromaticContact CZ-CE1 3.95Å; F59-F211 HydrophobicContact CZ-CE1 3.95Å |
| 60 | L | 98.8 | Very high | 98.3 | Very high | 61 Ų | 61 | 54.2 Ų | 54.2 | 32% | 0.319 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -61.1 | -50.9 | 174.6 | 179.2 | 61.1 | 0 | 0 | 0 | 111.2 | F56 G62 S63 L64 L199 | F56-L60 HydrophobicContact CE1-CD2 4.03Å; F56-L60 HydrophobicContact CZ-CD2 4.38Å; F56-L60 WeakPolarHBondContact O-CB 3.23Å; F56-L60 PolarHBondContact O-N 3.12Å; L60-G62 PolarHBondContact O-N 3.46Å; L60-S63 PolarHBondContact O-N 3.35Å; L60-S63 PolarHBondContact O-OG 3.47Å; L60-L64 HydrophobicContact CD1-CD1 4.23Å; L60-L64 HydrophobicContact CD1-CG 4.32Å; L60-L64 HydrophobicContact CG-CD1 4.1Å; L60-L64 WeakPolarHBondContact O-CG 3.35Å; L60-L64 PolarHBondContact O-N 3.36Å; L60-L199 HydrophobicContact CD1-CD2 4.03Å |
| 61 | A | 98.6 | Very high | 98.2 | Very high | 29 Ų | 29 | 53.9 Ų | 53.9 | 24% | 0.24 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -63.4 | -41.5 | -179.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | A41 T57 S63 L64 A65 | A41-A61 HydrophobicContact CB-CB 3.34Å; T57-A61 WeakPolarHBondContact O-CB 3.42Å; T57-A61 PolarHBondContact O-N 3.03Å; A61-S63 VanDerWaalsContact C-N 3.31Å; A61-S63 PolarHBondContact O-N 2.95Å; A61-L64 PolarHBondContact O-N 3.49Å; A61-A65 WeakPolarHBondContact O-CB 3.46Å; A61-A65 PolarHBondContact O-N 3.15Å |
| 62 | G | 98.2 | Very high | 97.9 | Very high | 8 Ų | 8 | 51.8 Ų | 51.8 | 8% | 0.082 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -60.1 | -40.7 | 174 | 0 | 0 | 0 | 0 | 0 | 112.4 | M58 L60 A65 V66 | M58-G62 PolarHBondContact O-N 3.36Å; L60-G62 PolarHBondContact O-N 3.46Å; G62-A65 WeakPolarHBondContact O-CB 3.44Å; G62-A65 PolarHBondContact O-N 2.95Å; G62-V66 PolarHBondContact O-N 2.9Å |
| 63 | S | 98.6 | Very high | 97.3 | Very high | 4 Ų | 4 | 44.8 Ų | 44.8 | 3% | 0.028 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -66 | -42.1 | 175.6 | 76.4 | 0 | 0 | 0 | 0 | 112.7 | F59 L60 A61 A65 V66 V67 G195 | F59-S63 WeakPolarHBondContact O-CB 3.46Å; F59-S63 PolarHBondContact O-N 2.9Å; L60-S63 PolarHBondContact O-N 3.35Å; L60-S63 PolarHBondContact O-OG 3.47Å; A61-S63 VanDerWaalsContact C-N 3.31Å; A61-S63 PolarHBondContact O-N 2.95Å; S63-A65 VanDerWaalsContact C-N 3.33Å; S63-A65 PolarHBondContact O-N 3.33Å; S63-V66 WeakPolarHBondContact O-CB 3.25Å; S63-V66 PolarHBondContact O-N 2.91Å; S63-V67 WeakPolarHBondContact O-CG2 3.44Å; S63-V67 PolarHBondContact O-N 3.3Å; S63-G195 WeakPolarHBondContact CB-O 3.43Å |
| 64 | L | 98.8 | Very high | 96.3 | Very high | 88 Ų | 88 | 46.2 Ų | 46.2 | 46% | 0.461 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -66.3 | -35.2 | 175.3 | -68 | 173.8 | 0 | 0 | 0 | 112 | L60 A61 V66 V67 I68 | L60-L64 HydrophobicContact CD1-CD1 4.23Å; L60-L64 HydrophobicContact CD1-CG 4.32Å; L60-L64 HydrophobicContact CG-CD1 4.1Å; L60-L64 WeakPolarHBondContact O-CG 3.35Å; L60-L64 PolarHBondContact O-N 3.36Å; A61-L64 PolarHBondContact O-N 3.49Å; L64-V66 VanDerWaalsContact C-N 3.29Å; L64-V66 PolarHBondContact O-N 3.24Å; L64-V67 WeakPolarHBondContact O-CB 3.23Å; L64-V67 PolarHBondContact O-N 3.12Å; L64-I68 WeakPolarHBondContact O-CG1 3.33Å; L64-I68 PolarHBondContact O-N 3.4Å |
| 65 | A | 98.6 | Very high | 95.2 | Very high | 1 Ų | 1 | 51 Ų | 51 | 1% | 0.008 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -59.6 | -41.6 | 174.3 | 0 | 0 | 0 | 0 | 0 | 111.4 | L34 L37 A61 G62 S63 I68 A69 | L34-A65 HydrophobicContact CD1-CB 3.99Å; L37-A65 HydrophobicContact CB-CB 3.53Å; L37-A65 HydrophobicContact CD1-CB 4.12Å; L37-A65 HydrophobicContact CG-CB 4.47Å; A61-A65 WeakPolarHBondContact O-CB 3.46Å; A61-A65 PolarHBondContact O-N 3.15Å; G62-A65 WeakPolarHBondContact O-CB 3.44Å; G62-A65 PolarHBondContact O-N 2.95Å; S63-A65 VanDerWaalsContact C-N 3.33Å; S63-A65 PolarHBondContact O-N 3.33Å; A65-I68 PolarHBondContact O-N 2.89Å; A65-A69 WeakPolarHBondContact O-CB 3.44Å; A65-A69 PolarHBondContact O-N 3.02Å |
| 66 | V | 98.3 | Very high | 94.2 | Very high | 24 Ų | 24 | 48.4 Ų | 48.4 | 15% | 0.145 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -61.5 | -47.1 | 173.7 | 174.3 | 0 | 0 | 0 | 0 | 111.1 | L34 G62 S63 L64 I68 A69 I70 V194 I198 | L34-V66 HydrophobicContact CD1-CB 4.34Å; L34-V66 HydrophobicContact CD1-CG2 3.5Å; G62-V66 PolarHBondContact O-N 2.9Å; S63-V66 WeakPolarHBondContact O-CB 3.25Å; S63-V66 PolarHBondContact O-N 2.91Å; L64-V66 VanDerWaalsContact C-N 3.29Å; L64-V66 PolarHBondContact O-N 3.24Å; V66-I68 PolarHBondContact O-N 3.19Å; V66-A69 PolarHBondContact O-N 3.41Å; V66-I70 HydrophobicContact CG1-CD1 3.6Å; V66-I70 HydrophobicContact CG1-CG1 4.26Å; V66-I70 VanDerWaalsContact O-CG1 3.26Å; V66-I70 WeakPolarHBondContact O-CG1 3.47Å; V66-I70 PolarHBondContact O-N 3.43Å; V66-V194 HydrophobicContact CG1-CG1 3.93Å; V66-I198 HydrophobicContact CG1-CG1 4.27Å; V66-I198 HydrophobicContact CG2-CG1 4.33Å; V66-I198 HydrophobicContact CG2-CG2 4.43Å |
| 67 | V | 98.4 | Very high | 93.2 | Very high | 16 Ų | 16 | 44.5 Ų | 44.5 | 10% | 0.097 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -54.1 | -53 | 177.7 | 179.9 | 0 | 0 | 0 | 0 | 110.7 | S63 L64 I70 Y71 P191 V192 | S63-V67 WeakPolarHBondContact O-CG2 3.44Å; S63-V67 PolarHBondContact O-N 3.3Å; L64-V67 WeakPolarHBondContact O-CB 3.23Å; L64-V67 PolarHBondContact O-N 3.12Å; V67-I70 PolarHBondContact O-N 3.28Å; V67-Y71 HydrophobicContact CG1-CD2 3.88Å; V67-Y71 HydrophobicContact CG1-CE2 3.55Å; V67-Y71 VanDerWaalsContact O-CD2 3.23Å; V67-Y71 WeakPolarHBondContact O-CD2 3.38Å; V67-Y71 PolarHBondContact O-N 3.4Å; V67-Y71 VanDerWaalsContact O-N 3.1Å; V67-P191 HydrophobicContact CG1-CB 4.22Å; V67-P191 WeakPolarHBondContact CG2-O 3.47Å; V67-V192 HydrophobicContact CG1-CG2 4.09Å |
| 68 | I | 98.3 | Very high | 92.3 | Very high | 82 Ų | 82 | 44.1 Ų | 44.1 | 42% | 0.421 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -65 | -44.4 | -176.6 | -64 | 165.6 | 0 | 0 | 0 | 110.2 | V33 L37 L64 A65 V66 I70 Y71 V72 | V33-I68 HydrophobicContact CG1-CG2 3.88Å; L37-I68 HydrophobicContact CD1-CB 4.47Å; L37-I68 HydrophobicContact CD1-CD1 3.9Å; L64-I68 WeakPolarHBondContact O-CG1 3.33Å; L64-I68 PolarHBondContact O-N 3.4Å; A65-I68 PolarHBondContact O-N 2.89Å; V66-I68 PolarHBondContact O-N 3.19Å; I68-I70 VanDerWaalsContact C-N 3.32Å; I68-I70 PolarHBondContact O-N 3.45Å; I68-Y71 PolarHBondContact O-N 3.29Å; I68-V72 HydrophobicContact CG2-CG2 4.41Å; I68-V72 VanDerWaalsContact O-CG2 3.3Å; I68-V72 WeakPolarHBondContact O-CG2 3.32Å; I68-V72 PolarHBondContact O-N 3.18Å |
| 69 | A | 97.8 | Very high | 91.8 | Very high | 0 Ų | 0 | 42.5 Ų | 42.5 | 0% | 0 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -63.5 | -37.2 | -179.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | G30 L34 A65 V66 V72 G73 L81 | G30-A69 VanDerWaalsContact O-CB 3.3Å; G30-A69 WeakPolarHBondContact O-CB 3.42Å; L34-A69 HydrophobicContact CB-CB 3.74Å; A65-A69 WeakPolarHBondContact O-CB 3.44Å; A65-A69 PolarHBondContact O-N 3.02Å; V66-A69 PolarHBondContact O-N 3.41Å; A69-V72 PolarHBondContact O-N 2.93Å; A69-G73 PolarHBondContact O-N 3.38Å; A69-L81 HydrophobicContact CB-CD1 3.63Å |
| 70 | I | 97.4 | Very high | 91.8 | Very high | 32 Ų | 32 | 41.7 Ų | 41.7 | 16% | 0.164 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -66.4 | -42.5 | 174.1 | -66.5 | 168.1 | 0 | 0 | 0 | 110.5 | V66 V67 I68 V72 G73 G74 A79 L81 P191 V194 | V66-I70 HydrophobicContact CG1-CD1 3.6Å; V66-I70 HydrophobicContact CG1-CG1 4.26Å; V66-I70 VanDerWaalsContact O-CG1 3.26Å; V66-I70 WeakPolarHBondContact O-CG1 3.47Å; V66-I70 PolarHBondContact O-N 3.43Å; V67-I70 PolarHBondContact O-N 3.28Å; I68-I70 VanDerWaalsContact C-N 3.32Å; I68-I70 PolarHBondContact O-N 3.45Å; I70-V72 VanDerWaalsContact C-N 3.25Å; I70-V72 PolarHBondContact O-N 3.41Å; I70-G73 PolarHBondContact O-N 2.85Å; I70-G74 WeakPolarHBondContact O-CA 3.49Å; I70-G74 PolarHBondContact O-N 3.4Å; I70-A79 HydrophobicContact CB-CB 4.37Å; I70-A79 HydrophobicContact CG1-CB 4.43Å; I70-A79 HydrophobicContact CG2-CB 4.19Å; I70-L81 HydrophobicContact CG1-CD1 4.22Å; I70-P191 HydrophobicContact CB-CB 3.99Å; I70-P191 HydrophobicContact CB-CG 4.34Å; I70-P191 HydrophobicContact CG2-CB 3.78Å; I70-P191 HydrophobicContact CG2-CG 3.62Å; I70-V194 HydrophobicContact CD1-CB 3.9Å; I70-V194 HydrophobicContact CD1-CG1 3.52Å; I70-V194 HydrophobicContact CD1-CG2 4.37Å |
| 71 | Y | 96 | Very high | 91.8 | Very high | 117 Ų | 117 | 39.2 Ų | 39.2 | 46% | 0.459 | 23% | 0.232 | S | C | . | . | H | α-helix | trans | -60.1 | -37.3 | 173.4 | -78.4 | -58.3 | 0 | 0 | 0 | 112.5 | V67 I68 G188 P191 V192 | V67-Y71 HydrophobicContact CG1-CD2 3.88Å; V67-Y71 HydrophobicContact CG1-CE2 3.55Å; V67-Y71 VanDerWaalsContact O-CD2 3.23Å; V67-Y71 WeakPolarHBondContact O-CD2 3.38Å; V67-Y71 PolarHBondContact O-N 3.4Å; V67-Y71 VanDerWaalsContact O-N 3.1Å; I68-Y71 PolarHBondContact O-N 3.29Å; Y71-G188 WeakPolarHBondContact CE1-O 3.47Å; Y71-G188 PolarHBondContact OH-O 2.98Å; Y71-P191 HydrophobicContact CD1-CB 4.29Å; Y71-P191 HydrophobicContact CD1-CG 3.79Å; Y71-P191 HydrophobicContact CD2-CB 3.99Å; Y71-P191 HydrophobicContact CD2-CG 4.4Å; Y71-P191 HydrophobicContact CE1-CB 4.05Å; Y71-P191 HydrophobicContact CE1-CG 3.53Å; Y71-P191 HydrophobicContact CE2-CB 3.76Å; Y71-P191 HydrophobicContact CE2-CG 4.19Å; Y71-P191 HydrophobicContact CG-CB 4.25Å; Y71-P191 HydrophobicContact CG-CG 4.21Å; Y71-V192 HydrophobicContact CE2-CG2 4.38Å |
| 72 | V | 93.4 | Very high | 91.8 | Very high | 63 Ų | 63 | 38.4 Ų | 38.4 | 38% | 0.382 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -67.2 | -44.2 | 177.7 | 168.9 | 0 | 0 | 0 | 0 | 112 | L29 I68 A69 I70 | L29-V72 HydrophobicContact CB-CG1 4.42Å; L29-V72 HydrophobicContact CD2-CG1 3.71Å; L29-V72 HydrophobicContact CG-CG1 3.69Å; I68-V72 HydrophobicContact CG2-CG2 4.41Å; I68-V72 VanDerWaalsContact O-CG2 3.3Å; I68-V72 WeakPolarHBondContact O-CG2 3.32Å; I68-V72 PolarHBondContact O-N 3.18Å; A69-V72 PolarHBondContact O-N 2.93Å; I70-V72 VanDerWaalsContact C-N 3.25Å; I70-V72 PolarHBondContact O-N 3.41Å |
| 73 | G | 85.9 | Confident | 91.8 | Very high | 0 Ų | 0 | 38.1 Ų | 38.1 | 0% | 0 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -92.5 | -18.4 | -175.1 | 0 | 0 | 0 | 0 | 0 | 116 | A69 I70 N75 V76 S77 A79 | A69-G73 PolarHBondContact O-N 3.38Å; I70-G73 PolarHBondContact O-N 2.85Å; G73-N75 VanDerWaalsContact C-N 3.33Å; G73-N75 PolarHBondContact O-N 2.98Å; G73-N75 VanDerWaalsContact O-N 3.14Å; G73-V76 PolarHBondContact O-N 2.74Å; G73-S77 PolarHBondContact O-N 2.75Å; G73-S77 PolarHBondContact O-OG 2.84Å; G73-A79 PolarHBondContact O-N 2.73Å |
| 74 | G | 76.8 | Confident | 91.8 | Very high | 36 Ų | 36 | 38 Ų | 38 | 37% | 0.371 | 22% | 0.22 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -65.5 | -26.5 | -154.8 | 0 | 0 | 0 | 0 | 0 | 115.9 | I70 | I70-G74 WeakPolarHBondContact O-CA 3.49Å; I70-G74 PolarHBondContact O-N 3.4Å |
| 75 | N | 74.3 | Confident | 91.8 | Very high | 164 Ų | 164 | 34.5 Ų | 34.5 | 88% | 0.877 | 20% | 0.201 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -92.2 | -17.1 | -176 | -149.2 | -12.7 | 0 | 0 | 0 | 113.7 | G73 | G73-N75 VanDerWaalsContact C-N 3.33Å; G73-N75 PolarHBondContact O-N 2.98Å; G73-N75 VanDerWaalsContact O-N 3.14Å |
| 76 | V | 77.4 | Confident | 91.8 | Very high | 71 Ų | 71 | 34.4 Ų | 34.4 | 43% | 0.43 | 20% | 0.201 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -108.3 | -50.8 | -171.9 | -178 | 0 | 0 | 0 | 0 | 112.3 | R22 A26 G73 | R22-V76 HydrophobicContact CB-CG1 3.8Å; R22-V76 WeakPolarHBondContact O-CG1 2.96Å; A26-V76 HydrophobicContact CB-CB 3.8Å; A26-V76 HydrophobicContact CB-CG1 3.98Å; G73-V76 PolarHBondContact O-N 2.74Å |
| 77 | S | 75.9 | Confident | 91.8 | Very high | 8 Ų | 8 | 34.6 Ų | 34.6 | 6% | 0.056 | 20% | 0.201 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -98.3 | -14.4 | 176.8 | 63 | 0 | 0 | 0 | 0 | 113.9 | E27 G73 A79 | E27-S77 VanDerWaalsContact OE1-CB 3.23Å; E27-S77 WeakPolarHBondContact OE1-CB 3.4Å; E27-S77 PolarHBondContact OE1-OG 2.8Å; G73-S77 PolarHBondContact O-N 2.75Å; G73-S77 PolarHBondContact O-OG 2.84Å; S77-A79 VanDerWaalsContact C-N 3.33Å; S77-A79 PolarHBondContact OG-N 3.43Å; S77-A79 VanDerWaalsContact OG-N 3.08Å |
| 78 | G | 79.2 | Confident | 91.8 | Very high | 45 Ų | 45 | 33.9 Ų | 33.9 | 46% | 0.464 | 20% | 0.196 | S | C | . | . | trans | 86.4 | 2.9 | -162.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 79 | A | 89.5 | Confident | 91.8 | Very high | 8 Ų | 8 | 30.6 Ų | 30.6 | 7% | 0.066 | 18% | 0.179 | C | C | . | . | trans | 50.1 | 66.2 | -176.5 | 0 | 0 | 0 | 0 | 0 | 113.5 | I70 G73 S77 L81 | I70-A79 HydrophobicContact CB-CB 4.37Å; I70-A79 HydrophobicContact CG1-CB 4.43Å; I70-A79 HydrophobicContact CG2-CB 4.19Å; G73-A79 PolarHBondContact O-N 2.73Å; S77-A79 VanDerWaalsContact C-N 3.33Å; S77-A79 PolarHBondContact OG-N 3.43Å; S77-A79 VanDerWaalsContact OG-N 3.08Å; A79-L81 HydrophobicContact CB-CD1 4.19Å; A79-L81 HydrophobicContact CB-CD2 4.47Å; A79-L81 HydrophobicContact CB-CG 4.15Å | ||
| 80 | H | 97.8 | Very high | 91.9 | Very high | 19 Ų | 19 | 30.7 Ų | 30.7 | 9% | 0.088 | 18% | 0.18 | C | C | . | . | trans | -70.9 | -51 | 176.8 | -70.3 | -159.2 | 0 | 0 | 0 | 111.4 | E27 N82 F85 S86 Y103 | E27-H80 PolarHBondContact OE1-N 2.82Å; H80-N82 WeakPolarHBondContact O-CB 3.44Å; H80-N82 PolarHBondContact O-N 3.15Å; H80-F85 HydrophobicContact CB-CD1 3.94Å; H80-F85 AromaticContact CD2-CE1 3.91Å; H80-F85 AromaticContact CG-CD1 3.94Å; H80-S86 WeakPolarHBondContact CB-OG 3.25Å; H80-S86 WeakPolarHBondContact ND1-CA 3.42Å; H80-S86 PolarHBondContact ND1-OG 3.18Å; H80-S86 VanDerWaalsContact ND1-OG 3.12Å; H80-Y103 HydrophobicContact CB-CD1 4.25Å; H80-Y103 HydrophobicContact CB-CE1 4.39Å; H80-Y103 AromaticContact CE1-CE1 3.96Å; H80-Y103 AromaticContact CG-CE1 3.88Å; H80-Y103 AromaticContact ND1-CD1 3.66Å; H80-Y103 AromaticContact ND1-CE1 3.64Å | ||
| 81 | L | 98.2 | Very high | 91.9 | Very high | 8 Ų | 8 | 32.4 Ų | 32.4 | 4% | 0.042 | 19% | 0.188 | C | C | . | . | trans | 57.2 | 1.7 | 172.8 | -43.9 | -177.5 | 0 | 0 | 0 | 115.6 | E27 V31 L34 A69 I70 A79 N214 | E27-L81 WeakPolarHBondContact OE2-CA 3.48Å; E27-L81 PolarHBondContact OE2-N 3.48Å; V31-L81 HydrophobicContact CG2-CB 3.95Å; V31-L81 HydrophobicContact CG2-CD2 4.1Å; L34-L81 HydrophobicContact CD2-CB 4.5Å; A69-L81 HydrophobicContact CB-CD1 3.63Å; I70-L81 HydrophobicContact CG1-CD1 4.22Å; A79-L81 HydrophobicContact CB-CD1 4.19Å; A79-L81 HydrophobicContact CB-CD2 4.47Å; A79-L81 HydrophobicContact CB-CG 4.15Å; L81-N214 PolarHBondContact O-ND2 3.43Å | ||
| 82 | N | 98.6 | Very high | 92 | Very high | 12 Ų | 12 | 28.5 Ų | 28.5 | 6% | 0.064 | 18% | 0.177 | C | C | . | . | S | Bend | trans | -150.6 | 123.8 | -168.9 | -176.1 | -15.4 | 0 | 0 | 0 | 109.1 | H80 A84 F85 S86 L213 N214 P215 | H80-N82 WeakPolarHBondContact O-CB 3.44Å; H80-N82 PolarHBondContact O-N 3.15Å; N82-A84 PolarHBondContact O-N 2.94Å; N82-A84 VanDerWaalsContact OD1-CB 3.26Å; N82-A84 WeakPolarHBondContact OD1-CB 3.42Å; N82-A84 PolarHBondContact OD1-N 3.42Å; N82-F85 HydrophobicContact CB-CB 4.02Å; N82-F85 PolarHBondContact O-N 2.58Å; N82-S86 PolarHBondContact O-N 2.95Å; N82-S86 PolarHBondContact O-OG 3.11Å; N82-L213 PolarHBondContact ND2-O 2.97Å; N82-N214 HydrophobicContact CB-CB 4.33Å; N82-N214 WeakPolarHBondContact CB-ND2 3.47Å; N82-N214 VanDerWaalsContact CG-CG 3.44Å; N82-N214 WeakPolarHBondContact OD1-CA 3.43Å; N82-P215 WeakPolarHBondContact OD1-CD 3.43Å |
| 83 | P | 98.9 | Very high | 92.1 | Very high | 3 Ų | 3 | 28.6 Ų | 28.6 | 2% | 0.019 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -53.6 | -38.4 | 172.1 | -33.2 | 40.6 | 0 | 0 | 0 | 113.8 | S86 L87 I104 Q107 N214 P215 A216 L250 | P83-S86 PolarHBondContact O-N 3.48Å; P83-L87 WeakPolarHBondContact O-CB 3.38Å; P83-L87 PolarHBondContact O-N 3.28Å; P83-I104 HydrophobicContact CB-CD1 4.15Å; P83-I104 HydrophobicContact CB-CG1 3.83Å; P83-I104 HydrophobicContact CG-CG1 4.16Å; P83-I104 HydrophobicContact CG-CG2 4.27Å; P83-Q107 VanDerWaalsContact N-OE1 3.14Å; P83-N214 VanDerWaalsContact CD-OD1 3.23Å; P83-N214 WeakPolarHBondContact CD-OD1 3.47Å; P83-P215 HydrophobicContact CB-CB 4.06Å; P83-P215 HydrophobicContact CB-CG 4.04Å; P83-P215 HydrophobicContact CG-CB 4.03Å; P83-P215 HydrophobicContact CG-CG 4.45Å; P83-A216 HydrophobicContact CG-CB 3.73Å; P83-L250 HydrophobicContact CB-CD2 4.33Å |
| 84 | A | 98.8 | Very high | 92.6 | Very high | 0 Ų | 0 | 38.4 Ų | 38.4 | 0% | 0 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -67.3 | -41.5 | -179.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | N82 L87 A88 T167 M171 P249 L250 A253 | N82-A84 PolarHBondContact O-N 2.94Å; N82-A84 VanDerWaalsContact OD1-CB 3.26Å; N82-A84 WeakPolarHBondContact OD1-CB 3.42Å; N82-A84 PolarHBondContact OD1-N 3.42Å; A84-L87 PolarHBondContact O-N 3.34Å; A84-A88 PolarHBondContact O-N 2.94Å; A84-T167 HydrophobicContact CB-CG2 4.02Å; A84-M171 HydrophobicContact CB-CE 4.42Å; A84-P249 HydrophobicContact CB-CB 4.17Å; A84-L250 HydrophobicContact CB-CD2 4.21Å; A84-A253 HydrophobicContact CB-CB 3.79Å; A84-A253 WeakPolarHBondContact O-CB 2.99Å |
| 85 | F | 98.6 | Very high | 93.5 | Very high | 15 Ų | 15 | 37 Ų | 37 | 7% | 0.066 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -70.3 | -36.8 | 173.6 | -175.1 | -103.5 | 0 | 0 | 0 | 112.1 | H80 N82 L87 A88 M89 M171 L174 L178 | H80-F85 HydrophobicContact CB-CD1 3.94Å; H80-F85 AromaticContact CD2-CE1 3.91Å; H80-F85 AromaticContact CG-CD1 3.94Å; N82-F85 HydrophobicContact CB-CB 4.02Å; N82-F85 PolarHBondContact O-N 2.58Å; F85-L87 VanDerWaalsContact C-N 3.29Å; F85-L87 PolarHBondContact O-N 2.95Å; F85-A88 WeakPolarHBondContact O-CB 3.47Å; F85-A88 PolarHBondContact O-N 3.33Å; F85-M89 HydrophobicContact CD1-CG 4.04Å; F85-M89 HydrophobicContact CD2-CE 4.25Å; F85-M89 HydrophobicContact CE1-CE 4.3Å; F85-M89 HydrophobicContact CE1-CG 3.64Å; F85-M89 HydrophobicContact CE1-SD 4.05Å; F85-M89 HydrophobicContact CE2-CE 3.52Å; F85-M89 HydrophobicContact CE2-CG 4.45Å; F85-M89 HydrophobicContact CE2-SD 4.3Å; F85-M89 HydrophobicContact CZ-CE 3.54Å; F85-M89 HydrophobicContact CZ-CG 3.86Å; F85-M89 HydrophobicContact CZ-SD 3.69Å; F85-M89 WeakPolarHBondContact O-CG 3.48Å; F85-M89 PolarHBondContact O-N 2.87Å; F85-M171 HydrophobicContact CB-CE 4.01Å; F85-M171 HydrophobicContact CB-SD 4.18Å; F85-M171 HydrophobicContact CD2-CE 4.32Å; F85-M171 HydrophobicContact CD2-SD 3.73Å; F85-M171 HydrophobicContact CG-SD 4.44Å; F85-L174 HydrophobicContact CD2-CB 4.28Å; F85-L174 HydrophobicContact CD2-CD1 3.4Å; F85-L174 HydrophobicContact CD2-CG 4.43Å; F85-L174 HydrophobicContact CE2-CB 3.89Å; F85-L174 HydrophobicContact CE2-CD1 3.77Å; F85-L174 HydrophobicContact CE2-CG 4.38Å; F85-L174 HydrophobicContact CG-CD1 4.2Å; F85-L178 HydrophobicContact CE2-CD1 3.94Å; F85-L178 HydrophobicContact CZ-CD1 3.54Å |
| 86 | S | 98.7 | Very high | 94.6 | Very high | 0 Ų | 0 | 32.6 Ų | 32.6 | 0% | 0 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -61.2 | -40 | 174.4 | -56.7 | 0 | 0 | 0 | 0 | 111.8 | H80 N82 P83 M89 C90 Q107 | H80-S86 WeakPolarHBondContact CB-OG 3.25Å; H80-S86 WeakPolarHBondContact ND1-CA 3.42Å; H80-S86 PolarHBondContact ND1-OG 3.18Å; H80-S86 VanDerWaalsContact ND1-OG 3.12Å; N82-S86 PolarHBondContact O-N 2.95Å; N82-S86 PolarHBondContact O-OG 3.11Å; P83-S86 PolarHBondContact O-N 3.48Å; S86-M89 PolarHBondContact O-N 3.11Å; S86-C90 PolarHBondContact O-N 3.27Å; S86-Q107 PolarHBondContact OG-NE2 2.78Å; S86-Q107 VanDerWaalsContact OG-NE2 3.15Å |
| 87 | L | 98.8 | Very high | 95.6 | Very high | 28 Ų | 28 | 36.2 Ų | 36.2 | 15% | 0.147 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -63.1 | -46.6 | 172.6 | 176 | 62.5 | 0 | 0 | 0 | 111.5 | P83 A84 F85 M89 C90 I91 W97 L100 L250 | P83-L87 WeakPolarHBondContact O-CB 3.38Å; P83-L87 PolarHBondContact O-N 3.28Å; A84-L87 PolarHBondContact O-N 3.34Å; F85-L87 VanDerWaalsContact C-N 3.29Å; F85-L87 PolarHBondContact O-N 2.95Å; L87-M89 VanDerWaalsContact C-N 3.29Å; L87-M89 PolarHBondContact O-N 3.35Å; L87-C90 WeakPolarHBondContact O-CA 3.3Å; L87-C90 WeakPolarHBondContact O-CB 3.49Å; L87-C90 PolarHBondContact O-N 3.28Å; L87-I91 HydrophobicContact CD1-CD1 4.38Å; L87-I91 HydrophobicContact CD1-CG1 4.47Å; L87-I91 HydrophobicContact CG-CD1 4.07Å; L87-I91 WeakPolarHBondContact O-CG1 3.21Å; L87-I91 PolarHBondContact O-N 3.36Å; L87-W97 HydrophobicContact CD1-CH2 3.92Å; L87-W97 HydrophobicContact CD1-CZ3 3.71Å; L87-L100 HydrophobicContact CD1-CD2 4.08Å; L87-L250 HydrophobicContact CD2-CB 4.06Å; L87-L250 HydrophobicContact CD2-CD2 4.07Å |
| 88 | A | 98.5 | Very high | 96.6 | Very high | 0 Ų | 0 | 41.3 Ų | 41.3 | 0% | 0 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -56 | -44.2 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | A84 F85 C90 I91 V92 M171 T257 | A84-A88 PolarHBondContact O-N 2.94Å; F85-A88 WeakPolarHBondContact O-CB 3.47Å; F85-A88 PolarHBondContact O-N 3.33Å; A88-C90 VanDerWaalsContact C-N 3.29Å; A88-C90 PolarHBondContact O-N 3.11Å; A88-I91 WeakPolarHBondContact O-CB 3.48Å; A88-I91 PolarHBondContact O-N 2.93Å; A88-I91 VanDerWaalsContact O-N 3.14Å; A88-V92 WeakPolarHBondContact O-CG2 3.41Å; A88-V92 PolarHBondContact O-N 3.39Å; A88-M171 HydrophobicContact CB-CG 4.35Å; A88-M171 HydrophobicContact CB-SD 3.76Å; A88-T257 VanDerWaalsContact CB-OG1 3.25Å; A88-T257 WeakPolarHBondContact CB-OG1 3.49Å |
| 89 | M | 98.3 | Very high | 97.5 | Very high | 13 Ų | 13 | 41 Ų | 41 | 6% | 0.064 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -63 | -32.6 | 175.4 | -67.4 | -57 | 98.5 | 0 | 0 | 113 | F85 S86 L87 V92 G93 R94 L95 L175 | F85-M89 HydrophobicContact CD1-CG 4.04Å; F85-M89 HydrophobicContact CD2-CE 4.25Å; F85-M89 HydrophobicContact CE1-CE 4.3Å; F85-M89 HydrophobicContact CE1-CG 3.64Å; F85-M89 HydrophobicContact CE1-SD 4.05Å; F85-M89 HydrophobicContact CE2-CE 3.52Å; F85-M89 HydrophobicContact CE2-CG 4.45Å; F85-M89 HydrophobicContact CE2-SD 4.3Å; F85-M89 HydrophobicContact CZ-CE 3.54Å; F85-M89 HydrophobicContact CZ-CG 3.86Å; F85-M89 HydrophobicContact CZ-SD 3.69Å; F85-M89 WeakPolarHBondContact O-CG 3.48Å; F85-M89 PolarHBondContact O-N 2.87Å; S86-M89 PolarHBondContact O-N 3.11Å; L87-M89 VanDerWaalsContact C-N 3.29Å; L87-M89 PolarHBondContact O-N 3.35Å; M89-V92 HydrophobicContact CE-CG2 4.03Å; M89-V92 HydrophobicContact SD-CG2 4.39Å; M89-G93 PolarHBondContact O-N 3.46Å; M89-R94 HydrophobicContact CB-CB 4.28Å; M89-R94 CarbonylContact O-C 3.56Å; M89-R94 WeakPolarHBondContact O-CA 3.45Å; M89-R94 PolarHBondContact O-N 2.81Å; M89-R94 HydrophobicContact SD-CB 3.92Å; M89-R94 HydrophobicContact SD-CG 4.43Å; M89-L95 HydrophobicContact CB-CB 3.82Å; M89-L95 PolarHBondContact O-N 3.47Å; M89-L175 HydrophobicContact CE-CD2 3.6Å |
| 90 | C | 98.5 | Very high | 97.9 | Very high | 2 Ų | 2 | 41.7 Ų | 41.7 | 1% | 0.014 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -67.5 | -44.6 | 170.4 | -74.6 | 0 | 0 | 0 | 0 | 112.4 | S86 L87 A88 V92 G93 L95 W97 | S86-C90 PolarHBondContact O-N 3.27Å; L87-C90 WeakPolarHBondContact O-CA 3.3Å; L87-C90 WeakPolarHBondContact O-CB 3.49Å; L87-C90 PolarHBondContact O-N 3.28Å; A88-C90 VanDerWaalsContact C-N 3.29Å; A88-C90 PolarHBondContact O-N 3.11Å; C90-V92 VanDerWaalsContact C-N 3.31Å; C90-V92 PolarHBondContact O-N 2.79Å; C90-G93 PolarHBondContact O-N 3.18Å; C90-G93 VanDerWaalsContact O-N 3.09Å; C90-L95 WeakPolarHBondContact CA-O 3.49Å; C90-L95 PolarHBondContact SG-O 3.02Å; C90-W97 HydrophobicContact CB-CD2 3.66Å; C90-W97 HydrophobicContact CB-CE3 3.64Å; C90-W97 HydrophobicContact CB-CG 4.38Å; C90-W97 HydrophobicContact CB-CH2 3.74Å; C90-W97 HydrophobicContact CB-CZ2 3.74Å; C90-W97 HydrophobicContact CB-CZ3 3.69Å |
| 91 | I | 98.3 | Very high | 98 | Very high | 68 Ų | 68 | 44.7 Ų | 44.7 | 35% | 0.349 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -59 | -42.5 | 179.1 | -67.7 | 166.4 | 0 | 0 | 0 | 111 | L87 A88 G93 W97 T254 T257 | L87-I91 HydrophobicContact CD1-CD1 4.38Å; L87-I91 HydrophobicContact CD1-CG1 4.47Å; L87-I91 HydrophobicContact CG-CD1 4.07Å; L87-I91 WeakPolarHBondContact O-CG1 3.21Å; L87-I91 PolarHBondContact O-N 3.36Å; A88-I91 WeakPolarHBondContact O-CB 3.48Å; A88-I91 PolarHBondContact O-N 2.93Å; A88-I91 VanDerWaalsContact O-N 3.14Å; I91-G93 VanDerWaalsContact C-N 3.28Å; I91-G93 PolarHBondContact O-N 3.47Å; I91-W97 HydrophobicContact CG1-CH2 4.06Å; I91-W97 HydrophobicContact CG1-CZ2 4.36Å; I91-T254 HydrophobicContact CD1-CG2 4.05Å; I91-T257 HydrophobicContact CB-CG2 4.18Å; I91-T257 HydrophobicContact CG2-CG2 3.71Å |
| 92 | V | 96.9 | Very high | 98 | Very high | 35 Ų | 35 | 47.4 Ų | 47.4 | 21% | 0.212 | 25% | 0.252 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -87.1 | 10.2 | 179.4 | -52.7 | 0 | 0 | 0 | 0 | 113.9 | A88 M89 C90 R94 L175 T257 Q261 | A88-V92 WeakPolarHBondContact O-CG2 3.41Å; A88-V92 PolarHBondContact O-N 3.39Å; M89-V92 HydrophobicContact CE-CG2 4.03Å; M89-V92 HydrophobicContact SD-CG2 4.39Å; C90-V92 VanDerWaalsContact C-N 3.31Å; C90-V92 PolarHBondContact O-N 2.79Å; V92-R94 VanDerWaalsContact C-N 3.3Å; V92-R94 HydrophobicContact CG2-CB 4.07Å; V92-R94 HydrophobicContact CG2-CG 3.71Å; V92-R94 PolarHBondContact O-N 3.01Å; V92-L175 HydrophobicContact CG1-CD2 4.44Å; V92-T257 HydrophobicContact CG1-CG2 3.44Å; V92-T257 VanDerWaalsContact CG1-CG2 3.44Å; V92-Q261 HydrophobicContact CG1-CG 4.39Å |
| 93 | G | 96.2 | Very high | 98 | Very high | 66 Ų | 66 | 46.9 Ų | 46.9 | 68% | 0.68 | 25% | 0.249 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 71.4 | 17 | 176 | 0 | 0 | 0 | 0 | 0 | 115.5 | M89 C90 I91 | M89-G93 PolarHBondContact O-N 3.46Å; C90-G93 PolarHBondContact O-N 3.18Å; C90-G93 VanDerWaalsContact O-N 3.09Å; I91-G93 VanDerWaalsContact C-N 3.28Å; I91-G93 PolarHBondContact O-N 3.47Å |
| 94 | R | 95.6 | Very high | 98 | Very high | 206 Ų | 206 | 49 Ų | 49 | 78% | 0.777 | 26% | 0.26 | S | S | * | . | S | Bend | trans | -92.7 | -16.1 | 179.3 | -67.8 | -75.1 | -176.6 | 167.7 | -0.2 | 113.7 | M89 V92 | M89-R94 HydrophobicContact CB-CB 4.28Å; M89-R94 CarbonylContact O-C 3.56Å; M89-R94 WeakPolarHBondContact O-CA 3.45Å; M89-R94 PolarHBondContact O-N 2.81Å; M89-R94 HydrophobicContact SD-CB 3.92Å; M89-R94 HydrophobicContact SD-CG 4.43Å; V92-R94 VanDerWaalsContact C-N 3.3Å; V92-R94 HydrophobicContact CG2-CB 4.07Å; V92-R94 HydrophobicContact CG2-CG 3.71Å; V92-R94 PolarHBondContact O-N 3.01Å |
| 95 | L | 96.4 | Very high | 98 | Very high | 7 Ų | 7 | 54.3 Ų | 54.3 | 4% | 0.037 | 29% | 0.288 | C | S | . | . | S | Bend | trans | -129 | 125.5 | 171.6 | -177.3 | 71.5 | 0 | 0 | 0 | 110.1 | M89 C90 W97 K99 Y103 | M89-L95 HydrophobicContact CB-CB 3.82Å; M89-L95 PolarHBondContact O-N 3.47Å; C90-L95 WeakPolarHBondContact CA-O 3.49Å; C90-L95 PolarHBondContact SG-O 3.02Å; L95-W97 PolarHBondContact O-N 3.18Å; L95-K99 HydrophobicContact CD1-CB 3.93Å; L95-K99 HydrophobicContact CD1-CD 4.02Å; L95-K99 HydrophobicContact CG-CB 4.27Å; L95-Y103 HydrophobicContact CD1-CE1 4.32Å; L95-Y103 HydrophobicContact CD1-CE2 4.13Å; L95-Y103 HydrophobicContact CD2-CD1 4.49Å |
| 96 | P | 97.9 | Very high | 98 | Very high | 70 Ų | 70 | 54.6 Ų | 54.6 | 46% | 0.455 | 29% | 0.29 | S | S | . | . | trans | -58.9 | 130.3 | 172.4 | -24.2 | 33.8 | 0 | 0 | 0 | 111.5 | V98 K99 | P96-V98 HydrophobicContact CB-CG1 4.2Å; P96-V98 PolarHBondContact O-N 3.35Å; P96-V98 VanDerWaalsContact O-N 3.07Å; P96-K99 HydrophobicContact CB-CG 4.47Å; P96-K99 HydrophobicContact CG-CD 4.48Å; P96-K99 WeakPolarHBondContact O-CB 3.5Å; P96-K99 PolarHBondContact O-N 2.94Å | ||
| 97 | W | 98.3 | Very high | 98 | Very high | 148 Ų | 148 | 54.6 Ų | 54.6 | 56% | 0.561 | 29% | 0.29 | S | S | * | . | G | 310 helix | trans | -51.6 | -35.2 | -177.9 | -72.4 | 97.8 | 0 | 0 | 0 | 114.1 | L87 C90 I91 L95 K99 L100 P101 | L87-W97 HydrophobicContact CD1-CH2 3.92Å; L87-W97 HydrophobicContact CD1-CZ3 3.71Å; C90-W97 HydrophobicContact CB-CD2 3.66Å; C90-W97 HydrophobicContact CB-CE3 3.64Å; C90-W97 HydrophobicContact CB-CG 4.38Å; C90-W97 HydrophobicContact CB-CH2 3.74Å; C90-W97 HydrophobicContact CB-CZ2 3.74Å; C90-W97 HydrophobicContact CB-CZ3 3.69Å; I91-W97 HydrophobicContact CG1-CH2 4.06Å; I91-W97 HydrophobicContact CG1-CZ2 4.36Å; L95-W97 PolarHBondContact O-N 3.18Å; W97-K99 PolarHBondContact O-N 3.47Å; W97-L100 HydrophobicContact CE3-CD2 4.07Å; W97-L100 HydrophobicContact CZ3-CD2 4.07Å; W97-L100 VanDerWaalsContact O-CB 3.29Å; W97-L100 WeakPolarHBondContact O-CB 3.29Å; W97-L100 PolarHBondContact O-N 2.97Å; W97-L100 VanDerWaalsContact O-N 3.1Å; W97-P101 WeakPolarHBondContact O-CD 3.37Å |
| 98 | V | 97.7 | Very high | 98 | Very high | 115 Ų | 115 | 55.2 Ų | 55.2 | 70% | 0.697 | 29% | 0.294 | S | S | * | . | G | 310 helix | trans | -61.1 | -24.7 | 177 | 70 | 0 | 0 | 0 | 0 | 113.6 | P96 | P96-V98 HydrophobicContact CB-CG1 4.2Å; P96-V98 PolarHBondContact O-N 3.35Å; P96-V98 VanDerWaalsContact O-N 3.07Å |
| 99 | K | 97.7 | Very high | 98 | Very high | 38 Ų | 38 | 59.4 Ų | 59.4 | 17% | 0.165 | 32% | 0.316 | C | S | . | . | G | 310 helix | trans | -83.2 | -21.4 | 178 | -66.1 | -169.8 | 177.9 | -176.6 | 0 | 113.1 | L20 L95 P96 W97 I102 Y103 | L20-K99 HydrophobicContact CD1-CD 4.16Å; L20-K99 HydrophobicContact CD1-CG 4.25Å; L95-K99 HydrophobicContact CD1-CB 3.93Å; L95-K99 HydrophobicContact CD1-CD 4.02Å; L95-K99 HydrophobicContact CG-CB 4.27Å; P96-K99 HydrophobicContact CB-CG 4.47Å; P96-K99 HydrophobicContact CG-CD 4.48Å; P96-K99 WeakPolarHBondContact O-CB 3.5Å; P96-K99 PolarHBondContact O-N 2.94Å; W97-K99 PolarHBondContact O-N 3.47Å; K99-I102 WeakPolarHBondContact O-CB 3.36Å; K99-I102 PolarHBondContact O-N 3.43Å; K99-I102 VanDerWaalsContact O-N 3.15Å; K99-Y103 HydrophobicContact CB-CD2 4.17Å; K99-Y103 HydrophobicContact CB-CE2 4.18Å; K99-Y103 HydrophobicContact CD-CE2 4.35Å; K99-Y103 WeakPolarHBondContact O-CD2 3.47Å; K99-Y103 PolarHBondContact O-N 3.45Å |
| 100 | L | 98.3 | Very high | 98 | Very high | 22 Ų | 22 | 58.8 Ų | 58.8 | 12% | 0.115 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -53.8 | -53 | -176.7 | -176.5 | 61 | 0 | 0 | 0 | 113.4 | L87 W97 I102 Y103 I104 | L87-L100 HydrophobicContact CD1-CD2 4.08Å; W97-L100 HydrophobicContact CE3-CD2 4.07Å; W97-L100 HydrophobicContact CZ3-CD2 4.07Å; W97-L100 VanDerWaalsContact O-CB 3.29Å; W97-L100 WeakPolarHBondContact O-CB 3.29Å; W97-L100 PolarHBondContact O-N 2.97Å; W97-L100 VanDerWaalsContact O-N 3.1Å; L100-I102 PolarHBondContact O-N 2.67Å; L100-Y103 PolarHBondContact O-N 3.35Å; L100-I104 HydrophobicContact CD1-CD1 3.91Å; L100-I104 HydrophobicContact CD1-CG1 4.2Å; L100-I104 HydrophobicContact CG-CD1 3.93Å; L100-I104 WeakPolarHBondContact O-CG1 3.35Å; L100-I104 PolarHBondContact O-N 3.32Å |
| 101 | P | 98.4 | Very high | 98 | Very high | 83 Ų | 83 | 58.7 Ų | 58.7 | 54% | 0.539 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -62.6 | -32.1 | -179.9 | 23.7 | -34.3 | 0 | 0 | 0 | 112.8 | W97 L105 | W97-P101 WeakPolarHBondContact O-CD 3.37Å; P101-L105 WeakPolarHBondContact O-CB 3.3Å; P101-L105 PolarHBondContact O-N 2.98Å |
| 102 | I | 98.3 | Very high | 98.1 | Very high | 65 Ų | 65 | 58.8 Ų | 58.8 | 33% | 0.333 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -69.3 | -44.6 | 178.2 | -54 | 179.9 | 0 | 0 | 0 | 110.4 | L20 K99 L100 L105 V106 | L20-I102 HydrophobicContact CD1-CG2 4.39Å; L20-I102 HydrophobicContact CD2-CD1 3.81Å; K99-I102 WeakPolarHBondContact O-CB 3.36Å; K99-I102 PolarHBondContact O-N 3.43Å; K99-I102 VanDerWaalsContact O-N 3.15Å; L100-I102 PolarHBondContact O-N 2.67Å; I102-L105 PolarHBondContact O-N 3.19Å; I102-V106 WeakPolarHBondContact O-CB 3.24Å; I102-V106 VanDerWaalsContact O-CG2 3.26Å; I102-V106 WeakPolarHBondContact O-CG2 3.27Å; I102-V106 PolarHBondContact O-N 3.34Å |
| 103 | Y | 98.4 | Very high | 98.2 | Very high | 1 Ų | 1 | 59.4 Ų | 59.4 | 0% | 0.004 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -59.9 | -48.3 | 175.6 | -89.6 | -125 | 0 | 0 | 0 | 110.9 | L20 Q23 E27 H80 L95 K99 L100 L105 V106 Q107 | L20-Y103 HydrophobicContact CD1-CE2 4.39Å; Q23-Y103 HydrophobicContact CB-CE2 4.24Å; Q23-Y103 WeakPolarHBondContact CB-OH 3.32Å; Q23-Y103 PolarHBondContact NE2-OH 2.83Å; E27-Y103 HydrophobicContact CG-CD1 3.73Å; E27-Y103 HydrophobicContact CG-CE1 3.75Å; E27-Y103 HydrophobicContact CG-CG 4.43Å; H80-Y103 HydrophobicContact CB-CD1 4.25Å; H80-Y103 HydrophobicContact CB-CE1 4.39Å; H80-Y103 AromaticContact CE1-CE1 3.96Å; H80-Y103 AromaticContact CG-CE1 3.88Å; H80-Y103 AromaticContact ND1-CD1 3.66Å; H80-Y103 AromaticContact ND1-CE1 3.64Å; L95-Y103 HydrophobicContact CD1-CE1 4.32Å; L95-Y103 HydrophobicContact CD1-CE2 4.13Å; L95-Y103 HydrophobicContact CD2-CD1 4.49Å; K99-Y103 HydrophobicContact CB-CD2 4.17Å; K99-Y103 HydrophobicContact CB-CE2 4.18Å; K99-Y103 HydrophobicContact CD-CE2 4.35Å; K99-Y103 WeakPolarHBondContact O-CD2 3.47Å; K99-Y103 PolarHBondContact O-N 3.45Å; L100-Y103 PolarHBondContact O-N 3.35Å; Y103-L105 PolarHBondContact O-N 3.12Å; Y103-V106 PolarHBondContact O-N 3.39Å; Y103-Q107 WeakPolarHBondContact O-CB 3.35Å; Y103-Q107 VanDerWaalsContact O-CD 3.27Å; Y103-Q107 WeakPolarHBondContact O-CG 3.2Å; Y103-Q107 PolarHBondContact O-N 3.45Å |
| 104 | I | 98.7 | Very high | 98.3 | Very high | 47 Ų | 47 | 56.2 Ų | 56.2 | 24% | 0.241 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -59.9 | -46 | -179.8 | -66.7 | 176.6 | 0 | 0 | 0 | 111.1 | P83 L100 V106 Q107 L108 | P83-I104 HydrophobicContact CB-CD1 4.15Å; P83-I104 HydrophobicContact CB-CG1 3.83Å; P83-I104 HydrophobicContact CG-CG1 4.16Å; P83-I104 HydrophobicContact CG-CG2 4.27Å; L100-I104 HydrophobicContact CD1-CD1 3.91Å; L100-I104 HydrophobicContact CD1-CG1 4.2Å; L100-I104 HydrophobicContact CG-CD1 3.93Å; L100-I104 WeakPolarHBondContact O-CG1 3.35Å; L100-I104 PolarHBondContact O-N 3.32Å; I104-V106 PolarHBondContact O-N 2.86Å; I104-Q107 PolarHBondContact O-N 2.94Å; I104-L108 HydrophobicContact CG2-CD1 3.79Å; I104-L108 HydrophobicContact CG2-CG 4.41Å; I104-L108 WeakPolarHBondContact O-CB 3.33Å; I104-L108 WeakPolarHBondContact O-CG 3.24Å; I104-L108 PolarHBondContact O-N 3.39Å |
| 105 | L | 98.7 | Very high | 98.5 | Very high | 112 Ų | 112 | 46.4 Ų | 46.4 | 59% | 0.586 | 25% | 0.246 | S | C | * | . | H | α-helix | trans | -61.1 | -44.5 | 178.9 | -175.7 | 153 | 0 | 0 | 0 | 111.6 | P101 I102 Y103 L108 L109 | P101-L105 WeakPolarHBondContact O-CB 3.3Å; P101-L105 PolarHBondContact O-N 2.98Å; I102-L105 PolarHBondContact O-N 3.19Å; Y103-L105 PolarHBondContact O-N 3.12Å; L105-L108 PolarHBondContact O-N 3.45Å; L105-L109 WeakPolarHBondContact O-CB 3.43Å; L105-L109 PolarHBondContact O-N 3Å |
| 106 | V | 98.7 | Very high | 98.6 | Very high | 20 Ų | 20 | 47 Ų | 47 | 12% | 0.121 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -66 | -41.3 | 179.2 | 170.3 | 0 | 0 | 0 | 0 | 111.6 | C24 E27 F28 I102 Y103 I104 L109 S110 | C24-V106 HydrophobicContact CB-CG1 4.35Å; C24-V106 HydrophobicContact CB-CG2 3.99Å; C24-V106 VanDerWaalsContact O-CG1 3.25Å; C24-V106 WeakPolarHBondContact O-CG1 3.3Å; E27-V106 HydrophobicContact CB-CG1 4.07Å; F28-V106 HydrophobicContact CB-CG1 3.84Å; F28-V106 HydrophobicContact CD2-CG1 4.34Å; I102-V106 WeakPolarHBondContact O-CB 3.24Å; I102-V106 VanDerWaalsContact O-CG2 3.26Å; I102-V106 WeakPolarHBondContact O-CG2 3.27Å; I102-V106 PolarHBondContact O-N 3.34Å; Y103-V106 PolarHBondContact O-N 3.39Å; I104-V106 PolarHBondContact O-N 2.86Å; V106-L109 PolarHBondContact O-N 3.32Å; V106-S110 VanDerWaalsContact O-CB 3.29Å; V106-S110 WeakPolarHBondContact O-CB 3.14Å; V106-S110 PolarHBondContact O-N 3.42Å |
| 107 | Q | 98.8 | Very high | 98.6 | Very high | 0 Ų | 0 | 45.2 Ų | 45.2 | 0% | 0 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -64 | -44.7 | 176.7 | -68.4 | 158.7 | -1.9 | 0 | 0 | 110.9 | E27 V31 P83 S86 Y103 I104 S110 A111 A216 | E27-Q107 HydrophobicContact CB-CG 4.48Å; E27-Q107 PolarHBondContact OE2-NE2 3.12Å; V31-Q107 WeakPolarHBondContact CG1-O 3.37Å; V31-Q107 HydrophobicContact CG2-CB 4.12Å; V31-Q107 HydrophobicContact CG2-CG 3.91Å; P83-Q107 VanDerWaalsContact N-OE1 3.14Å; S86-Q107 PolarHBondContact OG-NE2 2.78Å; S86-Q107 VanDerWaalsContact OG-NE2 3.15Å; Y103-Q107 WeakPolarHBondContact O-CB 3.35Å; Y103-Q107 VanDerWaalsContact O-CD 3.27Å; Y103-Q107 WeakPolarHBondContact O-CG 3.2Å; Y103-Q107 PolarHBondContact O-N 3.45Å; I104-Q107 PolarHBondContact O-N 2.94Å; Q107-S110 PolarHBondContact O-N 2.93Å; Q107-A111 WeakPolarHBondContact O-CB 3.26Å; Q107-A111 PolarHBondContact O-N 3.5Å; Q107-A216 HydrophobicContact CB-CB 3.73Å |
| 108 | L | 98.9 | Very high | 98.7 | Very high | 41 Ų | 41 | 38.1 Ų | 38.1 | 22% | 0.215 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -61.2 | -47.7 | 176 | -77.8 | 165.9 | 0 | 0 | 0 | 112.1 | I104 L105 S110 A111 F112 A216 L219 | I104-L108 HydrophobicContact CG2-CD1 3.79Å; I104-L108 HydrophobicContact CG2-CG 4.41Å; I104-L108 WeakPolarHBondContact O-CB 3.33Å; I104-L108 WeakPolarHBondContact O-CG 3.24Å; I104-L108 PolarHBondContact O-N 3.39Å; L105-L108 PolarHBondContact O-N 3.45Å; L108-S110 VanDerWaalsContact C-N 3.32Å; L108-S110 PolarHBondContact O-N 3.29Å; L108-A111 PolarHBondContact O-N 3.2Å; L108-F112 WeakPolarHBondContact O-CB 3.4Å; L108-F112 PolarHBondContact O-N 3.1Å; L108-A216 HydrophobicContact CD2-CB 4.27Å; L108-A216 HydrophobicContact CG-CB 4.34Å; L108-L219 HydrophobicContact CD2-CB 3.85Å; L108-L219 HydrophobicContact CD2-CD2 4.01Å; L108-L219 HydrophobicContact CD2-CG 4.05Å |
| 109 | L | 98.9 | Very high | 98.7 | Very high | 89 Ų | 89 | 35.2 Ų | 35.2 | 47% | 0.466 | 19% | 0.194 | S | C | . | . | H | α-helix | trans | -61.8 | -42.6 | 178.8 | -179.2 | 65.2 | 0 | 0 | 0 | 111.2 | F28 L105 V106 F112 C113 | F28-L109 HydrophobicContact CE2-CD2 4.15Å; F28-L109 HydrophobicContact CE2-CG 4.01Å; L105-L109 WeakPolarHBondContact O-CB 3.43Å; L105-L109 PolarHBondContact O-N 3Å; V106-L109 PolarHBondContact O-N 3.32Å; L109-F112 WeakPolarHBondContact O-CB 3.25Å; L109-F112 PolarHBondContact O-N 2.94Å; L109-C113 PolarHBondContact O-N 3.27Å; L109-C113 PolarHBondContact O-SG 2.95Å |
| 110 | S | 98.9 | Very high | 98.8 | Very high | 0 Ų | 0 | 38.5 Ų | 38.5 | 0% | 0 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -62.4 | -47 | 177.2 | 176.8 | 0 | 0 | 0 | 0 | 112.4 | F28 V31 F32 V106 Q107 L108 F112 C113 A114 | F28-S110 WeakPolarHBondContact O-CB 3.46Å; F28-S110 PolarHBondContact O-OG 3.37Å; V31-S110 WeakPolarHBondContact CB-OG 3.4Å; F32-S110 WeakPolarHBondContact CA-OG 3.4Å; F32-S110 WeakPolarHBondContact CB-OG 3.26Å; F32-S110 PolarHBondContact N-OG 3.28Å; V106-S110 VanDerWaalsContact O-CB 3.29Å; V106-S110 WeakPolarHBondContact O-CB 3.14Å; V106-S110 PolarHBondContact O-N 3.42Å; Q107-S110 PolarHBondContact O-N 2.93Å; L108-S110 VanDerWaalsContact C-N 3.32Å; L108-S110 PolarHBondContact O-N 3.29Å; S110-F112 VanDerWaalsContact C-N 3.3Å; S110-F112 PolarHBondContact O-N 3.19Å; S110-C113 PolarHBondContact O-N 3.43Å; S110-A114 WeakPolarHBondContact O-CB 3.38Å; S110-A114 PolarHBondContact O-N 3.44Å |
| 111 | A | 98.9 | Very high | 98.8 | Very high | 0 Ų | 0 | 43.1 Ų | 43.1 | 0% | 0 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -63.6 | -37.2 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | V31 M35 Q107 L108 S115 A216 P221 | V31-A111 HydrophobicContact CG1-CB 3.87Å; M35-A111 HydrophobicContact CG-CB 3.8Å; M35-A111 HydrophobicContact SD-CB 4.48Å; Q107-A111 WeakPolarHBondContact O-CB 3.26Å; Q107-A111 PolarHBondContact O-N 3.5Å; L108-A111 PolarHBondContact O-N 3.2Å; A111-S115 PolarHBondContact O-N 2.83Å; A111-S115 PolarHBondContact O-OG 3.1Å; A111-A216 VanDerWaalsContact CB-O 3.24Å; A111-A216 WeakPolarHBondContact CB-O 3.46Å; A111-P221 HydrophobicContact CB-CG 4.26Å |
| 112 | F | 98.9 | Very high | 98.8 | Very high | 69 Ų | 69 | 41 Ų | 41 | 30% | 0.303 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -60.5 | -49.7 | 171.1 | -179.1 | -82.4 | 0 | 0 | 0 | 111.7 | L108 L109 S110 A114 S115 G116 G220 L223 F224 V227 | L108-F112 WeakPolarHBondContact O-CB 3.4Å; L108-F112 PolarHBondContact O-N 3.1Å; L109-F112 WeakPolarHBondContact O-CB 3.25Å; L109-F112 PolarHBondContact O-N 2.94Å; S110-F112 VanDerWaalsContact C-N 3.3Å; S110-F112 PolarHBondContact O-N 3.19Å; F112-A114 PolarHBondContact O-N 3.15Å; F112-S115 VanDerWaalsContact O-CB 3.31Å; F112-S115 WeakPolarHBondContact O-CB 3.48Å; F112-S115 PolarHBondContact O-N 2.97Å; F112-G116 PolarHBondContact O-N 3.09Å; F112-G116 VanDerWaalsContact O-N 3.14Å; F112-G220 WeakPolarHBondContact CD2-O 3.39Å; F112-L223 HydrophobicContact CD2-CB 4.08Å; F112-L223 HydrophobicContact CE2-CB 4.3Å; F112-F224 HydrophobicContact CD2-CB 3.76Å; F112-F224 HydrophobicContact CE1-CD2 4.48Å; F112-F224 VanDerWaalsContact CE2-CA 3.42Å; F112-F224 HydrophobicContact CE2-CB 3.81Å; F112-F224 HydrophobicContact CE2-CD2 4.46Å; F112-F224 HydrophobicContact CG-CB 4.35Å; F112-F224 HydrophobicContact CZ-CB 4.42Å; F112-F224 HydrophobicContact CZ-CD2 4.25Å; F112-V227 HydrophobicContact CE2-CG2 4.2Å; F112-V227 HydrophobicContact CZ-CG2 4.08Å |
| 113 | C | 98.9 | Very high | 98.8 | Very high | 48 Ų | 48 | 43.2 Ų | 43.2 | 32% | 0.324 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -64.2 | -40.4 | 179.1 | -69.5 | 0 | 0 | 0 | 0 | 112.9 | F28 F32 L109 S110 S115 G116 A117 | F28-C113 HydrophobicContact CZ-CB 4.12Å; F32-C113 HydrophobicContact CD2-CB 4.38Å; F32-C113 HydrophobicContact CE2-CB 4.31Å; L109-C113 PolarHBondContact O-N 3.27Å; L109-C113 PolarHBondContact O-SG 2.95Å; S110-C113 PolarHBondContact O-N 3.43Å; C113-S115 PolarHBondContact O-N 3.37Å; C113-G116 PolarHBondContact O-N 2.95Å; C113-A117 PolarHBondContact O-N 3.14Å |
| 114 | A | 98.9 | Very high | 98.9 | Very high | 0 Ų | 0 | 49.3 Ų | 49.3 | 0% | 0 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -62.7 | -34.4 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | F32 M35 S110 F112 A117 T118 | F32-A114 HydrophobicContact CD2-CB 3.76Å; F32-A114 HydrophobicContact CE2-CB 4.09Å; F32-A114 HydrophobicContact CG-CB 4.15Å; M35-A114 HydrophobicContact CB-CB 3.52Å; S110-A114 WeakPolarHBondContact O-CB 3.38Å; S110-A114 PolarHBondContact O-N 3.44Å; F112-A114 PolarHBondContact O-N 3.15Å; A114-A117 WeakPolarHBondContact O-CB 3.38Å; A114-A117 PolarHBondContact O-N 2.87Å; A114-T118 PolarHBondContact O-N 2.69Å; A114-T118 PolarHBondContact O-OG1 3.28Å; A114-T118 VanDerWaalsContact O-OG1 3.06Å |
| 115 | S | 98.9 | Very high | 98.9 | Very high | 0 Ų | 0 | 48.7 Ų | 48.7 | 0% | 0 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -64.1 | -42.7 | 173.7 | -53.6 | 0 | 0 | 0 | 0 | 111.7 | Q39 A111 F112 C113 A117 T118 Y119 F146 P221 | Q39-S115 PolarHBondContact NE2-OG 3.03Å; A111-S115 PolarHBondContact O-N 2.83Å; A111-S115 PolarHBondContact O-OG 3.1Å; F112-S115 VanDerWaalsContact O-CB 3.31Å; F112-S115 WeakPolarHBondContact O-CB 3.48Å; F112-S115 PolarHBondContact O-N 2.97Å; C113-S115 PolarHBondContact O-N 3.37Å; S115-A117 VanDerWaalsContact C-N 3.32Å; S115-A117 PolarHBondContact O-N 3.44Å; S115-T118 PolarHBondContact O-N 2.92Å; S115-Y119 WeakPolarHBondContact O-CB 3.41Å; S115-Y119 PolarHBondContact O-N 3.35Å; S115-F146 WeakPolarHBondContact O-CE1 3.44Å; S115-P221 VanDerWaalsContact OG-CA 3.26Å; S115-P221 WeakPolarHBondContact OG-CA 3.36Å; S115-P221 WeakPolarHBondContact OG-CB 3.15Å; S115-P221 WeakPolarHBondContact OG-CG 3.23Å |
| 116 | G | 98.9 | Very high | 98.9 | Very high | 20 Ų | 20 | 43.7 Ų | 43.7 | 21% | 0.206 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -59.3 | -42.2 | 171 | 0 | 0 | 0 | 0 | 0 | 112.8 | F112 C113 Y119 V120 F224 | F112-G116 PolarHBondContact O-N 3.09Å; F112-G116 VanDerWaalsContact O-N 3.14Å; C113-G116 PolarHBondContact O-N 2.95Å; G116-Y119 PolarHBondContact O-N 3.26Å; G116-V120 WeakPolarHBondContact O-CG2 3.31Å; G116-V120 PolarHBondContact O-N 3.2Å; G116-F224 VanDerWaalsContact CA-CE2 3.43Å |
| 117 | A | 98.9 | Very high | 98.9 | Very high | 31 Ų | 31 | 46.8 Ų | 46.8 | 26% | 0.256 | 25% | 0.25 | S | C | . | . | H | α-helix | trans | -64.4 | -43.9 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | F32 L36 C113 A114 S115 V120 L121 | F32-A117 HydrophobicContact CE2-CB 4.2Å; F32-A117 HydrophobicContact CZ-CB 3.72Å; L36-A117 HydrophobicContact CD1-CB 4.11Å; C113-A117 PolarHBondContact O-N 3.14Å; A114-A117 WeakPolarHBondContact O-CB 3.38Å; A114-A117 PolarHBondContact O-N 2.87Å; S115-A117 VanDerWaalsContact C-N 3.32Å; S115-A117 PolarHBondContact O-N 3.44Å; A117-V120 PolarHBondContact O-N 3.33Å; A117-L121 VanDerWaalsContact O-CB 3.28Å; A117-L121 WeakPolarHBondContact O-CB 3.33Å; A117-L121 PolarHBondContact O-N 3.46Å |
| 118 | T | 98.9 | Very high | 98.9 | Very high | 0 Ų | 0 | 53.3 Ų | 53.3 | 0% | 0 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -60.8 | -44.8 | 174.5 | -57.7 | 0 | 0 | 0 | 0 | 111.2 | Q39 A43 A114 S115 V120 L121 Y122 F146 | Q39-T118 HydrophobicContact CB-CG2 3.79Å; Q39-T118 PolarHBondContact OE1-OG1 3.06Å; A43-T118 HydrophobicContact CB-CG2 4.41Å; A114-T118 PolarHBondContact O-N 2.69Å; A114-T118 PolarHBondContact O-OG1 3.28Å; A114-T118 VanDerWaalsContact O-OG1 3.06Å; S115-T118 PolarHBondContact O-N 2.92Å; T118-V120 PolarHBondContact O-N 3.48Å; T118-L121 PolarHBondContact O-N 2.88Å; T118-Y122 HydrophobicContact CG2-CD2 4.13Å; T118-Y122 PolarHBondContact O-N 3.18Å; T118-F146 HydrophobicContact CG2-CE1 4.28Å |
| 119 | Y | 98.9 | Very high | 98.9 | Very high | 53 Ų | 53 | 53.6 Ų | 53.6 | 21% | 0.208 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -58.7 | -46.4 | 177.9 | 178.5 | -90.3 | 0 | 0 | 0 | 111.8 | S115 G116 Y122 Y123 L126 F146 F224 W230 | S115-Y119 WeakPolarHBondContact O-CB 3.41Å; S115-Y119 PolarHBondContact O-N 3.35Å; G116-Y119 PolarHBondContact O-N 3.26Å; Y119-Y122 CarbonylContact O-C 3.55Å; Y119-Y122 PolarHBondContact O-N 3.41Å; Y119-Y123 HydrophobicContact CD1-CD2 4.49Å; Y119-Y123 AromaticContact CE1-CD2 3.74Å; Y119-Y123 HydrophobicContact CE1-CD2 3.74Å; Y119-Y123 HydrophobicContact CE1-CE2 4.14Å; Y119-Y123 WeakPolarHBondContact O-CA 3.47Å; Y119-Y123 PolarHBondContact O-N 2.75Å; Y119-L126 HydrophobicContact CD2-CD1 3.93Å; Y119-L126 HydrophobicContact CE2-CD1 4.27Å; Y119-F146 HydrophobicContact CD2-CZ 4.16Å; Y119-F224 VanDerWaalsContact CB-CZ 3.49Å; Y119-F224 HydrophobicContact CD1-CZ 4.28Å; Y119-F224 HydrophobicContact CD2-CE1 4.14Å; Y119-F224 HydrophobicContact CD2-CZ 4.14Å; Y119-F224 HydrophobicContact CG-CE1 4.07Å; Y119-F224 AromaticContact CG-CZ 3.72Å; Y119-F224 HydrophobicContact CG-CZ 3.72Å; Y119-W230 AromaticContact CD2-CH2 3.83Å; Y119-W230 HydrophobicContact CD2-CH2 3.83Å; Y119-W230 AromaticContact CD2-CZ3 3.99Å; Y119-W230 HydrophobicContact CD2-CZ3 3.99Å; Y119-W230 AromaticContact CE2-CH2 3.77Å; Y119-W230 HydrophobicContact CE2-CH2 3.77Å; Y119-W230 AromaticContact CE2-CZ3 3.85Å; Y119-W230 HydrophobicContact CE2-CZ3 3.85Å |
| 120 | V | 98.9 | Very high | 98.8 | Very high | 107 Ų | 107 | 50 Ų | 50 | 65% | 0.648 | 27% | 0.265 | S | S | * | . | H | α-helix | trans | -65.4 | -43.9 | 176.7 | 172 | 0 | 0 | 0 | 0 | 111.2 | G116 A117 T118 Y122 Y123 | G116-V120 WeakPolarHBondContact O-CG2 3.31Å; G116-V120 PolarHBondContact O-N 3.2Å; A117-V120 PolarHBondContact O-N 3.33Å; T118-V120 PolarHBondContact O-N 3.48Å; V120-Y122 VanDerWaalsContact C-N 3.27Å; V120-Y122 PolarHBondContact O-N 2.85Å; V120-Y123 WeakPolarHBondContact O-CB 3.23Å; V120-Y123 PolarHBondContact O-N 3.32Å |
| 121 | L | 98.9 | Very high | 98.8 | Very high | 119 Ų | 119 | 53 Ų | 53 | 62% | 0.623 | 30% | 0.296 | S | S | * | . | H | α-helix | trans | -60.6 | -36.8 | 179.9 | 179.4 | 61.7 | 0 | 0 | 0 | 112.4 | A117 T118 | A117-L121 VanDerWaalsContact O-CB 3.28Å; A117-L121 WeakPolarHBondContact O-CB 3.33Å; A117-L121 PolarHBondContact O-N 3.46Å; T118-L121 PolarHBondContact O-N 2.88Å |
| 122 | Y | 98.8 | Very high | 98.7 | Very high | 40 Ų | 40 | 54.8 Ų | 54.8 | 16% | 0.157 | 31% | 0.314 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -103.5 | 14.6 | -178.9 | -77 | -94.4 | 0 | 0 | 0 | 113.6 | G40 A43 Q44 T118 Y119 V120 D124 A125 L126 | G40-Y122 PolarHBondContact O-OH 2.93Å; G40-Y122 VanDerWaalsContact O-OH 3.08Å; A43-Y122 HydrophobicContact CB-CD1 3.61Å; A43-Y122 HydrophobicContact CB-CD2 3.73Å; A43-Y122 HydrophobicContact CB-CE1 3.79Å; A43-Y122 HydrophobicContact CB-CE2 3.9Å; A43-Y122 HydrophobicContact CB-CG 3.59Å; Q44-Y122 HydrophobicContact CB-CE1 4.24Å; T118-Y122 HydrophobicContact CG2-CD2 4.13Å; T118-Y122 PolarHBondContact O-N 3.18Å; Y119-Y122 CarbonylContact O-C 3.55Å; Y119-Y122 PolarHBondContact O-N 3.41Å; V120-Y122 VanDerWaalsContact C-N 3.27Å; V120-Y122 PolarHBondContact O-N 2.85Å; Y122-D124 PolarHBondContact O-N 2.97Å; Y122-A125 HydrophobicContact CD1-CB 4.16Å; Y122-A125 PolarHBondContact O-N 3.31Å; Y122-A125 VanDerWaalsContact O-N 3.09Å; Y122-L126 WeakPolarHBondContact O-CB 3.47Å; Y122-L126 WeakPolarHBondContact O-CG 3.25Å; Y122-L126 PolarHBondContact O-N 2.9Å |
| 123 | Y | 98.8 | Very high | 98.7 | Very high | 111 Ų | 111 | 56.6 Ų | 56.6 | 44% | 0.435 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -53.8 | -52.7 | -171.7 | -178.1 | -94.7 | 0 | 0 | 0 | 112.9 | Y119 V120 A125 L126 Q127 | Y119-Y123 HydrophobicContact CD1-CD2 4.49Å; Y119-Y123 AromaticContact CE1-CD2 3.74Å; Y119-Y123 HydrophobicContact CE1-CD2 3.74Å; Y119-Y123 HydrophobicContact CE1-CE2 4.14Å; Y119-Y123 WeakPolarHBondContact O-CA 3.47Å; Y119-Y123 PolarHBondContact O-N 2.75Å; V120-Y123 WeakPolarHBondContact O-CB 3.23Å; V120-Y123 PolarHBondContact O-N 3.32Å; Y123-A125 VanDerWaalsContact C-N 3.33Å; Y123-A125 PolarHBondContact O-N 2.97Å; Y123-L126 PolarHBondContact O-N 3.41Å; Y123-Q127 WeakPolarHBondContact O-CB 3.27Å; Y123-Q127 PolarHBondContact O-N 3.27Å |
| 124 | D | 98.8 | Very high | 98.7 | Very high | 129 Ų | 129 | 56 Ų | 56 | 69% | 0.69 | 32% | 0.321 | S | S | * | . | H | α-helix | trans | -66.1 | -35.7 | -180 | -68.8 | -15.8 | 0 | 0 | 0 | 112.3 | Y122 Q127 N128 | Y122-D124 PolarHBondContact O-N 2.97Å; D124-Q127 PolarHBondContact O-N 3.11Å; D124-N128 VanDerWaalsContact O-CB 3.24Å; D124-N128 WeakPolarHBondContact O-CB 3.42Å; D124-N128 PolarHBondContact O-N 3.38Å |
| 125 | A | 98.8 | Very high | 98.7 | Very high | 34 Ų | 34 | 57.6 Ų | 57.6 | 28% | 0.281 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -68.7 | -41.5 | 178.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | T47 Y122 Y123 Y129 | T47-A125 HydrophobicContact CG2-CB 4.2Å; Y122-A125 HydrophobicContact CD1-CB 4.16Å; Y122-A125 PolarHBondContact O-N 3.31Å; Y122-A125 VanDerWaalsContact O-N 3.09Å; Y123-A125 VanDerWaalsContact C-N 3.33Å; Y123-A125 PolarHBondContact O-N 2.97Å; A125-Y129 VanDerWaalsContact O-CB 3.24Å; A125-Y129 WeakPolarHBondContact O-CB 3.43Å; A125-Y129 PolarHBondContact O-N 3.19Å |
| 126 | L | 98.8 | Very high | 98.7 | Very high | 6 Ų | 6 | 57.8 Ų | 57.8 | 3% | 0.031 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -61.9 | -47.4 | 172.2 | -77.8 | 167 | 0 | 0 | 0 | 110.6 | T47 Y119 Y122 Y123 N128 Y129 T130 T142 I145 | T47-L126 HydrophobicContact CG2-CD2 3.98Å; T47-L126 HydrophobicContact CG2-CG 4.21Å; Y119-L126 HydrophobicContact CD2-CD1 3.93Å; Y119-L126 HydrophobicContact CE2-CD1 4.27Å; Y122-L126 WeakPolarHBondContact O-CB 3.47Å; Y122-L126 WeakPolarHBondContact O-CG 3.25Å; Y122-L126 PolarHBondContact O-N 2.9Å; Y123-L126 PolarHBondContact O-N 3.41Å; L126-N128 PolarHBondContact O-N 3.29Å; L126-Y129 PolarHBondContact O-N 2.88Å; L126-T130 WeakPolarHBondContact O-CB 3.23Å; L126-T130 WeakPolarHBondContact O-CG2 3.39Å; L126-T130 PolarHBondContact O-N 3.41Å; L126-T130 PolarHBondContact O-OG1 2.84Å; L126-T142 HydrophobicContact CD2-CG2 3.92Å; L126-I145 HydrophobicContact CD2-CD1 3.72Å |
| 127 | Q | 98.7 | Very high | 98.6 | Very high | 86 Ų | 86 | 60.7 Ų | 60.7 | 40% | 0.402 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -61.9 | -44.5 | 179.8 | -170.6 | 63.3 | 18 | 0 | 0 | 111.5 | Y123 D124 G131 | Y123-Q127 WeakPolarHBondContact O-CB 3.27Å; Y123-Q127 PolarHBondContact O-N 3.27Å; D124-Q127 PolarHBondContact O-N 3.11Å; Q127-G131 VanDerWaalsContact O-CA 3.28Å; Q127-G131 WeakPolarHBondContact O-CA 3.14Å; Q127-G131 PolarHBondContact O-N 2.89Å |
| 128 | N | 98.7 | Very high | 98.6 | Very high | 136 Ų | 136 | 61.5 Ų | 61.5 | 73% | 0.727 | 36% | 0.357 | S | S | * | . | H | α-helix | trans | -63.9 | -43.1 | 176.7 | 179 | 74.7 | 0 | 0 | 0 | 112.3 | D124 L126 | D124-N128 VanDerWaalsContact O-CB 3.24Å; D124-N128 WeakPolarHBondContact O-CB 3.42Å; D124-N128 PolarHBondContact O-N 3.38Å; L126-N128 PolarHBondContact O-N 3.29Å |
| 129 | Y | 98.7 | Very high | 98.5 | Very high | 47 Ų | 47 | 67.8 Ų | 67.8 | 18% | 0.184 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -68.6 | -44.6 | -178.6 | -179.3 | -101.9 | 0 | 0 | 0 | 112.5 | V46 A125 L126 K140 T142 | V46-Y129 HydrophobicContact CG1-CD1 4.39Å; V46-Y129 HydrophobicContact CG1-CE1 3.85Å; V46-Y129 WeakPolarHBondContact O-CE2 3.11Å; A125-Y129 VanDerWaalsContact O-CB 3.24Å; A125-Y129 WeakPolarHBondContact O-CB 3.43Å; A125-Y129 PolarHBondContact O-N 3.19Å; L126-Y129 PolarHBondContact O-N 2.88Å; Y129-K140 HydrophobicContact CE1-CB 4.11Å; Y129-K140 HydrophobicContact CE1-CG 4.4Å; Y129-K140 PolarHBondContact O-NZ 3.43Å; Y129-T142 HydrophobicContact CD1-CG2 3.78Å; Y129-T142 HydrophobicContact CE1-CG2 3.91Å |
| 130 | T | 98.4 | Very high | 98.5 | Very high | 13 Ų | 13 | 70.6 Ų | 70.6 | 8% | 0.08 | 41% | 0.411 | C | S | . | . | H | α-helix | trans | -91.8 | -20.6 | -172 | 63.8 | 0 | 0 | 0 | 0 | 114.1 | L126 G132 N133 L134 T142 | L126-T130 WeakPolarHBondContact O-CB 3.23Å; L126-T130 WeakPolarHBondContact O-CG2 3.39Å; L126-T130 PolarHBondContact O-N 3.41Å; L126-T130 PolarHBondContact O-OG1 2.84Å; T130-G132 PolarHBondContact O-N 3.38Å; T130-G132 PolarHBondContact OG1-N 3.21Å; T130-G132 VanDerWaalsContact OG1-N 3.08Å; T130-N133 WeakPolarHBondContact CB-O 3.38Å; T130-N133 PolarHBondContact O-N 3.38Å; T130-L134 HydrophobicContact CG2-CD2 4.33Å; T130-T142 HydrophobicContact CG2-CG2 3.56Å |
| 131 | G | 98.1 | Very high | 98.5 | Very high | 64 Ų | 64 | 67.7 Ų | 67.7 | 66% | 0.66 | 39% | 0.39 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 64.6 | 22.2 | -166.9 | 0 | 0 | 0 | 0 | 0 | 113.1 | Q127 | Q127-G131 VanDerWaalsContact O-CA 3.28Å; Q127-G131 WeakPolarHBondContact O-CA 3.14Å; Q127-G131 PolarHBondContact O-N 2.89Å |
| 132 | G | 97.2 | Very high | 98.5 | Very high | 37 Ų | 37 | 62 Ų | 62 | 38% | 0.381 | 36% | 0.361 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 86.6 | -0.2 | -175.1 | 0 | 0 | 0 | 0 | 0 | 115 | T130 L134 | T130-G132 PolarHBondContact O-N 3.38Å; T130-G132 PolarHBondContact OG1-N 3.21Å; T130-G132 VanDerWaalsContact OG1-N 3.08Å; G132-L134 PolarHBondContact O-N 2.98Å |
| 133 | N | 98.4 | Very high | 98.5 | Very high | 108 Ų | 108 | 60.1 Ų | 60.1 | 58% | 0.578 | 35% | 0.353 | S | S | * | . | trans | -93.5 | 97 | 179.3 | -172.2 | 30.3 | 0 | 0 | 0 | 111.9 | T130 T135 | T130-N133 WeakPolarHBondContact CB-O 3.38Å; T130-N133 PolarHBondContact O-N 3.38Å; N133-T135 WeakPolarHBondContact ND2-CG2 3.28Å; N133-T135 PolarHBondContact O-N 3.01Å | ||
| 134 | L | 98.8 | Very high | 98.5 | Very high | 35 Ų | 35 | 56.2 Ų | 56.2 | 18% | 0.183 | 34% | 0.342 | C | S | . | . | trans | -83.5 | 103.3 | -178.8 | -57.5 | -177.5 | 0 | 0 | 0 | 110.8 | T130 G132 W230 | T130-L134 HydrophobicContact CG2-CD2 4.33Å; G132-L134 PolarHBondContact O-N 2.98Å; L134-W230 HydrophobicContact CB-CD2 3.96Å; L134-W230 HydrophobicContact CB-CE3 4.49Å; L134-W230 HydrophobicContact CB-CG 4.15Å; L134-W230 HydrophobicContact CB-CZ2 4.28Å; L134-W230 HydrophobicContact CD1-CD2 4.25Å; L134-W230 HydrophobicContact CD1-CE3 3.96Å; L134-W230 HydrophobicContact CD1-CH2 3.95Å; L134-W230 HydrophobicContact CD1-CZ2 4.24Å; L134-W230 HydrophobicContact CD1-CZ3 3.8Å; L134-W230 HydrophobicContact CD2-CH2 4.06Å; L134-W230 HydrophobicContact CD2-CZ2 3.79Å; L134-W230 HydrophobicContact CG-CH2 4.48Å; L134-W230 HydrophobicContact CG-CZ2 4.32Å | ||
| 135 | T | 98.7 | Very high | 98.5 | Very high | 34 Ų | 34 | 50.1 Ų | 50.1 | 21% | 0.209 | 31% | 0.309 | C | S | . | . | trans | -113.3 | 149.5 | -176.5 | 55.4 | 0 | 0 | 0 | 0 | 111.8 | N133 K140 E141 T142 W230 | N133-T135 WeakPolarHBondContact ND2-CG2 3.28Å; N133-T135 PolarHBondContact O-N 3.01Å; T135-K140 PolarHBondContact OG1-O 2.92Å; T135-E141 WeakPolarHBondContact O-CA 3.26Å; T135-E141 WeakPolarHBondContact OG1-CA 3.48Å; T135-T142 PolarHBondContact O-N 3.47Å; T135-W230 VanDerWaalsContact O-CD1 3.29Å; T135-W230 PolarHBondContact O-NE1 3.43Å | ||
| 136 | V | 98.8 | Very high | 98.5 | Very high | 4 Ų | 4 | 48.5 Ų | 48.5 | 2% | 0.024 | 30% | 0.296 | C | S | . | . | S | Bend | trans | -93 | -28.3 | 178.4 | -177.7 | 0 | 0 | 0 | 0 | 111.9 | E141 A143 Y149 W230 E233 V234 A237 | V136-E141 WeakPolarHBondContact O-CB 3.35Å; V136-A143 HydrophobicContact CB-CB 4.15Å; V136-A143 HydrophobicContact CG1-CB 4.03Å; V136-A143 HydrophobicContact CG2-CB 4.04Å; V136-Y149 HydrophobicContact CG1-CD1 4.26Å; V136-Y149 HydrophobicContact CG1-CE1 3.5Å; V136-W230 HydrophobicContact CG2-CB 3.97Å; V136-W230 HydrophobicContact CG2-CG 4.39Å; V136-E233 HydrophobicContact CB-CB 4.16Å; V136-E233 HydrophobicContact CB-CG 3.84Å; V136-E233 HydrophobicContact CG1-CG 4.21Å; V136-E233 HydrophobicContact CG2-CB 3.79Å; V136-E233 HydrophobicContact CG2-CG 4.07Å; V136-V234 HydrophobicContact CG2-CG1 3.6Å; V136-A237 HydrophobicContact CG1-CB 3.72Å |
| 137 | T | 98.5 | Very high | 98.5 | Very high | 80 Ų | 80 | 48.2 Ų | 48.2 | 49% | 0.491 | 30% | 0.295 | S | S | . | . | S | Bend | trans | -131.3 | 161.2 | 178.9 | 59.9 | 0 | 0 | 0 | 0 | 111.1 | E233 A237 | T137-E233 PolarHBondContact OG1-OE1 3.42Å; T137-A237 HydrophobicContact CG2-CB 4.21Å |
| 138 | G | 98 | Very high | 98.5 | Very high | 49 Ų | 49 | 44.5 Ų | 44.5 | 51% | 0.505 | 28% | 0.278 | S | S | . | . | S | Bend | trans | 101.2 | -179 | -179.9 | 0 | 0 | 0 | 0 | 0 | 114 | K140 E141 | G138-K140 PolarHBondContact O-N 3.06Å; G138-E141 WeakPolarHBondContact O-CG 3.3Å; G138-E141 PolarHBondContact O-N 2.88Å |
| 139 | P | 97.4 | Very high | 98.5 | Very high | 132 Ų | 132 | 39.7 Ų | 39.7 | 86% | 0.857 | 25% | 0.25 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -72.1 | -13.9 | -167.1 | 28.6 | -36.6 | 0 | 0 | 0 | 114.7 | ||
| 140 | K | 98.1 | Very high | 98.5 | Very high | 111 Ų | 111 | 38.4 Ų | 38.4 | 48% | 0.483 | 25% | 0.247 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -123.9 | 25.8 | 177.5 | -70.2 | -166.5 | 166.7 | -158.2 | 0 | 111.9 | Y129 T135 G138 | Y129-K140 HydrophobicContact CE1-CB 4.11Å; Y129-K140 HydrophobicContact CE1-CG 4.4Å; Y129-K140 PolarHBondContact O-NZ 3.43Å; T135-K140 PolarHBondContact OG1-O 2.92Å; G138-K140 PolarHBondContact O-N 3.06Å |
| 141 | E | 98.6 | Very high | 98.5 | Very high | 46 Ų | 46 | 38.7 Ų | 38.7 | 22% | 0.215 | 25% | 0.251 | C | S | . | . | trans | -60.6 | 146.9 | 174.4 | 74.4 | 80.1 | -170.9 | 0 | 0 | 110.6 | T135 V136 G138 A143 S144 | T135-E141 WeakPolarHBondContact O-CA 3.26Å; T135-E141 WeakPolarHBondContact OG1-CA 3.48Å; V136-E141 WeakPolarHBondContact O-CB 3.35Å; G138-E141 WeakPolarHBondContact O-CG 3.3Å; G138-E141 PolarHBondContact O-N 2.88Å; E141-A143 PolarHBondContact OE2-N 3.39Å; E141-S144 VanDerWaalsContact CD-OG 3.25Å; E141-S144 WeakPolarHBondContact OE1-CB 3.44Å; E141-S144 PolarHBondContact OE1-OG 3.19Å; E141-S144 WeakPolarHBondContact OE2-CB 3.15Å; E141-S144 PolarHBondContact OE2-N 3.13Å; E141-S144 PolarHBondContact OE2-OG 3.42Å | ||
| 142 | T | 98.9 | Very high | 98.5 | Very high | 0 Ų | 0 | 42.6 Ų | 42.6 | 0% | 0 | 27% | 0.265 | C | S | . | . | trans | -133.4 | 0.9 | -179.2 | 44.3 | 0 | 0 | 0 | 0 | 112.5 | V46 L126 Y129 T130 T135 S144 I145 W230 | V46-T142 HydrophobicContact CG1-CG2 4.19Å; L126-T142 HydrophobicContact CD2-CG2 3.92Å; Y129-T142 HydrophobicContact CD1-CG2 3.78Å; Y129-T142 HydrophobicContact CE1-CG2 3.91Å; T130-T142 HydrophobicContact CG2-CG2 3.56Å; T135-T142 PolarHBondContact O-N 3.47Å; T142-S144 PolarHBondContact O-N 2.95Å; T142-I145 HydrophobicContact CG2-CD1 4.12Å; T142-I145 WeakPolarHBondContact O-CB 3.37Å; T142-I145 WeakPolarHBondContact O-CG1 3.26Å; T142-I145 PolarHBondContact O-N 3Å; T142-W230 WeakPolarHBondContact OG1-CZ2 3.42Å; T142-W230 PolarHBondContact OG1-NE1 3.35Å; T142-W230 VanDerWaalsContact OG1-NE1 3.14Å | ||
| 143 | A | 98.9 | Very high | 98.6 | Very high | 0 Ų | 0 | 48.4 Ų | 48.4 | 0% | 0 | 28% | 0.276 | C | S | . | . | G | 310 helix | trans | -68.7 | -29.5 | 179.4 | 0 | 0 | 0 | 0 | 0 | 111.1 | V136 E141 I145 F146 A147 Y149 W230 | V136-A143 HydrophobicContact CB-CB 4.15Å; V136-A143 HydrophobicContact CG1-CB 4.03Å; V136-A143 HydrophobicContact CG2-CB 4.04Å; E141-A143 PolarHBondContact OE2-N 3.39Å; A143-I145 PolarHBondContact O-N 3.34Å; A143-F146 PolarHBondContact O-N 2.92Å; A143-F146 VanDerWaalsContact O-N 3.11Å; A143-A147 PolarHBondContact O-N 3.1Å; A143-Y149 HydrophobicContact CB-CE2 3.73Å; A143-Y149 WeakPolarHBondContact CB-OH 3.36Å; A143-W230 HydrophobicContact CB-CG 4.26Å |
| 144 | S | 98.8 | Very high | 98.6 | Very high | 29 Ų | 29 | 43.8 Ų | 43.8 | 20% | 0.203 | 25% | 0.251 | C | S | . | . | G | 310 helix | trans | -66.8 | -15.4 | 179.4 | 70.5 | 0 | 0 | 0 | 0 | 114.3 | E141 T142 F146 A147 | E141-S144 VanDerWaalsContact CD-OG 3.25Å; E141-S144 WeakPolarHBondContact OE1-CB 3.44Å; E141-S144 PolarHBondContact OE1-OG 3.19Å; E141-S144 WeakPolarHBondContact OE2-CB 3.15Å; E141-S144 PolarHBondContact OE2-N 3.13Å; E141-S144 PolarHBondContact OE2-OG 3.42Å; T142-S144 PolarHBondContact O-N 2.95Å; S144-F146 PolarHBondContact O-N 2.89Å; S144-A147 CarbonylContact C-O 3.52Å; S144-A147 VanDerWaalsContact CA-O 3.25Å; S144-A147 WeakPolarHBondContact CA-O 3.37Å |
| 145 | I | 98.9 | Very high | 98.6 | Very high | 1 Ų | 1 | 45 Ų | 45 | 1% | 0.005 | 26% | 0.263 | C | S | . | . | G | 310 helix | trans | -57.2 | -36.5 | 169.8 | -66.9 | 170.4 | 0 | 0 | 0 | 110.8 | Q39 V42 A43 V46 T47 L126 T142 A143 | Q39-I145 WeakPolarHBondContact CG-O 3.13Å; V42-I145 HydrophobicContact CG1-CB 4.36Å; V42-I145 HydrophobicContact CG1-CG1 4.11Å; A43-I145 HydrophobicContact CB-CD1 4.33Å; A43-I145 HydrophobicContact CB-CG2 3.71Å; V46-I145 HydrophobicContact CB-CD1 4.11Å; V46-I145 HydrophobicContact CB-CG1 4.14Å; V46-I145 HydrophobicContact CG1-CD1 4.04Å; V46-I145 HydrophobicContact CG1-CG1 4.35Å; V46-I145 HydrophobicContact CG2-CG1 4.1Å; T47-I145 HydrophobicContact CG2-CD1 4.4Å; L126-I145 HydrophobicContact CD2-CD1 3.72Å; T142-I145 HydrophobicContact CG2-CD1 4.12Å; T142-I145 WeakPolarHBondContact O-CB 3.37Å; T142-I145 WeakPolarHBondContact O-CG1 3.26Å; T142-I145 PolarHBondContact O-N 3Å; A143-I145 PolarHBondContact O-N 3.34Å |
| 146 | F | 98.9 | Very high | 98.6 | Very high | 1 Ų | 1 | 45.6 Ų | 45.6 | 0% | 0.004 | 27% | 0.265 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -100.2 | -51.8 | -168.9 | -60.4 | -81.4 | 0 | 0 | 0 | 112.3 | Q39 S115 T118 Y119 A143 S144 R217 P221 F224 T225 W230 | Q39-F146 PolarHBondContact NE2-O 3.32Å; S115-F146 WeakPolarHBondContact O-CE1 3.44Å; T118-F146 HydrophobicContact CG2-CE1 4.28Å; Y119-F146 HydrophobicContact CD2-CZ 4.16Å; A143-F146 PolarHBondContact O-N 2.92Å; A143-F146 VanDerWaalsContact O-N 3.11Å; S144-F146 PolarHBondContact O-N 2.89Å; F146-R217 PolarHBondContact O-NH1 3.18Å; F146-R217 VanDerWaalsContact O-NH1 3.16Å; F146-P221 HydrophobicContact CB-CB 3.89Å; F146-P221 WeakPolarHBondContact O-CB 3.4Å; F146-F224 HydrophobicContact CD1-CD1 4.12Å; F146-F224 HydrophobicContact CD1-CE1 4.28Å; F146-F224 HydrophobicContact CE1-CD1 4.23Å; F146-F224 AromaticContact CE1-CE1 3.91Å; F146-F224 HydrophobicContact CE1-CE1 3.91Å; F146-F224 HydrophobicContact CZ-CE1 4.22Å; F146-T225 HydrophobicContact CB-CG2 3.55Å; F146-T225 HydrophobicContact CD1-CG2 4.42Å; F146-T225 HydrophobicContact CD2-CG2 3.3Å; F146-T225 HydrophobicContact CE2-CG2 4.1Å; F146-T225 HydrophobicContact CG-CG2 3.5Å; F146-T225 VanDerWaalsContact CG-CG2 3.5Å; F146-W230 HydrophobicContact CD2-CH2 4.32Å; F146-W230 HydrophobicContact CD2-CZ2 4.38Å; F146-W230 AromaticContact CE2-CH2 3.52Å; F146-W230 HydrophobicContact CE2-CH2 3.52Å; F146-W230 AromaticContact CE2-CZ2 3.79Å; F146-W230 HydrophobicContact CE2-CZ2 3.79Å; F146-W230 HydrophobicContact CE2-CZ3 4.24Å; F146-W230 HydrophobicContact CZ-CH2 4.14Å |
| 147 | A | 98.8 | Very high | 98.6 | Very high | 0 Ų | 0 | 51.9 Ų | 51.9 | 0% | 0 | 30% | 0.298 | C | S | . | . | S | Bend | trans | -124.8 | 164.6 | -178 | 0 | 0 | 0 | 0 | 0 | 110.6 | A143 S144 R222 | A143-A147 PolarHBondContact O-N 3.1Å; S144-A147 CarbonylContact C-O 3.52Å; S144-A147 VanDerWaalsContact CA-O 3.25Å; S144-A147 WeakPolarHBondContact CA-O 3.37Å; A147-R222 HydrophobicContact CB-CB 3.82Å; A147-R222 HydrophobicContact CB-CG 4.44Å |
| 148 | T | 98.8 | Very high | 98.6 | Very high | 8 Ų | 8 | 51.7 Ų | 51.7 | 5% | 0.049 | 29% | 0.294 | C | S | . | . | trans | -92.1 | 152 | -176.8 | 78.8 | 0 | 0 | 0 | 0 | 112.3 | C209 P212 D218 R222 W241 | T148-C209 VanDerWaalsContact CB-O 3.26Å; T148-C209 WeakPolarHBondContact CB-O 3.23Å; T148-C209 PolarHBondContact OG1-O 3.41Å; T148-P212 HydrophobicContact CG2-CB 3.82Å; T148-P212 HydrophobicContact CG2-CG 4.05Å; T148-P212 WeakPolarHBondContact OG1-CG 3.11Å; T148-D218 PolarHBondContact N-OD2 3.05Å; T148-D218 PolarHBondContact OG1-OD2 3.22Å; T148-R222 PolarHBondContact O-NH2 3.32Å; T148-W241 PolarHBondContact O-NE1 3.46Å | ||
| 149 | Y | 98.8 | Very high | 98.6 | Very high | 34 Ų | 34 | 49.3 Ų | 49.3 | 13% | 0.133 | 27% | 0.27 | C | S | . | . | trans | -132 | 148.9 | 175.9 | -65.2 | -89.9 | 0 | 0 | 0 | 108.8 | V136 A143 R222 V234 A237 | V136-Y149 HydrophobicContact CG1-CD1 4.26Å; V136-Y149 HydrophobicContact CG1-CE1 3.5Å; A143-Y149 HydrophobicContact CB-CE2 3.73Å; A143-Y149 WeakPolarHBondContact CB-OH 3.36Å; Y149-R222 PolarHBondContact OH-NH1 3.48Å; Y149-V234 WeakPolarHBondContact OH-CB 3.37Å; Y149-A237 HydrophobicContact CD1-CB 3.94Å; Y149-A237 HydrophobicContact CE1-CB 3.91Å | ||
| 150 | P | 98.7 | Very high | 98.7 | Very high | 21 Ų | 21 | 45.7 Ų | 45.7 | 14% | 0.136 | 24% | 0.241 | C | C | . | . | trans | -75.3 | 149.7 | -178.6 | 32.3 | -31.9 | 0 | 0 | 0 | 110 | L154 C209 W241 | P150-L154 HydrophobicContact CB-CB 4.14Å; P150-L154 HydrophobicContact CB-CD2 3.78Å; P150-L154 HydrophobicContact CB-CG 4.47Å; P150-C209 HydrophobicContact CB-CB 4.48Å; P150-W241 HydrophobicContact CB-CD2 4.04Å; P150-W241 HydrophobicContact CB-CE3 3.81Å; P150-W241 HydrophobicContact CB-CH2 4.41Å; P150-W241 HydrophobicContact CB-CZ3 4.01Å; P150-W241 VanDerWaalsContact CD-CG 3.48Å; P150-W241 HydrophobicContact CG-CB 4.16Å; P150-W241 HydrophobicContact CG-CD2 3.82Å; P150-W241 HydrophobicContact CG-CE3 3.8Å; P150-W241 HydrophobicContact CG-CG 3.99Å; P150-W241 HydrophobicContact CG-CZ3 4.48Å | ||
| 151 | A | 98.6 | Very high | 98.7 | Very high | 19 Ų | 19 | 44.8 Ų | 44.8 | 16% | 0.157 | 24% | 0.241 | C | C | . | . | trans | -57.7 | 151 | 168.4 | 0 | 0 | 0 | 0 | 0 | 110.2 | Y153 L154 N208 | A151-Y153 HydrophobicContact CB-CD1 4.03Å; A151-Y153 HydrophobicContact CB-CE1 3.55Å; A151-Y153 HydrophobicContact CB-CE2 4.09Å; A151-Y153 HydrophobicContact CB-CG 4.49Å; A151-Y153 PolarHBondContact O-N 2.93Å; A151-L154 WeakPolarHBondContact O-CB 3.4Å; A151-L154 PolarHBondContact O-N 3.47Å; A151-N208 WeakPolarHBondContact CB-O 3.35Å; A151-N208 PolarHBondContact N-O 3.39Å | ||
| 152 | P | 98.2 | Very high | 98.7 | Very high | 145 Ų | 145 | 43.3 Ų | 43.3 | 94% | 0.942 | 23% | 0.234 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -58.6 | -25.4 | -173.3 | -27.2 | 35.1 | 0 | 0 | 0 | 115.3 | ||
| 153 | Y | 98.1 | Very high | 98.7 | Very high | 159 Ų | 159 | 43.3 Ų | 43.3 | 62% | 0.624 | 23% | 0.234 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -85.3 | -10.6 | 179.2 | 58.8 | -105.7 | 0 | 0 | 0 | 113.9 | A151 N208 | A151-Y153 HydrophobicContact CB-CD1 4.03Å; A151-Y153 HydrophobicContact CB-CE1 3.55Å; A151-Y153 HydrophobicContact CB-CE2 4.09Å; A151-Y153 HydrophobicContact CB-CG 4.49Å; A151-Y153 PolarHBondContact O-N 2.93Å; Y153-N208 PolarHBondContact OH-OD1 3.4Å |
| 154 | L | 98.7 | Very high | 98.7 | Very high | 11 Ų | 11 | 44.2 Ų | 44.2 | 6% | 0.058 | 24% | 0.24 | C | C | . | . | trans | -86 | 121 | -167.2 | -170.5 | 75.6 | 0 | 0 | 0 | 111.1 | P150 A151 N158 N208 C209 W241 | P150-L154 HydrophobicContact CB-CB 4.14Å; P150-L154 HydrophobicContact CB-CD2 3.78Å; P150-L154 HydrophobicContact CB-CG 4.47Å; A151-L154 WeakPolarHBondContact O-CB 3.4Å; A151-L154 PolarHBondContact O-N 3.47Å; L154-N158 HydrophobicContact CD1-CB 3.85Å; L154-N158 WeakPolarHBondContact CD1-ND2 3.5Å; L154-N208 HydrophobicContact CD1-CB 3.92Å; L154-N208 HydrophobicContact CD2-CB 3.93Å; L154-N208 WeakPolarHBondContact CD2-O 3.42Å; L154-C209 HydrophobicContact CD2-CB 3.91Å; L154-W241 HydrophobicContact CD2-CH2 4.26Å; L154-W241 HydrophobicContact CD2-CZ3 4.27Å | ||
| 155 | S | 98.7 | Very high | 98.7 | Very high | 62 Ų | 62 | 47.4 Ų | 47.4 | 43% | 0.434 | 25% | 0.254 | S | S | . | . | trans | -76.4 | 155.6 | 170.5 | 68.7 | 0 | 0 | 0 | 0 | 111.7 | N157 N158 G159 | S155-N157 PolarHBondContact O-N 2.58Å; S155-N158 PolarHBondContact O-N 3Å; S155-N158 PolarHBondContact OG-N 2.79Å; S155-G159 PolarHBondContact O-N 3.33Å | ||
| 156 | L | 98.8 | Very high | 98.7 | Very high | 45 Ų | 45 | 47.3 Ų | 47.3 | 24% | 0.236 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -54.2 | -40 | 174 | -67.7 | 172.7 | 0 | 0 | 0 | 112.2 | G159 F160 N239 W241 W243 V244 | L156-G159 PolarHBondContact O-N 3.38Å; L156-F160 VanDerWaalsContact O-CB 3.23Å; L156-F160 WeakPolarHBondContact O-CB 3.45Å; L156-F160 PolarHBondContact O-N 3.39Å; L156-N239 HydrophobicContact CD1-CB 4.2Å; L156-N239 HydrophobicContact CG-CB 4.29Å; L156-W241 HydrophobicContact CD2-CE3 4.19Å; L156-W243 HydrophobicContact CB-CZ2 4.49Å; L156-W243 HydrophobicContact CD1-CZ2 4.31Å; L156-W243 HydrophobicContact CD2-CZ2 4.43Å; L156-V244 HydrophobicContact CD2-CG2 3.9Å |
| 157 | N | 98.7 | Very high | 98.7 | Very high | 136 Ų | 136 | 47.3 Ų | 47.3 | 73% | 0.727 | 25% | 0.253 | S | S | * | . | H | α-helix | trans | -62.2 | -47.4 | 179.4 | -67.1 | -8.4 | 0 | 0 | 0 | 111.7 | S155 F160 L161 | S155-N157 PolarHBondContact O-N 2.58Å; N157-F160 PolarHBondContact O-N 2.99Å; N157-L161 PolarHBondContact O-N 2.93Å |
| 158 | N | 98.7 | Very high | 98.7 | Very high | 76 Ų | 76 | 47.8 Ų | 47.8 | 41% | 0.406 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -71.2 | -37 | -179.7 | -158.6 | 99.7 | 0 | 0 | 0 | 111.4 | L154 S155 L161 D162 | L154-N158 HydrophobicContact CD1-CB 3.85Å; L154-N158 WeakPolarHBondContact CD1-ND2 3.5Å; S155-N158 PolarHBondContact O-N 3Å; S155-N158 PolarHBondContact OG-N 2.79Å; N158-L161 PolarHBondContact O-N 3.16Å; N158-D162 VanDerWaalsContact O-CB 3.26Å; N158-D162 WeakPolarHBondContact O-CB 3.46Å; N158-D162 PolarHBondContact O-N 2.97Å |
| 159 | G | 98.7 | Very high | 98.7 | Very high | 0 Ų | 0 | 52.3 Ų | 52.3 | 0% | 0 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -67.6 | -34.5 | 174.3 | 0 | 0 | 0 | 0 | 0 | 113.5 | S155 L156 Q163 | S155-G159 PolarHBondContact O-N 3.33Å; L156-G159 PolarHBondContact O-N 3.38Å; G159-Q163 WeakPolarHBondContact O-CG 3.34Å; G159-Q163 PolarHBondContact O-N 3.14Å |
| 160 | F | 98.9 | Very high | 98.7 | Very high | 55 Ų | 55 | 51 Ų | 51 | 24% | 0.241 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -65 | -47.3 | 172.3 | -169.7 | -85.3 | 0 | 0 | 0 | 111 | L156 N157 D162 Q163 V164 W243 V244 V247 A248 V251 | L156-F160 VanDerWaalsContact O-CB 3.23Å; L156-F160 WeakPolarHBondContact O-CB 3.45Å; L156-F160 PolarHBondContact O-N 3.39Å; N157-F160 PolarHBondContact O-N 2.99Å; F160-D162 PolarHBondContact O-N 3.04Å; F160-Q163 PolarHBondContact O-N 3.12Å; F160-V164 HydrophobicContact CD1-CG2 3.83Å; F160-V164 HydrophobicContact CE1-CG2 3.55Å; F160-V164 HydrophobicContact CZ-CG2 4.22Å; F160-V164 WeakPolarHBondContact O-CB 3.15Å; F160-V164 VanDerWaalsContact O-CG2 3.31Å; F160-V164 WeakPolarHBondContact O-CG2 3.36Å; F160-V164 PolarHBondContact O-N 3.13Å; F160-W243 AromaticContact CD2-CH2 3.9Å; F160-W243 HydrophobicContact CD2-CH2 3.9Å; F160-W243 AromaticContact CD2-CZ3 3.52Å; F160-W243 HydrophobicContact CD2-CZ3 3.52Å; F160-W243 HydrophobicContact CE2-CH2 4.43Å; F160-W243 AromaticContact CE2-CZ3 3.69Å; F160-W243 HydrophobicContact CE2-CZ3 3.69Å; F160-V244 HydrophobicContact CB-CG1 4.29Å; F160-V244 HydrophobicContact CD2-CG1 4.4Å; F160-V247 HydrophobicContact CE2-CB 4.33Å; F160-V247 HydrophobicContact CE2-CG1 4.04Å; F160-V247 HydrophobicContact CZ-CG1 4.38Å; F160-A248 HydrophobicContact CD1-CB 4.44Å; F160-A248 HydrophobicContact CD2-CB 3.6Å; F160-A248 HydrophobicContact CE2-CB 3.68Å; F160-A248 HydrophobicContact CG-CB 3.99Å; F160-A248 HydrophobicContact CZ-CB 4.16Å; F160-V251 HydrophobicContact CZ-CB 4.46Å; F160-V251 HydrophobicContact CZ-CG2 4.13Å |
| 161 | L | 98.8 | Very high | 98.7 | Very high | 93 Ų | 93 | 50 Ų | 50 | 49% | 0.487 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -59.5 | -45.4 | 175.5 | 178.8 | 63.7 | 0 | 0 | 0 | 112 | N157 N158 Q163 V164 L165 | N157-L161 PolarHBondContact O-N 2.93Å; N158-L161 PolarHBondContact O-N 3.16Å; L161-Q163 PolarHBondContact O-N 3.21Å; L161-V164 PolarHBondContact O-N 3.07Å; L161-L165 HydrophobicContact CD1-CD1 3.99Å; L161-L165 HydrophobicContact CD1-CG 4.08Å; L161-L165 HydrophobicContact CG-CD1 3.97Å; L161-L165 HydrophobicContact CG-CG 4.43Å; L161-L165 WeakPolarHBondContact O-CB 3.39Å; L161-L165 WeakPolarHBondContact O-CG 3.23Å; L161-L165 PolarHBondContact O-N 3.44Å |
| 162 | D | 98.8 | Very high | 98.7 | Very high | 14 Ų | 14 | 51.4 Ų | 51.4 | 8% | 0.075 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -54.3 | -49.7 | 176.5 | 177.6 | 94.5 | 0 | 0 | 0 | 111.5 | N158 F160 L165 G166 N208 C209 | N158-D162 VanDerWaalsContact O-CB 3.26Å; N158-D162 WeakPolarHBondContact O-CB 3.46Å; N158-D162 PolarHBondContact O-N 2.97Å; F160-D162 PolarHBondContact O-N 3.04Å; D162-L165 PolarHBondContact O-N 3.06Å; D162-G166 PolarHBondContact O-N 2.88Å; D162-N208 PolarHBondContact OD1-ND2 2.91Å; D162-C209 PolarHBondContact OD2-SG 3.38Å |
| 163 | Q | 98.8 | Very high | 98.7 | Very high | 1 Ų | 1 | 45.2 Ų | 45.2 | 1% | 0.005 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -71.9 | -32.5 | 179.9 | -71.7 | -54 | -69.6 | 0 | 0 | 113.9 | G159 F160 L161 T167 C209 P212 L213 V244 A248 | G159-Q163 WeakPolarHBondContact O-CG 3.34Å; G159-Q163 PolarHBondContact O-N 3.14Å; F160-Q163 PolarHBondContact O-N 3.12Å; L161-Q163 PolarHBondContact O-N 3.21Å; Q163-T167 VanDerWaalsContact O-CB 3.25Å; Q163-T167 WeakPolarHBondContact O-CB 3.31Å; Q163-T167 PolarHBondContact O-N 3.46Å; Q163-T167 VanDerWaalsContact O-N 3.09Å; Q163-T167 PolarHBondContact O-OG1 3.02Å; Q163-C209 PolarHBondContact NE2-SG 2.87Å; Q163-P212 VanDerWaalsContact OE1-CD 3.23Å; Q163-P212 VanDerWaalsContact OE1-CG 3.23Å; Q163-L213 VanDerWaalsContact OE1-N 3.08Å; Q163-V244 HydrophobicContact CG-CG1 4.4Å; Q163-A248 HydrophobicContact CB-CB 3.54Å |
| 164 | V | 98.9 | Very high | 98.7 | Very high | 18 Ų | 18 | 38.6 Ų | 38.6 | 11% | 0.109 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -62.6 | -49.2 | 170.8 | 167.4 | 0 | 0 | 0 | 0 | 110.4 | F160 L161 G168 A248 V251 G252 L255 | F160-V164 HydrophobicContact CD1-CG2 3.83Å; F160-V164 HydrophobicContact CE1-CG2 3.55Å; F160-V164 HydrophobicContact CZ-CG2 4.22Å; F160-V164 WeakPolarHBondContact O-CB 3.15Å; F160-V164 VanDerWaalsContact O-CG2 3.31Å; F160-V164 WeakPolarHBondContact O-CG2 3.36Å; F160-V164 PolarHBondContact O-N 3.13Å; L161-V164 PolarHBondContact O-N 3.07Å; V164-G168 PolarHBondContact O-N 3.01Å; V164-A248 HydrophobicContact CG2-CB 4.1Å; V164-V251 HydrophobicContact CG1-CG1 4.43Å; V164-V251 HydrophobicContact CG2-CB 4.07Å; V164-V251 HydrophobicContact CG2-CG1 3.91Å; V164-G252 VanDerWaalsContact O-CA 3.23Å; V164-G252 WeakPolarHBondContact O-CA 3.28Å; V164-L255 HydrophobicContact CG1-CD1 3.97Å |
| 165 | L | 98.8 | Very high | 98.6 | Very high | 96 Ų | 96 | 38.7 Ų | 38.7 | 50% | 0.503 | 21% | 0.214 | S | C | . | . | H | α-helix | trans | -66.4 | -49.3 | -178 | -73.7 | 174.9 | 0 | 0 | 0 | 112 | L161 D162 T167 G168 M169 | L161-L165 HydrophobicContact CD1-CD1 3.99Å; L161-L165 HydrophobicContact CD1-CG 4.08Å; L161-L165 HydrophobicContact CG-CD1 3.97Å; L161-L165 HydrophobicContact CG-CG 4.43Å; L161-L165 WeakPolarHBondContact O-CB 3.39Å; L161-L165 WeakPolarHBondContact O-CG 3.23Å; L161-L165 PolarHBondContact O-N 3.44Å; D162-L165 PolarHBondContact O-N 3.06Å; L165-T167 VanDerWaalsContact C-N 3.33Å; L165-T167 PolarHBondContact O-N 3.48Å; L165-G168 PolarHBondContact O-N 2.73Å; L165-M169 WeakPolarHBondContact O-CG 3.42Å; L165-M169 PolarHBondContact O-N 2.79Å |
| 166 | G | 98.7 | Very high | 98.5 | Very high | 0 Ų | 0 | 37.4 Ų | 37.4 | 0% | 0 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -61.3 | -41.6 | 179.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | D162 M169 L170 M205 | D162-G166 PolarHBondContact O-N 2.88Å; G166-M169 PolarHBondContact O-N 3.47Å; G166-L170 WeakPolarHBondContact O-CB 3.4Å; G166-L170 PolarHBondContact O-N 3.04Å; G166-M205 WeakPolarHBondContact CA-SD 3.14Å |
| 167 | T | 98.9 | Very high | 98.4 | Very high | 0 Ų | 0 | 36.6 Ų | 36.6 | 0% | 0 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -74.5 | -32.4 | 178.8 | -46.4 | 0 | 0 | 0 | 0 | 111.7 | A84 Q163 L165 L170 M171 P249 A253 | A84-T167 HydrophobicContact CB-CG2 4.02Å; Q163-T167 VanDerWaalsContact O-CB 3.25Å; Q163-T167 WeakPolarHBondContact O-CB 3.31Å; Q163-T167 PolarHBondContact O-N 3.46Å; Q163-T167 VanDerWaalsContact O-N 3.09Å; Q163-T167 PolarHBondContact O-OG1 3.02Å; L165-T167 VanDerWaalsContact C-N 3.33Å; L165-T167 PolarHBondContact O-N 3.48Å; T167-L170 WeakPolarHBondContact O-CB 3.43Å; T167-L170 PolarHBondContact O-N 2.82Å; T167-M171 HydrophobicContact CG2-CE 4.08Å; T167-M171 PolarHBondContact O-N 2.99Å; T167-P249 HydrophobicContact CG2-CB 3.89Å; T167-P249 VanDerWaalsContact CG2-O 3.24Å; T167-P249 WeakPolarHBondContact CG2-O 3.47Å; T167-P249 WeakPolarHBondContact OG1-CA 3.45Å; T167-P249 WeakPolarHBondContact OG1-CB 3.46Å; T167-A253 HydrophobicContact CG2-CB 4.19Å |
| 168 | G | 98.8 | Very high | 98.1 | Very high | 11 Ų | 11 | 34.6 Ų | 34.6 | 11% | 0.113 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -61.6 | -47.6 | 172 | 0 | 0 | 0 | 0 | 0 | 112.2 | V164 L165 L170 M171 V172 G252 | V164-G168 PolarHBondContact O-N 3.01Å; L165-G168 PolarHBondContact O-N 2.73Å; G168-L170 VanDerWaalsContact C-N 3.32Å; G168-L170 PolarHBondContact O-N 2.81Å; G168-M171 PolarHBondContact O-N 3.47Å; G168-V172 WeakPolarHBondContact O-CG2 3.39Å; G168-V172 PolarHBondContact O-N 3.33Å; G168-G252 VanDerWaalsContact CA-O 3.24Å; G168-G252 WeakPolarHBondContact CA-O 3.17Å |
| 169 | M | 98.6 | Very high | 97.9 | Very high | 102 Ų | 102 | 31.9 Ų | 31.9 | 50% | 0.502 | 18% | 0.177 | S | C | . | . | H | α-helix | trans | -61.2 | -41.1 | 174.6 | -72 | -172.1 | 69.9 | 0 | 0 | 112 | L165 G166 V172 G173 I201 M205 | L165-M169 WeakPolarHBondContact O-CG 3.42Å; L165-M169 PolarHBondContact O-N 2.79Å; G166-M169 PolarHBondContact O-N 3.47Å; M169-V172 PolarHBondContact O-N 2.96Å; M169-G173 PolarHBondContact O-N 2.74Å; M169-I201 HydrophobicContact CB-CD1 4.43Å; M169-M205 HydrophobicContact SD-CE 3.55Å; M169-M205 VanDerWaalsContact SD-CE 3.55Å |
| 170 | L | 98.6 | Very high | 97.6 | Very high | 6 Ų | 6 | 43.3 Ų | 43.3 | 3% | 0.031 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -57.6 | -50 | 173.3 | 177.2 | 60.2 | 0 | 0 | 0 | 111.2 | G166 T167 G168 G173 L174 L197 I198 I201 L213 | G166-L170 WeakPolarHBondContact O-CB 3.4Å; G166-L170 PolarHBondContact O-N 3.04Å; T167-L170 WeakPolarHBondContact O-CB 3.43Å; T167-L170 PolarHBondContact O-N 2.82Å; G168-L170 VanDerWaalsContact C-N 3.32Å; G168-L170 PolarHBondContact O-N 2.81Å; L170-G173 PolarHBondContact O-N 2.88Å; L170-L174 HydrophobicContact CD1-CD1 3.79Å; L170-L174 HydrophobicContact CD1-CD2 4.4Å; L170-L174 HydrophobicContact CD1-CG 3.86Å; L170-L174 HydrophobicContact CD2-CD1 4.48Å; L170-L174 HydrophobicContact CG-CD1 3.8Å; L170-L174 HydrophobicContact CG-CG 4.28Å; L170-L174 WeakPolarHBondContact O-CB 3.46Å; L170-L174 VanDerWaalsContact O-CG 3.25Å; L170-L174 WeakPolarHBondContact O-CG 3.43Å; L170-L174 PolarHBondContact O-N 3.24Å; L170-L197 HydrophobicContact CD1-CD2 4.02Å; L170-I198 HydrophobicContact CD1-CD1 3.56Å; L170-I198 HydrophobicContact CD1-CG1 4.32Å; L170-I198 HydrophobicContact CD2-CD1 4.04Å; L170-I198 HydrophobicContact CG-CD1 4.4Å; L170-I201 HydrophobicContact CB-CD1 4.04Å; L170-L213 HydrophobicContact CD2-CB 4.09Å; L170-L213 HydrophobicContact CD2-CD1 4.2Å |
| 171 | M | 98.7 | Very high | 97.3 | Very high | 0 Ų | 0 | 46.9 Ų | 46.9 | 0% | 0 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -64.7 | -42.5 | -179.6 | -72.4 | -45.4 | 118.2 | 0 | 0 | 113 | A84 F85 A88 T167 G168 G173 L174 L175 A253 | A84-M171 HydrophobicContact CB-CE 4.42Å; F85-M171 HydrophobicContact CB-CE 4.01Å; F85-M171 HydrophobicContact CB-SD 4.18Å; F85-M171 HydrophobicContact CD2-CE 4.32Å; F85-M171 HydrophobicContact CD2-SD 3.73Å; F85-M171 HydrophobicContact CG-SD 4.44Å; A88-M171 HydrophobicContact CB-CG 4.35Å; A88-M171 HydrophobicContact CB-SD 3.76Å; T167-M171 HydrophobicContact CG2-CE 4.08Å; T167-M171 PolarHBondContact O-N 2.99Å; G168-M171 PolarHBondContact O-N 3.47Å; M171-G173 VanDerWaalsContact C-N 3.31Å; M171-G173 PolarHBondContact O-N 2.94Å; M171-L174 HydrophobicContact CE-CD1 4.05Å; M171-L174 PolarHBondContact O-N 3.12Å; M171-L174 HydrophobicContact SD-CD1 4.31Å; M171-L175 WeakPolarHBondContact O-CB 3.29Å; M171-L175 VanDerWaalsContact O-CG 3.25Å; M171-L175 WeakPolarHBondContact O-CG 3.1Å; M171-L175 PolarHBondContact O-N 3.46Å; M171-A253 HydrophobicContact CE-CB 4.29Å; M171-A253 HydrophobicContact CG-CB 3.42Å; M171-A253 VanDerWaalsContact CG-CB 3.42Å; M171-A253 HydrophobicContact SD-CB 4.03Å |
| 172 | V | 98.6 | Very high | 97.1 | Very high | 49 Ų | 49 | 44.7 Ų | 44.7 | 30% | 0.297 | 22% | 0.221 | S | C | . | . | H | α-helix | trans | -57.8 | -47.6 | 175.8 | 170.5 | 0 | 0 | 0 | 0 | 110.2 | G168 M169 A176 G256 Y260 | G168-V172 WeakPolarHBondContact O-CG2 3.39Å; G168-V172 PolarHBondContact O-N 3.33Å; M169-V172 PolarHBondContact O-N 2.96Å; V172-A176 WeakPolarHBondContact O-CB 3.46Å; V172-A176 PolarHBondContact O-N 3.45Å; V172-G256 VanDerWaalsContact CG2-O 3.32Å; V172-G256 WeakPolarHBondContact CG2-O 3.33Å; V172-Y260 HydrophobicContact CG1-CD2 4.33Å |
| 173 | G | 98.2 | Very high | 96.7 | Very high | 16 Ų | 16 | 54.7 Ų | 54.7 | 17% | 0.165 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -64.6 | -44.4 | 178.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | M169 L170 M171 A176 I177 | M169-G173 PolarHBondContact O-N 2.74Å; L170-G173 PolarHBondContact O-N 2.88Å; M171-G173 VanDerWaalsContact C-N 3.31Å; M171-G173 PolarHBondContact O-N 2.94Å; G173-A176 PolarHBondContact O-N 2.91Å; G173-I177 WeakPolarHBondContact O-CD1 3.23Å; G173-I177 VanDerWaalsContact O-CG1 3.24Å; G173-I177 WeakPolarHBondContact O-CG1 3.24Å; G173-I177 PolarHBondContact O-N 2.99Å |
| 174 | L | 97.5 | Very high | 96.2 | Very high | 20 Ų | 20 | 56.8 Ų | 56.8 | 11% | 0.105 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -61.7 | -45.5 | 177.7 | -72.2 | 176.1 | 0 | 0 | 0 | 112 | F85 L170 M171 A176 I177 L178 V194 | F85-L174 HydrophobicContact CD2-CB 4.28Å; F85-L174 HydrophobicContact CD2-CD1 3.4Å; F85-L174 HydrophobicContact CD2-CG 4.43Å; F85-L174 HydrophobicContact CE2-CB 3.89Å; F85-L174 HydrophobicContact CE2-CD1 3.77Å; F85-L174 HydrophobicContact CE2-CG 4.38Å; F85-L174 HydrophobicContact CG-CD1 4.2Å; L170-L174 HydrophobicContact CD1-CD1 3.79Å; L170-L174 HydrophobicContact CD1-CD2 4.4Å; L170-L174 HydrophobicContact CD1-CG 3.86Å; L170-L174 HydrophobicContact CD2-CD1 4.48Å; L170-L174 HydrophobicContact CG-CD1 3.8Å; L170-L174 HydrophobicContact CG-CG 4.28Å; L170-L174 WeakPolarHBondContact O-CB 3.46Å; L170-L174 VanDerWaalsContact O-CG 3.25Å; L170-L174 WeakPolarHBondContact O-CG 3.43Å; L170-L174 PolarHBondContact O-N 3.24Å; M171-L174 HydrophobicContact CE-CD1 4.05Å; M171-L174 PolarHBondContact O-N 3.12Å; M171-L174 HydrophobicContact SD-CD1 4.31Å; L174-A176 VanDerWaalsContact C-N 3.35Å; L174-I177 PolarHBondContact O-N 3.35Å; L174-L178 WeakPolarHBondContact O-CB 3.43Å; L174-L178 VanDerWaalsContact O-CG 3.27Å; L174-L178 WeakPolarHBondContact O-CG 3.34Å; L174-L178 PolarHBondContact O-N 3.36Å; L174-V194 HydrophobicContact CD2-CB 4.22Å; L174-V194 HydrophobicContact CD2-CG1 3.62Å; L174-V194 HydrophobicContact CD2-CG2 3.52Å |
| 175 | L | 97.6 | Very high | 96 | Very high | 13 Ų | 13 | 58 Ų | 58 | 7% | 0.068 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -65 | -40.4 | 177.8 | -68 | 172.5 | 0 | 0 | 0 | 111.2 | M89 V92 M171 I177 L178 D179 T257 Y260 | M89-L175 HydrophobicContact CE-CD2 3.6Å; V92-L175 HydrophobicContact CG1-CD2 4.44Å; M171-L175 WeakPolarHBondContact O-CB 3.29Å; M171-L175 VanDerWaalsContact O-CG 3.25Å; M171-L175 WeakPolarHBondContact O-CG 3.1Å; M171-L175 PolarHBondContact O-N 3.46Å; L175-I177 VanDerWaalsContact C-N 3.32Å; L175-I177 PolarHBondContact O-N 2.82Å; L175-L178 PolarHBondContact O-N 3.4Å; L175-D179 VanDerWaalsContact O-CB 3.23Å; L175-D179 WeakPolarHBondContact O-CB 3.2Å; L175-D179 PolarHBondContact O-N 2.74Å; L175-T257 HydrophobicContact CD1-CG2 3.93Å; L175-Y260 HydrophobicContact CB-CD1 3.53Å; L175-Y260 HydrophobicContact CB-CD2 4.14Å; L175-Y260 HydrophobicContact CB-CE1 3.82Å; L175-Y260 HydrophobicContact CB-CE2 4.39Å; L175-Y260 HydrophobicContact CB-CG 3.72Å; L175-Y260 HydrophobicContact CD1-CD1 3.96Å; L175-Y260 HydrophobicContact CD1-CG 4.09Å; L175-Y260 HydrophobicContact CG-CD1 4.35Å |
| 176 | A | 97.4 | Very high | 95.8 | Very high | 34 Ų | 34 | 57.7 Ų | 57.7 | 28% | 0.281 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -60.8 | -39.8 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | V172 G173 L174 N182 Y260 | V172-A176 WeakPolarHBondContact O-CB 3.46Å; V172-A176 PolarHBondContact O-N 3.45Å; G173-A176 PolarHBondContact O-N 2.91Å; L174-A176 VanDerWaalsContact C-N 3.35Å; A176-N182 PolarHBondContact O-ND2 2.87Å; A176-Y260 VanDerWaalsContact CA-CE2 3.49Å; A176-Y260 HydrophobicContact CB-CD2 4.36Å; A176-Y260 HydrophobicContact CB-CE2 3.66Å |
| 177 | I | 96.1 | Very high | 95.5 | Very high | 28 Ų | 28 | 62.2 Ų | 62.2 | 14% | 0.144 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -69.6 | -38.6 | 177.5 | -67.4 | 162.4 | 0 | 0 | 0 | 111.3 | G173 L174 L175 V185 E190 V193 V194 | G173-I177 WeakPolarHBondContact O-CD1 3.23Å; G173-I177 VanDerWaalsContact O-CG1 3.24Å; G173-I177 WeakPolarHBondContact O-CG1 3.24Å; G173-I177 PolarHBondContact O-N 2.99Å; L174-I177 PolarHBondContact O-N 3.35Å; L175-I177 VanDerWaalsContact C-N 3.32Å; L175-I177 PolarHBondContact O-N 2.82Å; I177-V185 HydrophobicContact CG2-CG2 4.36Å; I177-E190 HydrophobicContact CG2-CB 3.86Å; I177-E190 HydrophobicContact CG2-CG 4.17Å; I177-V193 HydrophobicContact CD1-CB 4.32Å; I177-V193 HydrophobicContact CD1-CG1 3.76Å; I177-V193 HydrophobicContact CG1-CG1 4.23Å; I177-V194 HydrophobicContact CD1-CG2 3.82Å |
| 178 | L | 92.4 | Very high | 95.2 | Very high | 94 Ų | 94 | 64 Ų | 64 | 49% | 0.492 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -79.9 | -23.3 | -177.8 | -70.9 | 169.6 | 0 | 0 | 0 | 113.8 | F85 L174 L175 R180 | F85-L178 HydrophobicContact CE2-CD1 3.94Å; F85-L178 HydrophobicContact CZ-CD1 3.54Å; L174-L178 WeakPolarHBondContact O-CB 3.43Å; L174-L178 VanDerWaalsContact O-CG 3.27Å; L174-L178 WeakPolarHBondContact O-CG 3.34Å; L174-L178 PolarHBondContact O-N 3.36Å; L175-L178 PolarHBondContact O-N 3.4Å; L178-R180 PolarHBondContact O-N 3Å |
| 179 | D | 94.2 | Very high | 95.1 | Very high | 19 Ų | 19 | 67.4 Ų | 67.4 | 10% | 0.102 | 37% | 0.368 | C | S | . | . | trans | -74.6 | 106.6 | -177.9 | -167.4 | -11.2 | 0 | 0 | 0 | 111.3 | L175 R181 N182 Y260 H268 | L175-D179 VanDerWaalsContact O-CB 3.23Å; L175-D179 WeakPolarHBondContact O-CB 3.2Å; L175-D179 PolarHBondContact O-N 2.74Å; D179-R181 PolarHBondContact O-N 3.45Å; D179-R181 VanDerWaalsContact O-N 3.11Å; D179-R181 WeakPolarHBondContact OD1-CB 3.38Å; D179-R181 IonicContact OD1-CZ 3.57Å; D179-R181 PolarHBondContact OD1-N 3.37Å; D179-R181 VanDerWaalsContact OD1-N 3.15Å; D179-R181 IonicContact OD1-NE 2.82Å; D179-R181 PolarHBondContact OD1-NE 3.48Å; D179-R181 IonicContact OD1-NH2 3.43Å; D179-R181 PolarHBondContact OD1-NH2 2.99Å; D179-R181 IonicContact OD2-CZ 3.49Å; D179-R181 IonicContact OD2-NE 3.48Å; D179-R181 PolarHBondContact OD2-NE 2.94Å; D179-R181 IonicContact OD2-NH2 2.73Å; D179-R181 PolarHBondContact OD2-NH2 3.39Å; D179-N182 WeakPolarHBondContact O-CB 3.47Å; D179-N182 PolarHBondContact O-N 3.21Å; D179-N182 VanDerWaalsContact O-N 3.13Å; D179-Y260 HydrophobicContact CB-CE1 4.41Å; D179-Y260 WeakPolarHBondContact CB-OH 3.47Å; D179-Y260 PolarHBondContact OD2-OH 3.27Å; D179-H268 IonicContact OD2-CE1 3.83Å | ||
| 180 | R | 91.9 | Very high | 94.9 | Very high | 241 Ų | 241 | 65.7 Ų | 65.7 | 91% | 0.909 | 36% | 0.359 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.2 | -8.5 | -177.5 | -58.8 | -169.5 | 71.7 | 160.3 | 3.3 | 114.1 | L178 | L178-R180 PolarHBondContact O-N 3Š|
| 181 | R | 93 | Very high | 94.8 | Very high | 129 Ų | 129 | 65.9 Ų | 65.9 | 49% | 0.487 | 36% | 0.36 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -83.3 | -19.6 | 176.3 | -55.8 | 168.8 | -70 | 174.1 | 3.1 | 111.8 | D179 A265 H268 | D179-R181 PolarHBondContact O-N 3.45Å; D179-R181 VanDerWaalsContact O-N 3.11Å; D179-R181 WeakPolarHBondContact OD1-CB 3.38Å; D179-R181 IonicContact OD1-CZ 3.57Å; D179-R181 PolarHBondContact OD1-N 3.37Å; D179-R181 VanDerWaalsContact OD1-N 3.15Å; D179-R181 IonicContact OD1-NE 2.82Å; D179-R181 PolarHBondContact OD1-NE 3.48Å; D179-R181 IonicContact OD1-NH2 3.43Å; D179-R181 PolarHBondContact OD1-NH2 2.99Å; D179-R181 IonicContact OD2-CZ 3.49Å; D179-R181 IonicContact OD2-NE 3.48Å; D179-R181 PolarHBondContact OD2-NE 2.94Å; D179-R181 IonicContact OD2-NH2 2.73Å; D179-R181 PolarHBondContact OD2-NH2 3.39Å; R181-A265 PolarHBondContact NH1-O 3.4Å; R181-H268 HydrophobicContact CB-CB 4.48Å; R181-H268 WeakPolarHBondContact CB-CD2 3.37Å; R181-H268 WeakPolarHBondContact CB-NE2 3.35Å; R181-H268 PolarHBondContact O-CD2 2.83Å; R181-H268 PolarHBondContact O-NE2 3.4Å |
| 182 | N | 94 | Very high | 94.8 | Very high | 47 Ų | 47 | 68.5 Ų | 68.5 | 25% | 0.251 | 38% | 0.376 | S | S | . | . | S | Bend | trans | -70.6 | 166.4 | 167.7 | -69.7 | -36.6 | 0 | 0 | 0 | 110.4 | A176 D179 G184 Y260 H268 | A176-N182 PolarHBondContact O-ND2 2.87Å; D179-N182 WeakPolarHBondContact O-CB 3.47Å; D179-N182 PolarHBondContact O-N 3.21Å; D179-N182 VanDerWaalsContact O-N 3.13Å; N182-G184 PolarHBondContact O-N 3.16Å; N182-Y260 PolarHBondContact ND2-OH 3.14Å; N182-H268 PolarHBondContact N-NE2 3.33Å; N182-H268 PolarHBondContact OD1-CE1 2.99Å; N182-H268 PolarHBondContact OD1-NE2 2.88Å; N182-H268 VanDerWaalsContact OD1-NE2 3.11Å |
| 183 | K | 90.8 | Very high | 94.8 | Very high | 224 Ų | 224 | 68.1 Ų | 68.1 | 97% | 0.974 | 37% | 0.374 | S | S | * | . | trans | -54.3 | -22.2 | 174.5 | -63.5 | -169.9 | 179.9 | 76.3 | 0 | 113.4 | ||||
| 184 | G | 89 | Confident | 94.8 | Very high | 46 Ų | 46 | 67.9 Ų | 67.9 | 47% | 0.474 | 37% | 0.369 | S | S | . | . | trans | 72.7 | 170.6 | 176.3 | 0 | 0 | 0 | 0 | 0 | 113.2 | N182 | N182-G184 PolarHBondContact O-N 3.16Š| ||
| 185 | V | 93.4 | Very high | 94.8 | Very high | 44 Ų | 44 | 67 Ų | 67 | 27% | 0.267 | 37% | 0.365 | S | S | . | . | trans | -106.4 | 157.5 | 169 | -60.1 | 0 | 0 | 0 | 0 | 108.5 | I177 A187 E190 V193 | I177-V185 HydrophobicContact CG2-CG2 4.36Å; V185-A187 PolarHBondContact O-N 3.33Å; V185-E190 HydrophobicContact CG2-CB 4.17Å; V185-E190 HydrophobicContact CG2-CG 3.63Å; V185-V193 HydrophobicContact CB-CG2 4.45Å; V185-V193 HydrophobicContact CG1-CG1 4.48Å; V185-V193 HydrophobicContact CG1-CG2 4.05Å | ||
| 186 | P | 94.9 | Very high | 94.8 | Very high | 89 Ų | 89 | 71.7 Ų | 71.7 | 58% | 0.578 | 39% | 0.388 | S | S | * | . | trans | -55.6 | 137 | 176.5 | -24.8 | 34.2 | 0 | 0 | 0 | 111.4 | G188 L189 | P186-G188 PolarHBondContact O-N 2.99Å; P186-L189 HydrophobicContact CB-CD1 3.96Å; P186-L189 HydrophobicContact CB-CG 4.34Å; P186-L189 HydrophobicContact CG-CD1 4.08Å; P186-L189 WeakPolarHBondContact O-CB 3.46Å; P186-L189 PolarHBondContact O-N 3.29Å | ||
| 187 | A | 92.9 | Very high | 94.9 | Very high | 95 Ų | 95 | 71.9 Ų | 71.9 | 79% | 0.785 | 38% | 0.384 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -56.6 | 130.7 | -175.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | V185 | V185-A187 PolarHBondContact O-N 3.33Š|
| 188 | G | 92.1 | Very high | 95 | Very high | 36 Ų | 36 | 71.3 Ų | 71.3 | 37% | 0.371 | 38% | 0.381 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 88.8 | -8.5 | -176.4 | 0 | 0 | 0 | 0 | 0 | 114.5 | Y71 P186 E190 | Y71-G188 WeakPolarHBondContact CE1-O 3.47Å; Y71-G188 PolarHBondContact OH-O 2.98Å; P186-G188 PolarHBondContact O-N 2.99Å; G188-E190 WeakPolarHBondContact CA-OE2 3.38Å; G188-E190 PolarHBondContact N-OE1 3.46Å; G188-E190 PolarHBondContact N-OE2 3.47Å |
| 189 | L | 96.3 | Very high | 95.3 | Very high | 83 Ų | 83 | 68.5 Ų | 68.5 | 44% | 0.435 | 37% | 0.366 | S | S | . | . | trans | -96.5 | -2.9 | 174.2 | -63.1 | -174.2 | 0 | 0 | 0 | 113.7 | P186 P191 V192 V193 | P186-L189 HydrophobicContact CB-CD1 3.96Å; P186-L189 HydrophobicContact CB-CG 4.34Å; P186-L189 HydrophobicContact CG-CD1 4.08Å; P186-L189 WeakPolarHBondContact O-CB 3.46Å; P186-L189 PolarHBondContact O-N 3.29Å; L189-P191 VanDerWaalsContact C-CD 3.48Å; L189-P191 VanDerWaalsContact C-N 3.33Å; L189-V192 HydrophobicContact CD2-CG2 4.49Å; L189-V192 WeakPolarHBondContact O-CB 3.48Å; L189-V192 PolarHBondContact O-N 2.96Å; L189-V192 VanDerWaalsContact O-N 3.1Å; L189-V193 PolarHBondContact O-N 3.04Å; L189-V193 VanDerWaalsContact O-N 3.09Å | ||
| 190 | E | 95.4 | Very high | 95.5 | Very high | 67 Ų | 67 | 70.1 Ų | 70.1 | 31% | 0.313 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -50.8 | -49.1 | 176.6 | -49.8 | 78.4 | 171.9 | 0 | 0 | 111.3 | I177 V185 G188 V192 V193 V194 | I177-E190 HydrophobicContact CG2-CB 3.86Å; I177-E190 HydrophobicContact CG2-CG 4.17Å; V185-E190 HydrophobicContact CG2-CB 4.17Å; V185-E190 HydrophobicContact CG2-CG 3.63Å; G188-E190 WeakPolarHBondContact CA-OE2 3.38Å; G188-E190 PolarHBondContact N-OE1 3.46Å; G188-E190 PolarHBondContact N-OE2 3.47Å; E190-V192 VanDerWaalsContact C-N 3.29Å; E190-V192 PolarHBondContact O-N 3.27Å; E190-V193 PolarHBondContact O-N 2.91Å; E190-V194 WeakPolarHBondContact O-CG2 3.43Å; E190-V194 PolarHBondContact O-N 3.33Å |
| 191 | P | 96.8 | Very high | 95.8 | Very high | 9 Ų | 9 | 58.8 Ų | 58.8 | 6% | 0.058 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -62.2 | -35.4 | -178.9 | -26 | 40.2 | 0 | 0 | 0 | 113.1 | V67 I70 Y71 L189 V194 G195 | V67-P191 HydrophobicContact CG1-CB 4.22Å; V67-P191 WeakPolarHBondContact CG2-O 3.47Å; I70-P191 HydrophobicContact CB-CB 3.99Å; I70-P191 HydrophobicContact CB-CG 4.34Å; I70-P191 HydrophobicContact CG2-CB 3.78Å; I70-P191 HydrophobicContact CG2-CG 3.62Å; Y71-P191 HydrophobicContact CD1-CB 4.29Å; Y71-P191 HydrophobicContact CD1-CG 3.79Å; Y71-P191 HydrophobicContact CD2-CB 3.99Å; Y71-P191 HydrophobicContact CD2-CG 4.4Å; Y71-P191 HydrophobicContact CE1-CB 4.05Å; Y71-P191 HydrophobicContact CE1-CG 3.53Å; Y71-P191 HydrophobicContact CE2-CB 3.76Å; Y71-P191 HydrophobicContact CE2-CG 4.19Å; Y71-P191 HydrophobicContact CG-CB 4.25Å; Y71-P191 HydrophobicContact CG-CG 4.21Å; L189-P191 VanDerWaalsContact C-CD 3.48Å; L189-P191 VanDerWaalsContact C-N 3.33Å; P191-V194 PolarHBondContact O-N 3.02Å; P191-G195 PolarHBondContact O-N 3.26Å |
| 192 | V | 98.1 | Very high | 96.1 | Very high | 56 Ų | 56 | 52.7 Ų | 52.7 | 34% | 0.339 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -65.8 | -44.5 | 177.8 | 177.9 | 0 | 0 | 0 | 0 | 110.5 | V67 Y71 L189 E190 V194 G195 M196 | V67-V192 HydrophobicContact CG1-CG2 4.09Å; Y71-V192 HydrophobicContact CE2-CG2 4.38Å; L189-V192 HydrophobicContact CD2-CG2 4.49Å; L189-V192 WeakPolarHBondContact O-CB 3.48Å; L189-V192 PolarHBondContact O-N 2.96Å; L189-V192 VanDerWaalsContact O-N 3.1Å; E190-V192 VanDerWaalsContact C-N 3.29Å; E190-V192 PolarHBondContact O-N 3.27Å; V192-V194 VanDerWaalsContact C-N 3.32Å; V192-V194 PolarHBondContact O-N 3.42Å; V192-G195 PolarHBondContact O-N 3.37Å; V192-G195 VanDerWaalsContact O-N 3.17Å; V192-M196 HydrophobicContact CG1-CE 4.44Å; V192-M196 WeakPolarHBondContact O-CG 3.49Å; V192-M196 PolarHBondContact O-N 3.17Å |
| 193 | V | 98.1 | Very high | 96.3 | Very high | 41 Ų | 41 | 54.5 Ų | 54.5 | 25% | 0.248 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -65.6 | -37 | 177.5 | -179.1 | 0 | 0 | 0 | 0 | 111.2 | I177 V185 L189 E190 M196 L197 | I177-V193 HydrophobicContact CD1-CB 4.32Å; I177-V193 HydrophobicContact CD1-CG1 3.76Å; I177-V193 HydrophobicContact CG1-CG1 4.23Å; V185-V193 HydrophobicContact CB-CG2 4.45Å; V185-V193 HydrophobicContact CG1-CG1 4.48Å; V185-V193 HydrophobicContact CG1-CG2 4.05Å; L189-V193 PolarHBondContact O-N 3.04Å; L189-V193 VanDerWaalsContact O-N 3.09Å; E190-V193 PolarHBondContact O-N 2.91Å; V193-M196 HydrophobicContact CB-CE 4.21Å; V193-M196 HydrophobicContact CG1-CE 4.49Å; V193-M196 HydrophobicContact CG2-CE 3.8Å; V193-M196 PolarHBondContact O-N 3.49Å; V193-L197 PolarHBondContact O-N 2.84Å |
| 194 | V | 98.1 | Very high | 96.7 | Very high | 10 Ų | 10 | 48.8 Ų | 48.8 | 6% | 0.061 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -62.1 | -42.6 | 171.4 | 176.1 | 0 | 0 | 0 | 0 | 111.7 | V66 I70 L174 I177 E190 P191 V192 M196 L197 I198 | V66-V194 HydrophobicContact CG1-CG1 3.93Å; I70-V194 HydrophobicContact CD1-CB 3.9Å; I70-V194 HydrophobicContact CD1-CG1 3.52Å; I70-V194 HydrophobicContact CD1-CG2 4.37Å; L174-V194 HydrophobicContact CD2-CB 4.22Å; L174-V194 HydrophobicContact CD2-CG1 3.62Å; L174-V194 HydrophobicContact CD2-CG2 3.52Å; I177-V194 HydrophobicContact CD1-CG2 3.82Å; E190-V194 WeakPolarHBondContact O-CG2 3.43Å; E190-V194 PolarHBondContact O-N 3.33Å; P191-V194 PolarHBondContact O-N 3.02Å; V192-V194 VanDerWaalsContact C-N 3.32Å; V192-V194 PolarHBondContact O-N 3.42Å; V194-M196 PolarHBondContact O-N 2.68Å; V194-L197 WeakPolarHBondContact O-CB 3.21Å; V194-L197 PolarHBondContact O-N 3.19Å; V194-I198 WeakPolarHBondContact O-CG1 3.34Å; V194-I198 PolarHBondContact O-N 3.43Å |
| 195 | G | 98.3 | Very high | 97 | Very high | 3 Ų | 3 | 48.4 Ų | 48.4 | 3% | 0.031 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -59.1 | -45.8 | 173.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | S63 P191 V192 L197 I198 L199 | S63-G195 WeakPolarHBondContact CB-O 3.43Å; P191-G195 PolarHBondContact O-N 3.26Å; V192-G195 PolarHBondContact O-N 3.37Å; V192-G195 VanDerWaalsContact O-N 3.17Å; G195-L197 VanDerWaalsContact C-N 3.3Å; G195-L197 PolarHBondContact O-N 2.99Å; G195-I198 PolarHBondContact O-N 3.39Å; G195-L199 PolarHBondContact O-N 3.3Å |
| 196 | M | 98.6 | Very high | 97.2 | Very high | 110 Ų | 110 | 46.5 Ų | 46.5 | 54% | 0.542 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -61.1 | -38.6 | 176.2 | -68.6 | -170.1 | -67 | 0 | 0 | 112.3 | V192 V193 V194 L199 A200 | V192-M196 HydrophobicContact CG1-CE 4.44Å; V192-M196 WeakPolarHBondContact O-CG 3.49Å; V192-M196 PolarHBondContact O-N 3.17Å; V193-M196 HydrophobicContact CB-CE 4.21Å; V193-M196 HydrophobicContact CG1-CE 4.49Å; V193-M196 HydrophobicContact CG2-CE 3.8Å; V193-M196 PolarHBondContact O-N 3.49Å; V194-M196 PolarHBondContact O-N 2.68Å; M196-L199 PolarHBondContact O-N 3.34Å; M196-A200 WeakPolarHBondContact O-CB 3.24Å; M196-A200 PolarHBondContact O-N 2.95Å |
| 197 | L | 98.6 | Very high | 97.3 | Very high | 39 Ų | 39 | 46 Ų | 46 | 20% | 0.204 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -61.6 | -46.7 | 173.9 | 175.9 | 63.4 | 0 | 0 | 0 | 111.6 | L170 V193 V194 G195 L199 A200 I201 | L170-L197 HydrophobicContact CD1-CD2 4.02Å; V193-L197 PolarHBondContact O-N 2.84Å; V194-L197 WeakPolarHBondContact O-CB 3.21Å; V194-L197 PolarHBondContact O-N 3.19Å; G195-L197 VanDerWaalsContact C-N 3.3Å; G195-L197 PolarHBondContact O-N 2.99Å; L197-L199 VanDerWaalsContact C-N 3.34Å; L197-L199 PolarHBondContact O-N 3.26Å; L197-A200 PolarHBondContact O-N 3.5Å; L197-I201 HydrophobicContact CD1-CD1 4.09Å; L197-I201 HydrophobicContact CD1-CG1 4.47Å; L197-I201 HydrophobicContact CG-CD1 4.07Å; L197-I201 WeakPolarHBondContact O-CG1 3.34Å; L197-I201 PolarHBondContact O-N 3.48Å |
| 198 | I | 98.4 | Very high | 97.6 | Very high | 16 Ų | 16 | 43.3 Ų | 43.3 | 8% | 0.082 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -61.6 | -42.3 | 176.1 | -67.9 | -70.8 | 0 | 0 | 0 | 111.2 | V66 L170 V194 G195 I201 G202 F211 L213 | V66-I198 HydrophobicContact CG1-CG1 4.27Å; V66-I198 HydrophobicContact CG2-CG1 4.33Å; V66-I198 HydrophobicContact CG2-CG2 4.43Å; L170-I198 HydrophobicContact CD1-CD1 3.56Å; L170-I198 HydrophobicContact CD1-CG1 4.32Å; L170-I198 HydrophobicContact CD2-CD1 4.04Å; L170-I198 HydrophobicContact CG-CD1 4.4Å; V194-I198 WeakPolarHBondContact O-CG1 3.34Å; V194-I198 PolarHBondContact O-N 3.43Å; G195-I198 PolarHBondContact O-N 3.39Å; I198-I201 PolarHBondContact O-N 2.97Å; I198-G202 PolarHBondContact O-N 2.95Å; I198-F211 HydrophobicContact CG2-CE2 4.07Å; I198-L213 HydrophobicContact CD1-CD1 4.07Å |
| 199 | L | 98.7 | Very high | 97.9 | Very high | 35 Ų | 35 | 41.7 Ų | 41.7 | 18% | 0.183 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -62.9 | -44.4 | 177.5 | -175.8 | 57.3 | 0 | 0 | 0 | 111.6 | F59 L60 G195 M196 L197 G202 L203 | F59-L199 HydrophobicContact CB-CD1 4.32Å; L60-L199 HydrophobicContact CD1-CD2 4.03Å; G195-L199 PolarHBondContact O-N 3.3Å; M196-L199 PolarHBondContact O-N 3.34Å; L197-L199 VanDerWaalsContact C-N 3.34Å; L197-L199 PolarHBondContact O-N 3.26Å; L199-G202 PolarHBondContact O-N 3.49Å; L199-L203 HydrophobicContact CD1-CD1 3.88Å; L199-L203 HydrophobicContact CD1-CG 4.04Å; L199-L203 HydrophobicContact CG-CD1 3.85Å; L199-L203 HydrophobicContact CG-CG 4.4Å; L199-L203 WeakPolarHBondContact O-CB 3.45Å; L199-L203 VanDerWaalsContact O-CG 3.31Å; L199-L203 WeakPolarHBondContact O-CG 3.29Å; L199-L203 PolarHBondContact O-N 3.2Å |
| 200 | A | 98.8 | Very high | 97.8 | Very high | 52 Ų | 52 | 39 Ų | 39 | 43% | 0.43 | 24% | 0.241 | S | C | . | . | H | α-helix | trans | -61 | -45.2 | 177 | 0 | 0 | 0 | 0 | 0 | 111.6 | M196 L197 L203 S204 | M196-A200 WeakPolarHBondContact O-CB 3.24Å; M196-A200 PolarHBondContact O-N 2.95Å; L197-A200 PolarHBondContact O-N 3.5Å; A200-L203 PolarHBondContact O-N 3.21Å; A200-S204 VanDerWaalsContact O-CB 3.31Å; A200-S204 WeakPolarHBondContact O-CB 3.43Å; A200-S204 PolarHBondContact O-N 3.09Å; A200-S204 PolarHBondContact O-OG 2.81Å |
| 201 | I | 98.5 | Very high | 97.8 | Very high | 4 Ų | 4 | 37 Ų | 37 | 2% | 0.021 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -58.8 | -50.2 | 173.7 | -70.9 | 168 | 0 | 0 | 0 | 110.2 | M169 L170 L197 I198 L203 S204 M205 F211 L213 | M169-I201 HydrophobicContact CB-CD1 4.43Å; L170-I201 HydrophobicContact CB-CD1 4.04Å; L197-I201 HydrophobicContact CD1-CD1 4.09Å; L197-I201 HydrophobicContact CD1-CG1 4.47Å; L197-I201 HydrophobicContact CG-CD1 4.07Å; L197-I201 WeakPolarHBondContact O-CG1 3.34Å; L197-I201 PolarHBondContact O-N 3.48Å; I198-I201 PolarHBondContact O-N 2.97Å; I201-L203 PolarHBondContact O-N 3.18Å; I201-S204 PolarHBondContact O-N 3.28Å; I201-M205 HydrophobicContact CB-CG 4.46Å; I201-M205 HydrophobicContact CG2-CG 3.69Å; I201-M205 HydrophobicContact CG2-SD 3.71Å; I201-M205 WeakPolarHBondContact O-CG 3.24Å; I201-M205 PolarHBondContact O-N 3.41Å; I201-F211 HydrophobicContact CG2-CB 4.4Å; I201-L213 HydrophobicContact CD1-CD1 4.46Å; I201-L213 HydrophobicContact CG2-CD1 3.74Å; I201-L213 HydrophobicContact CG2-CD2 4.43Å |
| 202 | G | 98.1 | Very high | 97.6 | Very high | 1 Ų | 1 | 36.9 Ų | 36.9 | 1% | 0.01 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -59.2 | -43.1 | 179.7 | 0 | 0 | 0 | 0 | 0 | 113.3 | F59 I198 L199 S204 G206 | F59-G202 WeakPolarHBondContact CD2-O 3.33Å; F59-G202 WeakPolarHBondContact CE2-O 3.47Å; I198-G202 PolarHBondContact O-N 2.95Å; L199-G202 PolarHBondContact O-N 3.49Å; G202-S204 PolarHBondContact O-N 3.1Å; G202-G206 WeakPolarHBondContact O-CA 3.41Å; G202-G206 PolarHBondContact O-N 2.96Å |
| 203 | L | 98.5 | Very high | 97.6 | Very high | 84 Ų | 84 | 34.5 Ų | 34.5 | 44% | 0.44 | 22% | 0.216 | S | C | . | . | H | α-helix | trans | -73.7 | -24.3 | -179.9 | -66.7 | 171.9 | 0 | 0 | 0 | 113.6 | F56 F59 L199 A200 I201 | F56-L203 HydrophobicContact CD2-CD2 4.04Å; F56-L203 HydrophobicContact CE2-CD2 4.41Å; F59-L203 HydrophobicContact CD2-CD2 4.01Å; L199-L203 HydrophobicContact CD1-CD1 3.88Å; L199-L203 HydrophobicContact CD1-CG 4.04Å; L199-L203 HydrophobicContact CG-CD1 3.85Å; L199-L203 HydrophobicContact CG-CG 4.4Å; L199-L203 WeakPolarHBondContact O-CB 3.45Å; L199-L203 VanDerWaalsContact O-CG 3.31Å; L199-L203 WeakPolarHBondContact O-CG 3.29Å; L199-L203 PolarHBondContact O-N 3.2Å; A200-L203 PolarHBondContact O-N 3.21Å; I201-L203 PolarHBondContact O-N 3.18Å |
| 204 | S | 98.2 | Very high | 97.6 | Very high | 105 Ų | 105 | 33 Ų | 33 | 73% | 0.734 | 21% | 0.207 | S | C | * | . | H | α-helix | trans | -98.8 | -27.6 | -178 | -64.1 | 0 | 0 | 0 | 0 | 114.3 | A200 I201 G202 | A200-S204 VanDerWaalsContact O-CB 3.31Å; A200-S204 WeakPolarHBondContact O-CB 3.43Å; A200-S204 PolarHBondContact O-N 3.09Å; A200-S204 PolarHBondContact O-OG 2.81Å; I201-S204 PolarHBondContact O-N 3.28Å; G202-S204 PolarHBondContact O-N 3.1Å |
| 205 | M | 96.4 | Very high | 97.7 | Very high | 38 Ų | 38 | 33 Ų | 33 | 19% | 0.187 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -140.6 | 14.4 | -175 | 53.6 | 175.2 | 73.4 | 0 | 0 | 113.6 | G166 M169 I201 | G166-M205 WeakPolarHBondContact CA-SD 3.14Å; M169-M205 HydrophobicContact SD-CE 3.55Å; M169-M205 VanDerWaalsContact SD-CE 3.55Å; I201-M205 HydrophobicContact CB-CG 4.46Å; I201-M205 HydrophobicContact CG2-CG 3.69Å; I201-M205 HydrophobicContact CG2-SD 3.71Å; I201-M205 WeakPolarHBondContact O-CG 3.24Å; I201-M205 PolarHBondContact O-N 3.41Å |
| 206 | G | 97.3 | Very high | 97.7 | Very high | 4 Ų | 4 | 32.8 Ų | 32.8 | 4% | 0.041 | 21% | 0.205 | C | C | . | . | trans | -78 | -18.3 | 177.4 | 0 | 0 | 0 | 0 | 0 | 115.1 | G202 N208 G210 | G202-G206 WeakPolarHBondContact O-CA 3.41Å; G202-G206 PolarHBondContact O-N 2.96Å; G206-N208 VanDerWaalsContact C-N 3.35Å; G206-N208 PolarHBondContact O-N 3.42Å; G206-G210 VanDerWaalsContact O-CA 3.28Å; G206-G210 WeakPolarHBondContact O-CA 3.46Å; G206-G210 PolarHBondContact O-N 2.99Å | ||
| 207 | A | 98.2 | Very high | 97.7 | Very high | 79 Ų | 79 | 29 Ų | 29 | 65% | 0.653 | 18% | 0.184 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -66.7 | -32 | -172 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||
| 208 | N | 98.6 | Very high | 97.7 | Very high | 38 Ų | 38 | 27.1 Ų | 27.1 | 20% | 0.203 | 18% | 0.175 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -67.7 | -50 | -176.3 | -74.3 | -35.4 | 0 | 0 | 0 | 111.7 | A151 Y153 L154 D162 G206 | A151-N208 WeakPolarHBondContact CB-O 3.35Å; A151-N208 PolarHBondContact N-O 3.39Å; Y153-N208 PolarHBondContact OH-OD1 3.4Å; L154-N208 HydrophobicContact CD1-CB 3.92Å; L154-N208 HydrophobicContact CD2-CB 3.93Å; L154-N208 WeakPolarHBondContact CD2-O 3.42Å; D162-N208 PolarHBondContact OD1-ND2 2.91Å; G206-N208 VanDerWaalsContact C-N 3.35Å; G206-N208 PolarHBondContact O-N 3.42Å |
| 209 | C | 97.8 | Very high | 97.7 | Very high | 2 Ų | 2 | 27.9 Ų | 27.9 | 1% | 0.014 | 18% | 0.179 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -152.4 | 21.1 | -172.1 | 66.7 | 0 | 0 | 0 | 0 | 114.9 | T148 P150 L154 D162 Q163 F211 W241 | T148-C209 VanDerWaalsContact CB-O 3.26Å; T148-C209 WeakPolarHBondContact CB-O 3.23Å; T148-C209 PolarHBondContact OG1-O 3.41Å; P150-C209 HydrophobicContact CB-CB 4.48Å; L154-C209 HydrophobicContact CD2-CB 3.91Å; D162-C209 PolarHBondContact OD2-SG 3.38Å; Q163-C209 PolarHBondContact NE2-SG 2.87Å; C209-F211 PolarHBondContact O-N 3.48Å; C209-W241 HydrophobicContact CB-CH2 3.58Å; C209-W241 HydrophobicContact CB-CZ2 3.38Å |
| 210 | G | 94.6 | Very high | 97.7 | Very high | 26 Ų | 26 | 26.2 Ų | 26.2 | 27% | 0.268 | 17% | 0.17 | S | C | . | . | trans | 75.1 | 18.6 | 173.3 | 0 | 0 | 0 | 0 | 0 | 115.6 | G206 | G206-G210 VanDerWaalsContact O-CA 3.28Å; G206-G210 WeakPolarHBondContact O-CA 3.46Å; G206-G210 PolarHBondContact O-N 2.99Å | ||
| 211 | F | 94.3 | Very high | 97.8 | Very high | 25 Ų | 25 | 23.8 Ų | 23.8 | 11% | 0.11 | 15% | 0.15 | C | C | . | . | trans | 40.1 | 60.5 | 174.3 | 69.6 | -75.8 | 0 | 0 | 0 | 115 | F59 I198 I201 C209 L213 | F59-F211 HydrophobicContact CB-CZ 4.37Å; F59-F211 AromaticContact CD1-CE1 3.47Å; F59-F211 HydrophobicContact CD1-CE1 3.47Å; F59-F211 VanDerWaalsContact CD1-CE1 3.47Å; F59-F211 AromaticContact CD1-CZ 3.94Å; F59-F211 HydrophobicContact CD1-CZ 3.94Å; F59-F211 HydrophobicContact CD2-CE1 4.21Å; F59-F211 HydrophobicContact CE1-CD1 4.37Å; F59-F211 AromaticContact CE1-CE1 3.55Å; F59-F211 HydrophobicContact CE1-CE1 3.55Å; F59-F211 HydrophobicContact CE1-CZ 4.45Å; F59-F211 HydrophobicContact CE2-CE1 4.27Å; F59-F211 AromaticContact CG-CE1 3.83Å; F59-F211 HydrophobicContact CG-CE1 3.83Å; F59-F211 HydrophobicContact CG-CZ 4.12Å; F59-F211 HydrophobicContact CZ-CD1 4.47Å; F59-F211 AromaticContact CZ-CE1 3.95Å; F59-F211 HydrophobicContact CZ-CE1 3.95Å; I198-F211 HydrophobicContact CG2-CE2 4.07Å; I201-F211 HydrophobicContact CG2-CB 4.4Å; C209-F211 PolarHBondContact O-N 3.48Å; F211-L213 HydrophobicContact CB-CD1 4.47Å; F211-L213 HydrophobicContact CB-CD2 4.36Å; F211-L213 HydrophobicContact CB-CG 4.25Å; F211-L213 HydrophobicContact CD2-CD1 4.18Å; F211-L213 WeakPolarHBondContact O-CG 3.37Å; F211-L213 PolarHBondContact O-N 3.02Å | ||
| 212 | P | 93.6 | Very high | 97.8 | Very high | 7 Ų | 7 | 23.6 Ų | 23.6 | 5% | 0.045 | 15% | 0.149 | C | C | . | . | trans | -61.3 | -43.1 | 178.3 | 19.9 | -29.8 | 0 | 0 | 0 | 113 | T148 Q163 N214 D218 P245 | T148-P212 HydrophobicContact CG2-CB 3.82Å; T148-P212 HydrophobicContact CG2-CG 4.05Å; T148-P212 WeakPolarHBondContact OG1-CG 3.11Å; Q163-P212 VanDerWaalsContact OE1-CD 3.23Å; Q163-P212 VanDerWaalsContact OE1-CG 3.23Å; P212-N214 WeakPolarHBondContact O-CB 3.36Å; P212-N214 PolarHBondContact O-N 3.34Å; P212-D218 HydrophobicContact CB-CB 4.37Å; P212-P245 HydrophobicContact CB-CB 4.13Å; P212-P245 HydrophobicContact CG-CB 3.62Å | ||
| 213 | L | 98.3 | Very high | 97.8 | Very high | 5 Ų | 5 | 27 Ų | 27 | 3% | 0.026 | 17% | 0.166 | C | C | . | . | trans | 54.6 | 0.4 | 176.6 | -45.5 | 175.1 | 0 | 0 | 0 | 116.2 | N82 Q163 L170 I198 I201 F211 | N82-L213 PolarHBondContact ND2-O 2.97Å; Q163-L213 VanDerWaalsContact OE1-N 3.08Å; L170-L213 HydrophobicContact CD2-CB 4.09Å; L170-L213 HydrophobicContact CD2-CD1 4.2Å; I198-L213 HydrophobicContact CD1-CD1 4.07Å; I201-L213 HydrophobicContact CD1-CD1 4.46Å; I201-L213 HydrophobicContact CG2-CD1 3.74Å; I201-L213 HydrophobicContact CG2-CD2 4.43Å; F211-L213 HydrophobicContact CB-CD1 4.47Å; F211-L213 HydrophobicContact CB-CD2 4.36Å; F211-L213 HydrophobicContact CB-CG 4.25Å; F211-L213 HydrophobicContact CD2-CD1 4.18Å; F211-L213 WeakPolarHBondContact O-CG 3.37Å; F211-L213 PolarHBondContact O-N 3.02Å | ||
| 214 | N | 98.8 | Very high | 97.8 | Very high | 11 Ų | 11 | 23.9 Ų | 23.9 | 6% | 0.059 | 15% | 0.15 | C | C | . | . | trans | -147.2 | 109.6 | -165.6 | 177 | -19.8 | 0 | 0 | 0 | 108.9 | L81 N82 P83 P212 A216 R217 D218 | L81-N214 PolarHBondContact O-ND2 3.43Å; N82-N214 HydrophobicContact CB-CB 4.33Å; N82-N214 WeakPolarHBondContact CB-ND2 3.47Å; N82-N214 VanDerWaalsContact CG-CG 3.44Å; N82-N214 WeakPolarHBondContact OD1-CA 3.43Å; P83-N214 VanDerWaalsContact CD-OD1 3.23Å; P83-N214 WeakPolarHBondContact CD-OD1 3.47Å; P212-N214 WeakPolarHBondContact O-CB 3.36Å; P212-N214 PolarHBondContact O-N 3.34Å; N214-A216 VanDerWaalsContact C-N 3.29Å; N214-A216 PolarHBondContact O-N 3.42Å; N214-A216 PolarHBondContact OD1-N 3.03Å; N214-R217 HydrophobicContact CB-CB 3.69Å; N214-R217 WeakPolarHBondContact O-CB 3.43Å; N214-R217 PolarHBondContact O-N 2.92Å; N214-R217 PolarHBondContact OD1-N 3.34Å; N214-R217 VanDerWaalsContact OD1-N 3.15Å; N214-D218 PolarHBondContact O-N 3.44Å | ||
| 215 | P | 98.9 | Very high | 97.9 | Very high | 8 Ų | 8 | 18.9 Ų | 18.9 | 5% | 0.052 | 12% | 0.115 | C | C | . | . | H | α-helix | trans | -58.5 | -35.6 | -179.2 | -29.9 | 38 | 0 | 0 | 0 | 114.3 | N82 P83 D218 L219 P245 V246 P249 L250 | N82-P215 WeakPolarHBondContact OD1-CD 3.43Å; P83-P215 HydrophobicContact CB-CB 4.06Å; P83-P215 HydrophobicContact CB-CG 4.04Å; P83-P215 HydrophobicContact CG-CB 4.03Å; P83-P215 HydrophobicContact CG-CG 4.45Å; P215-D218 PolarHBondContact O-N 2.8Å; P215-L219 WeakPolarHBondContact O-CB 3.39Å; P215-L219 PolarHBondContact O-N 3.18Å; P215-P245 WeakPolarHBondContact CA-O 3.38Å; P215-V246 HydrophobicContact CB-CG1 4.48Å; P215-V246 WeakPolarHBondContact CG-O 3.43Å; P215-P249 HydrophobicContact CG-CB 4.12Å; P215-L250 HydrophobicContact CG-CD2 4.04Å; P215-L250 HydrophobicContact CG-CG 4.14Å |
| 216 | A | 98.8 | Very high | 98 | Very high | 0 Ų | 0 | 22.1 Ų | 22.1 | 0% | 0 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -71.9 | -36.4 | 179.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | P83 Q107 L108 A111 N214 D218 G220 P221 | P83-A216 HydrophobicContact CG-CB 3.73Å; Q107-A216 HydrophobicContact CB-CB 3.73Å; L108-A216 HydrophobicContact CD2-CB 4.27Å; L108-A216 HydrophobicContact CG-CB 4.34Å; A111-A216 VanDerWaalsContact CB-O 3.24Å; A111-A216 WeakPolarHBondContact CB-O 3.46Å; N214-A216 VanDerWaalsContact C-N 3.29Å; N214-A216 PolarHBondContact O-N 3.42Å; N214-A216 PolarHBondContact OD1-N 3.03Å; A216-D218 PolarHBondContact O-N 3.48Å; A216-G220 PolarHBondContact O-N 3.29Å; A216-P221 WeakPolarHBondContact O-CD 3.5Å |
| 217 | R | 98.7 | Very high | 98.1 | Very high | 29 Ų | 29 | 26.6 Ų | 26.6 | 11% | 0.109 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -64.4 | -19.6 | 176.3 | 174.6 | -92.8 | 176.8 | -84.8 | 2.3 | 113.4 | M35 F146 N214 P221 | M35-R217 HydrophobicContact CE-CB 4.37Å; M35-R217 HydrophobicContact CE-CG 3.89Å; M35-R217 WeakPolarHBondContact CE-O 3.47Å; M35-R217 HydrophobicContact SD-CB 3.68Å; M35-R217 HydrophobicContact SD-CG 3.47Å; M35-R217 WeakPolarHBondContact SD-CG 3.42Å; F146-R217 PolarHBondContact O-NH1 3.18Å; F146-R217 VanDerWaalsContact O-NH1 3.16Å; N214-R217 HydrophobicContact CB-CB 3.69Å; N214-R217 WeakPolarHBondContact O-CB 3.43Å; N214-R217 PolarHBondContact O-N 2.92Å; N214-R217 PolarHBondContact OD1-N 3.34Å; N214-R217 VanDerWaalsContact OD1-N 3.15Å; R217-P221 WeakPolarHBondContact O-CG 3.38Å |
| 218 | D | 98.9 | Very high | 98.1 | Very high | 0 Ų | 0 | 24.1 Ų | 24.1 | 0% | 0 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -105.4 | -55 | 177.8 | -168.4 | -92 | 0 | 0 | 0 | 112.6 | T148 P212 N214 P215 A216 G220 P221 R222 P245 | T148-D218 PolarHBondContact N-OD2 3.05Å; T148-D218 PolarHBondContact OG1-OD2 3.22Å; P212-D218 HydrophobicContact CB-CB 4.37Å; N214-D218 PolarHBondContact O-N 3.44Å; P215-D218 PolarHBondContact O-N 2.8Å; A216-D218 PolarHBondContact O-N 3.48Å; D218-G220 PolarHBondContact O-N 2.73Å; D218-P221 WeakPolarHBondContact O-CD 3.47Å; D218-R222 VanDerWaalsContact CG-NH2 3.26Å; D218-R222 VanDerWaalsContact O-CB 3.23Å; D218-R222 WeakPolarHBondContact O-CB 3.47Å; D218-R222 PolarHBondContact O-N 3.44Å; D218-R222 IonicContact OD1-CZ 3.31Å; D218-R222 VanDerWaalsContact OD1-CZ 3.31Å; D218-R222 IonicContact OD1-NE 3.01Å; D218-R222 PolarHBondContact OD1-NE 2.89Å; D218-R222 IonicContact OD1-NH2 2.73Å; D218-R222 PolarHBondContact OD1-NH2 3.14Å; D218-R222 IonicContact OD2-NH2 3.04Å; D218-R222 PolarHBondContact OD2-NH2 3.01Å; D218-P245 HydrophobicContact CB-CB 3.83Å; D218-P245 HydrophobicContact CB-CG 4Å; D218-P245 WeakPolarHBondContact OD1-CG 3.48Å |
| 219 | L | 98.9 | Very high | 98.1 | Very high | 32 Ų | 32 | 24.8 Ų | 24.8 | 17% | 0.168 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -68.8 | -40.3 | -172.1 | -178.8 | 61.7 | 0 | 0 | 0 | 112.9 | L108 P215 R222 L223 F235 W242 V246 | L108-L219 HydrophobicContact CD2-CB 3.85Å; L108-L219 HydrophobicContact CD2-CD2 4.01Å; L108-L219 HydrophobicContact CD2-CG 4.05Å; P215-L219 WeakPolarHBondContact O-CB 3.39Å; P215-L219 PolarHBondContact O-N 3.18Å; L219-R222 PolarHBondContact O-N 3.29Å; L219-L223 HydrophobicContact CD1-CD1 4.29Å; L219-L223 HydrophobicContact CD1-CG 4.25Å; L219-L223 HydrophobicContact CG-CD1 4.06Å; L219-L223 HydrophobicContact CG-CG 4.48Å; L219-L223 WeakPolarHBondContact O-CB 3.25Å; L219-L223 VanDerWaalsContact O-CG 3.29Å; L219-L223 WeakPolarHBondContact O-CG 3.45Å; L219-L223 PolarHBondContact O-N 2.99Å; L219-F235 HydrophobicContact CD1-CE1 4.22Å; L219-W242 HydrophobicContact CD1-CE3 4.41Å; L219-V246 HydrophobicContact CB-CG2 3.92Å; L219-V246 HydrophobicContact CD1-CG2 4.48Å; L219-V246 HydrophobicContact CD2-CG2 4.13Å; L219-V246 HydrophobicContact CG-CG2 4.4Å |
| 220 | G | 98.8 | Very high | 98.1 | Very high | 1 Ų | 1 | 25.3 Ų | 25.3 | 1% | 0.01 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -59.4 | -54 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112 | F112 A216 D218 R222 L223 F224 | F112-G220 WeakPolarHBondContact CD2-O 3.39Å; A216-G220 PolarHBondContact O-N 3.29Å; D218-G220 PolarHBondContact O-N 2.73Å; G220-R222 VanDerWaalsContact C-N 3.34Å; G220-R222 PolarHBondContact O-N 3.09Å; G220-L223 WeakPolarHBondContact O-CB 3.4Å; G220-L223 PolarHBondContact O-N 3.4Å; G220-F224 PolarHBondContact O-N 3.11Å; G220-F224 VanDerWaalsContact O-N 3.1Å |
| 221 | P | 98.9 | Very high | 98.3 | Very high | 0 Ų | 0 | 24.8 Ų | 24.8 | 0% | 0 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -63.4 | -33.5 | 175.3 | -27 | 37.4 | 0 | 0 | 0 | 114.8 | M35 Q39 A111 S115 F146 A216 R217 D218 F224 T225 | M35-P221 HydrophobicContact CE-CG 3.52Å; Q39-P221 VanDerWaalsContact NE2-CG 3.26Å; A111-P221 HydrophobicContact CB-CG 4.26Å; S115-P221 VanDerWaalsContact OG-CA 3.26Å; S115-P221 WeakPolarHBondContact OG-CA 3.36Å; S115-P221 WeakPolarHBondContact OG-CB 3.15Å; S115-P221 WeakPolarHBondContact OG-CG 3.23Å; F146-P221 HydrophobicContact CB-CB 3.89Å; F146-P221 WeakPolarHBondContact O-CB 3.4Å; A216-P221 WeakPolarHBondContact O-CD 3.5Å; R217-P221 WeakPolarHBondContact O-CG 3.38Å; D218-P221 WeakPolarHBondContact O-CD 3.47Å; P221-F224 WeakPolarHBondContact O-CB 3.46Å; P221-F224 PolarHBondContact O-N 3.25Å; P221-T225 PolarHBondContact O-N 3.43Å; P221-T225 PolarHBondContact O-OG1 3.5Å |
| 222 | R | 98.9 | Very high | 98.5 | Very high | 0 Ų | 0 | 28 Ų | 28 | 0% | 0 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -66.2 | -39.9 | 175.4 | -169.8 | -177.8 | -60.3 | -75.9 | -5.3 | 112.1 | A147 T148 Y149 D218 L219 G220 F224 T225 Y226 V234 F235 W242 | A147-R222 HydrophobicContact CB-CB 3.82Å; A147-R222 HydrophobicContact CB-CG 4.44Å; T148-R222 PolarHBondContact O-NH2 3.32Å; Y149-R222 PolarHBondContact OH-NH1 3.48Å; D218-R222 VanDerWaalsContact CG-NH2 3.26Å; D218-R222 VanDerWaalsContact O-CB 3.23Å; D218-R222 WeakPolarHBondContact O-CB 3.47Å; D218-R222 PolarHBondContact O-N 3.44Å; D218-R222 IonicContact OD1-CZ 3.31Å; D218-R222 VanDerWaalsContact OD1-CZ 3.31Å; D218-R222 IonicContact OD1-NE 3.01Å; D218-R222 PolarHBondContact OD1-NE 2.89Å; D218-R222 IonicContact OD1-NH2 2.73Å; D218-R222 PolarHBondContact OD1-NH2 3.14Å; D218-R222 IonicContact OD2-NH2 3.04Å; D218-R222 PolarHBondContact OD2-NH2 3.01Å; L219-R222 PolarHBondContact O-N 3.29Å; G220-R222 VanDerWaalsContact C-N 3.34Å; G220-R222 PolarHBondContact O-N 3.09Å; R222-F224 VanDerWaalsContact C-N 3.27Å; R222-F224 PolarHBondContact O-N 2.89Å; R222-T225 PolarHBondContact O-N 3.37Å; R222-T225 PolarHBondContact O-OG1 3.4Å; R222-T225 VanDerWaalsContact O-OG1 3.07Å; R222-Y226 WeakPolarHBondContact O-CB 3.25Å; R222-Y226 PolarHBondContact O-N 2.9Å; R222-V234 WeakPolarHBondContact CD-O 3.33Å; R222-V234 HydrophobicContact CG-CB 4.1Å; R222-V234 HydrophobicContact CG-CG2 3.97Å; R222-V234 PolarHBondContact NH1-O 3.15Å; R222-F235 VanDerWaalsContact CD-CE1 3.42Å; R222-F235 HydrophobicContact CG-CD1 4.21Å; R222-F235 HydrophobicContact CG-CE1 3.77Å; R222-F235 HydrophobicContact CG-CZ 3.96Å; R222-W242 VanDerWaalsContact CD-CB 3.47Å |
| 223 | L | 98.9 | Very high | 98.8 | Very high | 72 Ų | 72 | 31.2 Ų | 31.2 | 38% | 0.377 | 18% | 0.182 | S | C | . | . | H | α-helix | trans | -63.4 | -36.1 | 171.7 | -73.8 | 164.8 | 0 | 0 | 0 | 111.4 | F112 L219 G220 Y226 V227 F235 | F112-L223 HydrophobicContact CD2-CB 4.08Å; F112-L223 HydrophobicContact CE2-CB 4.3Å; L219-L223 HydrophobicContact CD1-CD1 4.29Å; L219-L223 HydrophobicContact CD1-CG 4.25Å; L219-L223 HydrophobicContact CG-CD1 4.06Å; L219-L223 HydrophobicContact CG-CG 4.48Å; L219-L223 WeakPolarHBondContact O-CB 3.25Å; L219-L223 VanDerWaalsContact O-CG 3.29Å; L219-L223 WeakPolarHBondContact O-CG 3.45Å; L219-L223 PolarHBondContact O-N 2.99Å; G220-L223 WeakPolarHBondContact O-CB 3.4Å; G220-L223 PolarHBondContact O-N 3.4Å; L223-Y226 WeakPolarHBondContact O-CB 3.39Å; L223-V227 PolarHBondContact O-N 3.3Å; L223-F235 HydrophobicContact CD2-CZ 3.84Å; L223-F235 HydrophobicContact CG-CZ 4.26Å |
| 224 | F | 98.9 | Very high | 98.8 | Very high | 20 Ų | 20 | 31 Ų | 31 | 9% | 0.088 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -63.2 | -52.9 | 173.9 | 171 | -96.7 | 0 | 0 | 0 | 111.5 | F112 G116 Y119 F146 G220 P221 R222 Y226 V227 A228 | F112-F224 HydrophobicContact CD2-CB 3.76Å; F112-F224 HydrophobicContact CE1-CD2 4.48Å; F112-F224 VanDerWaalsContact CE2-CA 3.42Å; F112-F224 HydrophobicContact CE2-CB 3.81Å; F112-F224 HydrophobicContact CE2-CD2 4.46Å; F112-F224 HydrophobicContact CG-CB 4.35Å; F112-F224 HydrophobicContact CZ-CB 4.42Å; F112-F224 HydrophobicContact CZ-CD2 4.25Å; G116-F224 VanDerWaalsContact CA-CE2 3.43Å; Y119-F224 VanDerWaalsContact CB-CZ 3.49Å; Y119-F224 HydrophobicContact CD1-CZ 4.28Å; Y119-F224 HydrophobicContact CD2-CE1 4.14Å; Y119-F224 HydrophobicContact CD2-CZ 4.14Å; Y119-F224 HydrophobicContact CG-CE1 4.07Å; Y119-F224 AromaticContact CG-CZ 3.72Å; Y119-F224 HydrophobicContact CG-CZ 3.72Å; F146-F224 HydrophobicContact CD1-CD1 4.12Å; F146-F224 HydrophobicContact CD1-CE1 4.28Å; F146-F224 HydrophobicContact CE1-CD1 4.23Å; F146-F224 AromaticContact CE1-CE1 3.91Å; F146-F224 HydrophobicContact CE1-CE1 3.91Å; F146-F224 HydrophobicContact CZ-CE1 4.22Å; G220-F224 PolarHBondContact O-N 3.11Å; G220-F224 VanDerWaalsContact O-N 3.1Å; P221-F224 WeakPolarHBondContact O-CB 3.46Å; P221-F224 PolarHBondContact O-N 3.25Å; R222-F224 VanDerWaalsContact C-N 3.27Å; R222-F224 PolarHBondContact O-N 2.89Å; F224-Y226 VanDerWaalsContact C-N 3.26Å; F224-Y226 PolarHBondContact O-N 3.24Å; F224-V227 VanDerWaalsContact O-CG2 3.3Å; F224-V227 WeakPolarHBondContact O-CG2 3.26Å; F224-V227 PolarHBondContact O-N 2.85Å; F224-V227 VanDerWaalsContact O-N 3.12Å; F224-A228 HydrophobicContact CD1-CB 4.22Å; F224-A228 HydrophobicContact CD2-CB 4.31Å; F224-A228 HydrophobicContact CE1-CB 3.76Å; F224-A228 HydrophobicContact CE2-CB 3.84Å; F224-A228 HydrophobicContact CG-CB 4.47Å; F224-A228 HydrophobicContact CZ-CB 3.54Å; F224-A228 WeakPolarHBondContact O-CB 3.41Å; F224-A228 PolarHBondContact O-N 2.98Å |
| 225 | T | 98.9 | Very high | 98.8 | Very high | 0 Ų | 0 | 32.7 Ų | 32.7 | 0% | 0 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -63.2 | -33 | -179 | 49.5 | 0 | 0 | 0 | 0 | 112.7 | F146 P221 R222 V227 A228 G229 W230 | F146-T225 HydrophobicContact CB-CG2 3.55Å; F146-T225 HydrophobicContact CD1-CG2 4.42Å; F146-T225 HydrophobicContact CD2-CG2 3.3Å; F146-T225 HydrophobicContact CE2-CG2 4.1Å; F146-T225 HydrophobicContact CG-CG2 3.5Å; F146-T225 VanDerWaalsContact CG-CG2 3.5Å; P221-T225 PolarHBondContact O-N 3.43Å; P221-T225 PolarHBondContact O-OG1 3.5Å; R222-T225 PolarHBondContact O-N 3.37Å; R222-T225 PolarHBondContact O-OG1 3.4Å; R222-T225 VanDerWaalsContact O-OG1 3.07Å; T225-V227 VanDerWaalsContact C-N 3.35Å; T225-V227 PolarHBondContact O-N 3.38Å; T225-A228 PolarHBondContact O-N 3.34Å; T225-G229 PolarHBondContact O-N 3.48Å; T225-W230 HydrophobicContact CG2-CD2 4.07Å; T225-W230 HydrophobicContact CG2-CE3 3.84Å; T225-W230 HydrophobicContact CG2-CZ3 4.14Å; T225-W230 WeakPolarHBondContact O-CB 3.28Å; T225-W230 PolarHBondContact O-N 2.89Å; T225-W230 VanDerWaalsContact O-N 3.12Å |
| 226 | Y | 98.9 | Very high | 98.8 | Very high | 105 Ų | 105 | 35.9 Ų | 35.9 | 41% | 0.412 | 21% | 0.21 | S | C | . | . | I | π-helix | trans | -53.7 | -49 | 171.8 | 175.8 | -109.3 | 0 | 0 | 0 | 112.4 | R222 L223 F224 G231 P232 V234 F235 | R222-Y226 WeakPolarHBondContact O-CB 3.25Å; R222-Y226 PolarHBondContact O-N 2.9Å; L223-Y226 WeakPolarHBondContact O-CB 3.39Å; F224-Y226 VanDerWaalsContact C-N 3.26Å; F224-Y226 PolarHBondContact O-N 3.24Å; Y226-G231 PolarHBondContact O-N 3.35Å; Y226-P232 HydrophobicContact CE2-CB 4.1Å; Y226-P232 HydrophobicContact CE2-CG 3.97Å; Y226-V234 HydrophobicContact CD2-CG2 4.3Å; Y226-F235 HydrophobicContact CD1-CE2 4.41Å; Y226-F235 AromaticContact CD2-CD2 3.88Å; Y226-F235 HydrophobicContact CD2-CD2 3.88Å; Y226-F235 AromaticContact CD2-CE2 3.82Å; Y226-F235 HydrophobicContact CD2-CE2 3.82Å; Y226-F235 HydrophobicContact CE2-CD2 4.49Å; Y226-F235 HydrophobicContact CG-CD2 4.27Å; Y226-F235 AromaticContact CG-CE2 3.72Å; Y226-F235 HydrophobicContact CG-CE2 3.72Å |
| 227 | V | 98.8 | Very high | 98.8 | Very high | 99 Ų | 99 | 36.4 Ų | 36.4 | 60% | 0.6 | 21% | 0.214 | S | C | * | . | I | π-helix | trans | -87 | -18.4 | -177.8 | -56.9 | 0 | 0 | 0 | 0 | 113.8 | F112 L223 F224 T225 | F112-V227 HydrophobicContact CE2-CG2 4.2Å; F112-V227 HydrophobicContact CZ-CG2 4.08Å; L223-V227 PolarHBondContact O-N 3.3Å; F224-V227 VanDerWaalsContact O-CG2 3.3Å; F224-V227 WeakPolarHBondContact O-CG2 3.26Å; F224-V227 PolarHBondContact O-N 2.85Å; F224-V227 VanDerWaalsContact O-N 3.12Å; T225-V227 VanDerWaalsContact C-N 3.35Å; T225-V227 PolarHBondContact O-N 3.38Å |
| 228 | A | 98.5 | Very high | 98.7 | Very high | 26 Ų | 26 | 36.2 Ų | 36.2 | 22% | 0.215 | 22% | 0.222 | C | C | . | . | I | π-helix | trans | -93.4 | 6.6 | -174.5 | 0 | 0 | 0 | 0 | 0 | 114.5 | F224 T225 W230 | F224-A228 HydrophobicContact CD1-CB 4.22Å; F224-A228 HydrophobicContact CD2-CB 4.31Å; F224-A228 HydrophobicContact CE1-CB 3.76Å; F224-A228 HydrophobicContact CE2-CB 3.84Å; F224-A228 HydrophobicContact CG-CB 4.47Å; F224-A228 HydrophobicContact CZ-CB 3.54Å; F224-A228 WeakPolarHBondContact O-CB 3.41Å; F224-A228 PolarHBondContact O-N 2.98Å; T225-A228 PolarHBondContact O-N 3.34Å; A228-W230 HydrophobicContact CB-CE3 4.4Å; A228-W230 HydrophobicContact CB-CZ3 4.16Å |
| 229 | G | 98.3 | Very high | 98.7 | Very high | 53 Ų | 53 | 42.7 Ų | 42.7 | 55% | 0.546 | 26% | 0.256 | S | S | . | . | I | π-helix | trans | 125.7 | -13 | 167.4 | 0 | 0 | 0 | 0 | 0 | 116.3 | T225 G231 | T225-G229 PolarHBondContact O-N 3.48Å; G229-G231 VanDerWaalsContact C-N 3.3Å |
| 230 | W | 98.8 | Very high | 98.7 | Very high | 12 Ų | 12 | 41.9 Ų | 41.9 | 5% | 0.045 | 26% | 0.256 | C | S | . | . | I | π-helix | trans | -75.4 | -22.4 | 174.4 | -72.4 | -97.7 | 0 | 0 | 0 | 112.6 | Y119 L134 T135 V136 T142 A143 F146 T225 A228 V234 | Y119-W230 AromaticContact CD2-CH2 3.83Å; Y119-W230 HydrophobicContact CD2-CH2 3.83Å; Y119-W230 AromaticContact CD2-CZ3 3.99Å; Y119-W230 HydrophobicContact CD2-CZ3 3.99Å; Y119-W230 AromaticContact CE2-CH2 3.77Å; Y119-W230 HydrophobicContact CE2-CH2 3.77Å; Y119-W230 AromaticContact CE2-CZ3 3.85Å; Y119-W230 HydrophobicContact CE2-CZ3 3.85Å; L134-W230 HydrophobicContact CB-CD2 3.96Å; L134-W230 HydrophobicContact CB-CE3 4.49Å; L134-W230 HydrophobicContact CB-CG 4.15Å; L134-W230 HydrophobicContact CB-CZ2 4.28Å; L134-W230 HydrophobicContact CD1-CD2 4.25Å; L134-W230 HydrophobicContact CD1-CE3 3.96Å; L134-W230 HydrophobicContact CD1-CH2 3.95Å; L134-W230 HydrophobicContact CD1-CZ2 4.24Å; L134-W230 HydrophobicContact CD1-CZ3 3.8Å; L134-W230 HydrophobicContact CD2-CH2 4.06Å; L134-W230 HydrophobicContact CD2-CZ2 3.79Å; L134-W230 HydrophobicContact CG-CH2 4.48Å; L134-W230 HydrophobicContact CG-CZ2 4.32Å; T135-W230 VanDerWaalsContact O-CD1 3.29Å; T135-W230 PolarHBondContact O-NE1 3.43Å; V136-W230 HydrophobicContact CG2-CB 3.97Å; V136-W230 HydrophobicContact CG2-CG 4.39Å; T142-W230 WeakPolarHBondContact OG1-CZ2 3.42Å; T142-W230 PolarHBondContact OG1-NE1 3.35Å; T142-W230 VanDerWaalsContact OG1-NE1 3.14Å; A143-W230 HydrophobicContact CB-CG 4.26Å; F146-W230 HydrophobicContact CD2-CH2 4.32Å; F146-W230 HydrophobicContact CD2-CZ2 4.38Å; F146-W230 AromaticContact CE2-CH2 3.52Å; F146-W230 HydrophobicContact CE2-CH2 3.52Å; F146-W230 AromaticContact CE2-CZ2 3.79Å; F146-W230 HydrophobicContact CE2-CZ2 3.79Å; F146-W230 HydrophobicContact CE2-CZ3 4.24Å; F146-W230 HydrophobicContact CZ-CH2 4.14Å; T225-W230 HydrophobicContact CG2-CD2 4.07Å; T225-W230 HydrophobicContact CG2-CE3 3.84Å; T225-W230 HydrophobicContact CG2-CZ3 4.14Å; T225-W230 WeakPolarHBondContact O-CB 3.28Å; T225-W230 PolarHBondContact O-N 2.89Å; T225-W230 VanDerWaalsContact O-N 3.12Å; A228-W230 HydrophobicContact CB-CE3 4.4Å; A228-W230 HydrophobicContact CB-CZ3 4.16Å; W230-V234 HydrophobicContact CB-CG1 3.59Å; W230-V234 HydrophobicContact CG-CG1 4.46Å |
| 231 | G | 98.7 | Very high | 98.7 | Very high | 16 Ų | 16 | 41.9 Ų | 41.9 | 17% | 0.165 | 26% | 0.256 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 71.8 | -164.5 | 172.5 | 0 | 0 | 0 | 0 | 0 | 114.4 | Y226 G229 E233 V234 | Y226-G231 PolarHBondContact O-N 3.35Å; G229-G231 VanDerWaalsContact C-N 3.3Å; G231-E233 PolarHBondContact O-N 3.09Å; G231-E233 VanDerWaalsContact O-N 3.12Å; G231-V234 WeakPolarHBondContact O-CG2 3.42Å; G231-V234 PolarHBondContact O-N 2.81Å |
| 232 | P | 98.6 | Very high | 98.7 | Very high | 92 Ų | 92 | 46.7 Ų | 46.7 | 60% | 0.597 | 27% | 0.274 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.4 | -18.7 | -170.8 | -21.5 | 31.9 | 0 | 0 | 0 | 115.5 | Y226 V234 F235 | Y226-P232 HydrophobicContact CE2-CB 4.1Å; Y226-P232 HydrophobicContact CE2-CG 3.97Å; P232-V234 PolarHBondContact O-N 3.41Å; P232-V234 VanDerWaalsContact O-N 3.13Å; P232-F235 PolarHBondContact O-N 3.49Å |
| 233 | E | 98.8 | Very high | 98.7 | Very high | 74 Ų | 74 | 50.9 Ų | 50.9 | 35% | 0.346 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -59.8 | -27.2 | -177.2 | -169.5 | -175 | 168.6 | 0 | 0 | 112.1 | V136 T137 G231 F235 S236 A237 | V136-E233 HydrophobicContact CB-CB 4.16Å; V136-E233 HydrophobicContact CB-CG 3.84Å; V136-E233 HydrophobicContact CG1-CG 4.21Å; V136-E233 HydrophobicContact CG2-CB 3.79Å; V136-E233 HydrophobicContact CG2-CG 4.07Å; T137-E233 PolarHBondContact OG1-OE1 3.42Å; G231-E233 PolarHBondContact O-N 3.09Å; G231-E233 VanDerWaalsContact O-N 3.12Å; E233-F235 PolarHBondContact O-N 3.39Å; E233-S236 WeakPolarHBondContact CA-OG 3.44Å; E233-S236 PolarHBondContact O-N 3.33Å; E233-S236 PolarHBondContact O-OG 3.39Å; E233-A237 WeakPolarHBondContact O-CB 3.5Å; E233-A237 PolarHBondContact O-N 2.79Å |
| 234 | V | 98.8 | Very high | 98.7 | Very high | 0 Ų | 0 | 47.5 Ų | 47.5 | 0% | 0 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -59.9 | -19.7 | 176.1 | -53.9 | 0 | 0 | 0 | 0 | 113.3 | V136 Y149 R222 Y226 W230 G231 P232 | V136-V234 HydrophobicContact CG2-CG1 3.6Å; Y149-V234 WeakPolarHBondContact OH-CB 3.37Å; R222-V234 WeakPolarHBondContact CD-O 3.33Å; R222-V234 HydrophobicContact CG-CB 4.1Å; R222-V234 HydrophobicContact CG-CG2 3.97Å; R222-V234 PolarHBondContact NH1-O 3.15Å; Y226-V234 HydrophobicContact CD2-CG2 4.3Å; W230-V234 HydrophobicContact CB-CG1 3.59Å; W230-V234 HydrophobicContact CG-CG1 4.46Å; G231-V234 WeakPolarHBondContact O-CG2 3.42Å; G231-V234 PolarHBondContact O-N 2.81Å; P232-V234 PolarHBondContact O-N 3.41Å; P232-V234 VanDerWaalsContact O-N 3.13Å |
| 235 | F | 98.9 | Very high | 98.7 | Very high | 48 Ų | 48 | 46.5 Ų | 46.5 | 21% | 0.211 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -104.5 | -11.8 | 175.8 | -67.7 | -71.9 | 0 | 0 | 0 | 113.7 | L219 R222 L223 Y226 P232 E233 G240 W242 | L219-F235 HydrophobicContact CD1-CE1 4.22Å; R222-F235 VanDerWaalsContact CD-CE1 3.42Å; R222-F235 HydrophobicContact CG-CD1 4.21Å; R222-F235 HydrophobicContact CG-CE1 3.77Å; R222-F235 HydrophobicContact CG-CZ 3.96Å; L223-F235 HydrophobicContact CD2-CZ 3.84Å; L223-F235 HydrophobicContact CG-CZ 4.26Å; Y226-F235 HydrophobicContact CD1-CE2 4.41Å; Y226-F235 AromaticContact CD2-CD2 3.88Å; Y226-F235 HydrophobicContact CD2-CD2 3.88Å; Y226-F235 AromaticContact CD2-CE2 3.82Å; Y226-F235 HydrophobicContact CD2-CE2 3.82Å; Y226-F235 HydrophobicContact CE2-CD2 4.49Å; Y226-F235 HydrophobicContact CG-CD2 4.27Å; Y226-F235 AromaticContact CG-CE2 3.72Å; Y226-F235 HydrophobicContact CG-CE2 3.72Å; P232-F235 PolarHBondContact O-N 3.49Å; E233-F235 PolarHBondContact O-N 3.39Å; F235-G240 WeakPolarHBondContact O-CA 3.47Å; F235-W242 HydrophobicContact CD1-CB 3.67Å; F235-W242 AromaticContact CD1-CD2 3.97Å; F235-W242 HydrophobicContact CD1-CD2 3.97Å; F235-W242 HydrophobicContact CD1-CE3 4.45Å; F235-W242 AromaticContact CD1-CG 3.61Å; F235-W242 HydrophobicContact CD1-CG 3.61Å; F235-W242 HydrophobicContact CE1-CB 4.28Å; F235-W242 HydrophobicContact CE1-CD2 4.48Å; F235-W242 HydrophobicContact CE1-CG 4.4Å |
| 236 | S | 98.6 | Very high | 98.7 | Very high | 75 Ų | 75 | 47.9 Ų | 47.9 | 52% | 0.524 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -103.9 | -25.3 | 177.8 | 62.2 | 0 | 0 | 0 | 0 | 113.9 | E233 G240 | E233-S236 WeakPolarHBondContact CA-OG 3.44Å; E233-S236 PolarHBondContact O-N 3.33Å; E233-S236 PolarHBondContact O-OG 3.39Å; S236-G240 PolarHBondContact O-N 3.02Å |
| 237 | A | 98.5 | Very high | 98.7 | Very high | 10 Ų | 10 | 45.9 Ų | 45.9 | 8% | 0.083 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -57.4 | 148.7 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | V136 T137 Y149 E233 N239 G240 W241 | V136-A237 HydrophobicContact CG1-CB 3.72Å; T137-A237 HydrophobicContact CG2-CB 4.21Å; Y149-A237 HydrophobicContact CD1-CB 3.94Å; Y149-A237 HydrophobicContact CE1-CB 3.91Å; E233-A237 WeakPolarHBondContact O-CB 3.5Å; E233-A237 PolarHBondContact O-N 2.79Å; A237-N239 PolarHBondContact O-N 3.14Å; A237-G240 PolarHBondContact O-N 3.43Å; A237-W241 WeakPolarHBondContact O-CB 3.4Å; A237-W241 PolarHBondContact O-N 3.47Å |
| 238 | G | 98.3 | Very high | 98.7 | Very high | 26 Ų | 26 | 41.1 Ų | 41.1 | 27% | 0.268 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | 62.9 | 38.6 | -177.6 | 0 | 0 | 0 | 0 | 0 | 113.5 | G240 W241 | G238-G240 VanDerWaalsContact C-N 3.33Å; G238-G240 PolarHBondContact O-N 3.19Å; G238-W241 PolarHBondContact O-N 2.96Å |
| 239 | N | 98.3 | Very high | 98.7 | Very high | 135 Ų | 135 | 39.9 Ų | 39.9 | 72% | 0.722 | 24% | 0.235 | S | C | * | . | H | α-helix | trans | 60.1 | 38.4 | -177.7 | -50.7 | 100.7 | 0 | 0 | 0 | 113.4 | L156 A237 | L156-N239 HydrophobicContact CD1-CB 4.2Å; L156-N239 HydrophobicContact CG-CB 4.29Å; A237-N239 PolarHBondContact O-N 3.14Å |
| 240 | G | 98.4 | Very high | 98.7 | Very high | 16 Ų | 16 | 39.8 Ų | 39.8 | 17% | 0.165 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | 76.6 | 44.7 | -174.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | F235 S236 A237 G238 W242 W243 | F235-G240 WeakPolarHBondContact O-CA 3.47Å; S236-G240 PolarHBondContact O-N 3.02Å; A237-G240 PolarHBondContact O-N 3.43Å; G238-G240 VanDerWaalsContact C-N 3.33Å; G238-G240 PolarHBondContact O-N 3.19Å; G240-W242 PolarHBondContact O-N 3.36Å; G240-W242 VanDerWaalsContact O-N 3.16Å; G240-W243 PolarHBondContact O-NE1 3.39Å; G240-W243 VanDerWaalsContact O-NE1 3.14Å |
| 241 | W | 98.8 | Very high | 98.7 | Very high | 1 Ų | 1 | 41.8 Ų | 41.8 | 0% | 0.004 | 24% | 0.235 | C | C | . | . | G | 310 helix | trans | -56.8 | -31.6 | -172.5 | 173.5 | -111.3 | 0 | 0 | 0 | 115.1 | T148 P150 L154 L156 C209 A237 G238 W243 V244 P245 | T148-W241 PolarHBondContact O-NE1 3.46Å; P150-W241 HydrophobicContact CB-CD2 4.04Å; P150-W241 HydrophobicContact CB-CE3 3.81Å; P150-W241 HydrophobicContact CB-CH2 4.41Å; P150-W241 HydrophobicContact CB-CZ3 4.01Å; P150-W241 VanDerWaalsContact CD-CG 3.48Å; P150-W241 HydrophobicContact CG-CB 4.16Å; P150-W241 HydrophobicContact CG-CD2 3.82Å; P150-W241 HydrophobicContact CG-CE3 3.8Å; P150-W241 HydrophobicContact CG-CG 3.99Å; P150-W241 HydrophobicContact CG-CZ3 4.48Å; L154-W241 HydrophobicContact CD2-CH2 4.26Å; L154-W241 HydrophobicContact CD2-CZ3 4.27Å; L156-W241 HydrophobicContact CD2-CE3 4.19Å; C209-W241 HydrophobicContact CB-CH2 3.58Å; C209-W241 HydrophobicContact CB-CZ2 3.38Å; A237-W241 WeakPolarHBondContact O-CB 3.4Å; A237-W241 PolarHBondContact O-N 3.47Å; G238-W241 PolarHBondContact O-N 2.96Å; W241-W243 PolarHBondContact O-N 2.87Å; W241-V244 HydrophobicContact CD2-CB 4.23Å; W241-V244 HydrophobicContact CE3-CB 3.93Å; W241-V244 HydrophobicContact CE3-CG1 4.29Å; W241-V244 HydrophobicContact CE3-CG2 3.91Å; W241-V244 HydrophobicContact CH2-CB 4.04Å; W241-V244 HydrophobicContact CH2-CG1 3.57Å; W241-V244 HydrophobicContact CZ2-CB 4.34Å; W241-V244 HydrophobicContact CZ2-CG1 4.14Å; W241-V244 HydrophobicContact CZ3-CB 3.83Å; W241-V244 HydrophobicContact CZ3-CG1 3.67Å; W241-V244 HydrophobicContact CZ3-CG2 3.97Å; W241-V244 WeakPolarHBondContact O-CB 3.47Å; W241-V244 PolarHBondContact O-N 2.91Å; W241-P245 WeakPolarHBondContact O-CD 3.48Å |
| 242 | W | 98.8 | Very high | 98.7 | Very high | 101 Ų | 101 | 41 Ų | 41 | 38% | 0.383 | 23% | 0.227 | S | C | . | . | G | 310 helix | trans | -49.7 | -31 | -166.1 | 72.4 | -85.2 | 0 | 0 | 0 | 116.3 | L219 R222 F235 G240 P245 V246 | L219-W242 HydrophobicContact CD1-CE3 4.41Å; R222-W242 VanDerWaalsContact CD-CB 3.47Å; F235-W242 HydrophobicContact CD1-CB 3.67Å; F235-W242 AromaticContact CD1-CD2 3.97Å; F235-W242 HydrophobicContact CD1-CD2 3.97Å; F235-W242 HydrophobicContact CD1-CE3 4.45Å; F235-W242 AromaticContact CD1-CG 3.61Å; F235-W242 HydrophobicContact CD1-CG 3.61Å; F235-W242 HydrophobicContact CE1-CB 4.28Å; F235-W242 HydrophobicContact CE1-CD2 4.48Å; F235-W242 HydrophobicContact CE1-CG 4.4Å; G240-W242 PolarHBondContact O-N 3.36Å; G240-W242 VanDerWaalsContact O-N 3.16Å; W242-P245 WeakPolarHBondContact O-CD 3.42Å; W242-V246 WeakPolarHBondContact O-CG2 3.41Å |
| 243 | W | 98.8 | Very high | 98.7 | Very high | 88 Ų | 88 | 36.6 Ų | 36.6 | 33% | 0.333 | 20% | 0.199 | S | C | . | . | G | 310 helix | trans | -79.7 | -23.5 | -177.5 | 67.1 | -94.4 | 0 | 0 | 0 | 112.2 | L156 F160 G240 W241 V246 V247 | L156-W243 HydrophobicContact CB-CZ2 4.49Å; L156-W243 HydrophobicContact CD1-CZ2 4.31Å; L156-W243 HydrophobicContact CD2-CZ2 4.43Å; F160-W243 AromaticContact CD2-CH2 3.9Å; F160-W243 HydrophobicContact CD2-CH2 3.9Å; F160-W243 AromaticContact CD2-CZ3 3.52Å; F160-W243 HydrophobicContact CD2-CZ3 3.52Å; F160-W243 HydrophobicContact CE2-CH2 4.43Å; F160-W243 AromaticContact CE2-CZ3 3.69Å; F160-W243 HydrophobicContact CE2-CZ3 3.69Å; G240-W243 PolarHBondContact O-NE1 3.39Å; G240-W243 VanDerWaalsContact O-NE1 3.14Å; W241-W243 PolarHBondContact O-N 2.87Å; W243-V246 PolarHBondContact O-N 3.2Å; W243-V247 HydrophobicContact CE3-CB 4.31Å; W243-V247 HydrophobicContact CE3-CG2 4.33Å; W243-V247 WeakPolarHBondContact O-CG2 3.41Å; W243-V247 PolarHBondContact O-N 3.27Å |
| 244 | V | 98.9 | Very high | 98.7 | Very high | 0 Ų | 0 | 35.9 Ų | 35.9 | 0% | 0 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -61.3 | -55.9 | 179.3 | 179 | 0 | 0 | 0 | 0 | 111.5 | L156 F160 Q163 W241 V246 V247 A248 P249 | L156-V244 HydrophobicContact CD2-CG2 3.9Å; F160-V244 HydrophobicContact CB-CG1 4.29Å; F160-V244 HydrophobicContact CD2-CG1 4.4Å; Q163-V244 HydrophobicContact CG-CG1 4.4Å; W241-V244 HydrophobicContact CD2-CB 4.23Å; W241-V244 HydrophobicContact CE3-CB 3.93Å; W241-V244 HydrophobicContact CE3-CG1 4.29Å; W241-V244 HydrophobicContact CE3-CG2 3.91Å; W241-V244 HydrophobicContact CH2-CB 4.04Å; W241-V244 HydrophobicContact CH2-CG1 3.57Å; W241-V244 HydrophobicContact CZ2-CB 4.34Å; W241-V244 HydrophobicContact CZ2-CG1 4.14Å; W241-V244 HydrophobicContact CZ3-CB 3.83Å; W241-V244 HydrophobicContact CZ3-CG1 3.67Å; W241-V244 HydrophobicContact CZ3-CG2 3.97Å; W241-V244 WeakPolarHBondContact O-CB 3.47Å; W241-V244 PolarHBondContact O-N 2.91Å; V244-V246 PolarHBondContact O-N 2.93Å; V244-V247 PolarHBondContact O-N 2.86Å; V244-A248 HydrophobicContact CG1-CB 4.11Å; V244-A248 WeakPolarHBondContact O-CB 3.29Å; V244-A248 PolarHBondContact O-N 3.08Å; V244-P249 WeakPolarHBondContact O-CD 3.14Å |
| 245 | P | 98.7 | Very high | 98.7 | Very high | 0 Ų | 0 | 40.3 Ų | 40.3 | 0% | 0 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -68.8 | -4.3 | 177.8 | 29.9 | -36.5 | 0 | 0 | 0 | 113.8 | P212 P215 D218 W241 W242 P249 | P212-P245 HydrophobicContact CB-CB 4.13Å; P212-P245 HydrophobicContact CG-CB 3.62Å; P215-P245 WeakPolarHBondContact CA-O 3.38Å; D218-P245 HydrophobicContact CB-CB 3.83Å; D218-P245 HydrophobicContact CB-CG 4Å; D218-P245 WeakPolarHBondContact OD1-CG 3.48Å; W241-P245 WeakPolarHBondContact O-CD 3.48Å; W242-P245 WeakPolarHBondContact O-CD 3.42Å; P245-P249 WeakPolarHBondContact O-CD 3.26Å; P245-P249 VanDerWaalsContact O-CG 3.29Å; P245-P249 WeakPolarHBondContact O-CG 3.45Å |
| 246 | V | 98.8 | Very high | 98.7 | Very high | 29 Ų | 29 | 38.2 Ų | 38.2 | 18% | 0.176 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -91.8 | -51.4 | 171.2 | 178 | 0 | 0 | 0 | 0 | 111.2 | P215 L219 W242 W243 V244 L250 | P215-V246 HydrophobicContact CB-CG1 4.48Å; P215-V246 WeakPolarHBondContact CG-O 3.43Å; L219-V246 HydrophobicContact CB-CG2 3.92Å; L219-V246 HydrophobicContact CD1-CG2 4.48Å; L219-V246 HydrophobicContact CD2-CG2 4.13Å; L219-V246 HydrophobicContact CG-CG2 4.4Å; W242-V246 WeakPolarHBondContact O-CG2 3.41Å; W243-V246 PolarHBondContact O-N 3.2Å; V244-V246 PolarHBondContact O-N 2.93Å; V246-L250 WeakPolarHBondContact O-CG 3.35Å |
| 247 | V | 98.9 | Very high | 98.7 | Very high | 62 Ų | 62 | 34.6 Ų | 34.6 | 38% | 0.376 | 19% | 0.189 | S | C | . | . | H | α-helix | trans | -86.2 | -45.3 | -172.3 | -180 | 0 | 0 | 0 | 0 | 111.9 | F160 W243 V244 L250 V251 | F160-V247 HydrophobicContact CE2-CB 4.33Å; F160-V247 HydrophobicContact CE2-CG1 4.04Å; F160-V247 HydrophobicContact CZ-CG1 4.38Å; W243-V247 HydrophobicContact CE3-CB 4.31Å; W243-V247 HydrophobicContact CE3-CG2 4.33Å; W243-V247 WeakPolarHBondContact O-CG2 3.41Å; W243-V247 PolarHBondContact O-N 3.27Å; V244-V247 PolarHBondContact O-N 2.86Å; V247-L250 WeakPolarHBondContact O-CB 3.47Å; V247-L250 PolarHBondContact O-N 2.95Å; V247-L250 VanDerWaalsContact O-N 3.11Å; V247-V251 HydrophobicContact CG1-CG2 4.35Å; V247-V251 PolarHBondContact O-N 2.9Å; V247-V251 VanDerWaalsContact O-N 3.11Å |
| 248 | A | 98.8 | Very high | 98.7 | Very high | 0 Ų | 0 | 36.2 Ų | 36.2 | 0% | 0 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -61.4 | -41.3 | -174.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | F160 Q163 V164 V244 L250 V251 G252 | F160-A248 HydrophobicContact CD1-CB 4.44Å; F160-A248 HydrophobicContact CD2-CB 3.6Å; F160-A248 HydrophobicContact CE2-CB 3.68Å; F160-A248 HydrophobicContact CG-CB 3.99Å; F160-A248 HydrophobicContact CZ-CB 4.16Å; Q163-A248 HydrophobicContact CB-CB 3.54Å; V164-A248 HydrophobicContact CG2-CB 4.1Å; V244-A248 HydrophobicContact CG1-CB 4.11Å; V244-A248 WeakPolarHBondContact O-CB 3.29Å; V244-A248 PolarHBondContact O-N 3.08Å; A248-L250 VanDerWaalsContact C-N 3.32Å; A248-L250 PolarHBondContact O-N 2.89Å; A248-V251 PolarHBondContact O-N 3.18Å; A248-G252 PolarHBondContact O-N 2.67Å |
| 249 | P | 98.9 | Very high | 98.7 | Very high | 0 Ų | 0 | 38.2 Ų | 38.2 | 0% | 0 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -63.4 | -33.9 | 174.4 | -28.7 | 40.2 | 0 | 0 | 0 | 114.1 | A84 T167 P215 V244 P245 G252 A253 | A84-P249 HydrophobicContact CB-CB 4.17Å; T167-P249 HydrophobicContact CG2-CB 3.89Å; T167-P249 VanDerWaalsContact CG2-O 3.24Å; T167-P249 WeakPolarHBondContact CG2-O 3.47Å; T167-P249 WeakPolarHBondContact OG1-CA 3.45Å; T167-P249 WeakPolarHBondContact OG1-CB 3.46Å; P215-P249 HydrophobicContact CG-CB 4.12Å; V244-P249 WeakPolarHBondContact O-CD 3.14Å; P245-P249 WeakPolarHBondContact O-CD 3.26Å; P245-P249 VanDerWaalsContact O-CG 3.29Å; P245-P249 WeakPolarHBondContact O-CG 3.45Å; P249-G252 PolarHBondContact O-N 3.24Å; P249-A253 VanDerWaalsContact O-CB 3.27Å; P249-A253 WeakPolarHBondContact O-CB 3.4Å; P249-A253 PolarHBondContact O-N 3.31Å |
| 250 | L | 98.9 | Very high | 98.7 | Very high | 51 Ų | 51 | 32.1 Ų | 32.1 | 27% | 0.267 | 18% | 0.177 | S | C | . | . | H | α-helix | trans | -67.4 | -41 | 176.3 | -60.6 | 177.7 | 0 | 0 | 0 | 111.2 | P83 A84 L87 P215 V246 V247 A248 A253 T254 | P83-L250 HydrophobicContact CB-CD2 4.33Å; A84-L250 HydrophobicContact CB-CD2 4.21Å; L87-L250 HydrophobicContact CD2-CB 4.06Å; L87-L250 HydrophobicContact CD2-CD2 4.07Å; P215-L250 HydrophobicContact CG-CD2 4.04Å; P215-L250 HydrophobicContact CG-CG 4.14Å; V246-L250 WeakPolarHBondContact O-CG 3.35Å; V247-L250 WeakPolarHBondContact O-CB 3.47Å; V247-L250 PolarHBondContact O-N 2.95Å; V247-L250 VanDerWaalsContact O-N 3.11Å; A248-L250 VanDerWaalsContact C-N 3.32Å; A248-L250 PolarHBondContact O-N 2.89Å; L250-A253 PolarHBondContact O-N 3.34Å; L250-T254 WeakPolarHBondContact O-CB 3.28Å; L250-T254 PolarHBondContact O-N 3.21Å; L250-T254 PolarHBondContact O-OG1 3.26Å |
| 251 | V | 98.9 | Very high | 98.7 | Very high | 53 Ų | 53 | 34.6 Ų | 34.6 | 32% | 0.321 | 18% | 0.184 | S | C | . | . | H | α-helix | trans | -63.7 | -49.4 | 173.5 | 174.8 | 0 | 0 | 0 | 0 | 110.4 | F160 V164 V247 A248 A253 T254 L255 | F160-V251 HydrophobicContact CZ-CB 4.46Å; F160-V251 HydrophobicContact CZ-CG2 4.13Å; V164-V251 HydrophobicContact CG1-CG1 4.43Å; V164-V251 HydrophobicContact CG2-CB 4.07Å; V164-V251 HydrophobicContact CG2-CG1 3.91Å; V247-V251 HydrophobicContact CG1-CG2 4.35Å; V247-V251 PolarHBondContact O-N 2.9Å; V247-V251 VanDerWaalsContact O-N 3.11Å; A248-V251 PolarHBondContact O-N 3.18Å; V251-A253 VanDerWaalsContact C-N 3.3Å; V251-A253 PolarHBondContact O-N 2.89Å; V251-T254 WeakPolarHBondContact O-CB 3.32Å; V251-T254 PolarHBondContact O-N 2.81Å; V251-L255 HydrophobicContact CG1-CD1 3.96Å; V251-L255 HydrophobicContact CG1-CG 4.38Å; V251-L255 WeakPolarHBondContact O-CG 3.12Å; V251-L255 PolarHBondContact O-N 2.83Å |
| 252 | G | 98.8 | Very high | 98.6 | Very high | 0 Ų | 0 | 39.7 Ų | 39.7 | 0% | 0 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -56.5 | -43.4 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | V164 G168 A248 P249 L255 G256 | V164-G252 VanDerWaalsContact O-CA 3.23Å; V164-G252 WeakPolarHBondContact O-CA 3.28Å; G168-G252 VanDerWaalsContact CA-O 3.24Å; G168-G252 WeakPolarHBondContact CA-O 3.17Å; A248-G252 PolarHBondContact O-N 2.67Å; P249-G252 PolarHBondContact O-N 3.24Å; G252-L255 PolarHBondContact O-N 2.56Å; G252-G256 PolarHBondContact O-N 3.38Å |
| 253 | A | 98.8 | Very high | 98.6 | Very high | 0 Ų | 0 | 40.6 Ų | 40.6 | 0% | 0 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -67.2 | -38.3 | 178.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | A84 T167 M171 P249 L250 V251 T257 | A84-A253 HydrophobicContact CB-CB 3.79Å; A84-A253 WeakPolarHBondContact O-CB 2.99Å; T167-A253 HydrophobicContact CG2-CB 4.19Å; M171-A253 HydrophobicContact CE-CB 4.29Å; M171-A253 HydrophobicContact CG-CB 3.42Å; M171-A253 VanDerWaalsContact CG-CB 3.42Å; M171-A253 HydrophobicContact SD-CB 4.03Å; P249-A253 VanDerWaalsContact O-CB 3.27Å; P249-A253 WeakPolarHBondContact O-CB 3.4Å; P249-A253 PolarHBondContact O-N 3.31Å; L250-A253 PolarHBondContact O-N 3.34Å; V251-A253 VanDerWaalsContact C-N 3.3Å; V251-A253 PolarHBondContact O-N 2.89Å; A253-T257 WeakPolarHBondContact O-CB 3.16Å; A253-T257 PolarHBondContact O-N 2.84Å; A253-T257 PolarHBondContact O-OG1 3.06Å |
| 254 | T | 98.8 | Very high | 98.5 | Very high | 59 Ų | 59 | 38.9 Ų | 38.9 | 36% | 0.362 | 22% | 0.221 | S | C | . | . | H | α-helix | trans | -62.5 | -50.1 | 175 | -56.3 | 0 | 0 | 0 | 0 | 110.7 | I91 L250 V251 T257 A258 | I91-T254 HydrophobicContact CD1-CG2 4.05Å; L250-T254 WeakPolarHBondContact O-CB 3.28Å; L250-T254 PolarHBondContact O-N 3.21Å; L250-T254 PolarHBondContact O-OG1 3.26Å; V251-T254 WeakPolarHBondContact O-CB 3.32Å; V251-T254 PolarHBondContact O-N 2.81Å; T254-T257 PolarHBondContact O-N 3.29Å; T254-A258 PolarHBondContact O-N 2.85Å |
| 255 | L | 98.8 | Very high | 98.1 | Very high | 93 Ų | 93 | 39.2 Ų | 39.2 | 49% | 0.487 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -65.1 | -48.7 | 179.8 | -66.4 | 177.9 | 0 | 0 | 0 | 111.7 | V164 V251 G252 T257 A258 T259 | V164-L255 HydrophobicContact CG1-CD1 3.97Å; V251-L255 HydrophobicContact CG1-CD1 3.96Å; V251-L255 HydrophobicContact CG1-CG 4.38Å; V251-L255 WeakPolarHBondContact O-CG 3.12Å; V251-L255 PolarHBondContact O-N 2.83Å; G252-L255 PolarHBondContact O-N 2.56Å; L255-T257 VanDerWaalsContact C-N 3.29Å; L255-T257 PolarHBondContact O-N 3.08Å; L255-A258 PolarHBondContact O-N 2.67Å; L255-T259 WeakPolarHBondContact O-CB 3.33Å; L255-T259 PolarHBondContact O-N 3.22Å; L255-T259 PolarHBondContact O-OG1 2.86Å |
| 256 | G | 98.8 | Very high | 97.8 | Very high | 3 Ų | 3 | 45.3 Ų | 45.3 | 3% | 0.031 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -60.6 | -38.4 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | V172 G252 T259 Y260 | V172-G256 VanDerWaalsContact CG2-O 3.32Å; V172-G256 WeakPolarHBondContact CG2-O 3.33Å; G252-G256 PolarHBondContact O-N 3.38Å; G256-T259 PolarHBondContact O-N 3.37Å; G256-Y260 PolarHBondContact O-N 2.91Å |
| 257 | T | 98.6 | Very high | 97.6 | Very high | 0 Ų | 0 | 50.6 Ų | 50.6 | 0% | 0 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -63.7 | -48.5 | 173.9 | -59.9 | 0 | 0 | 0 | 0 | 111.4 | A88 I91 V92 L175 A253 T254 L255 T259 Y260 Q261 | A88-T257 VanDerWaalsContact CB-OG1 3.25Å; A88-T257 WeakPolarHBondContact CB-OG1 3.49Å; I91-T257 HydrophobicContact CB-CG2 4.18Å; I91-T257 HydrophobicContact CG2-CG2 3.71Å; V92-T257 HydrophobicContact CG1-CG2 3.44Å; V92-T257 VanDerWaalsContact CG1-CG2 3.44Å; L175-T257 HydrophobicContact CD1-CG2 3.93Å; A253-T257 WeakPolarHBondContact O-CB 3.16Å; A253-T257 PolarHBondContact O-N 2.84Å; A253-T257 PolarHBondContact O-OG1 3.06Å; T254-T257 PolarHBondContact O-N 3.29Å; L255-T257 VanDerWaalsContact C-N 3.29Å; L255-T257 PolarHBondContact O-N 3.08Å; T257-T259 VanDerWaalsContact C-N 3.33Å; T257-T259 PolarHBondContact O-N 3.01Å; T257-Y260 PolarHBondContact O-N 3.43Å; T257-Q261 HydrophobicContact CG2-CG 4.43Å; T257-Q261 VanDerWaalsContact O-CG 3.23Å; T257-Q261 WeakPolarHBondContact O-CG 3.45Å; T257-Q261 PolarHBondContact O-N 3.4Å |
| 258 | A | 98.4 | Very high | 97.3 | Very high | 44 Ų | 44 | 49.3 Ų | 49.3 | 36% | 0.364 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -60 | -43.9 | 177 | 0 | 0 | 0 | 0 | 0 | 111.6 | T254 L255 Q261 L262 | T254-A258 PolarHBondContact O-N 2.85Å; L255-A258 PolarHBondContact O-N 2.67Å; A258-Q261 PolarHBondContact O-N 2.9Å; A258-L262 WeakPolarHBondContact O-CB 3.44Å; A258-L262 VanDerWaalsContact O-CG 3.3Å; A258-L262 WeakPolarHBondContact O-CG 3.37Å; A258-L262 PolarHBondContact O-N 3.48Å |
| 259 | T | 98.6 | Very high | 96.7 | Very high | 67 Ų | 67 | 54.9 Ų | 54.9 | 41% | 0.411 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -59.5 | -48.3 | 176.5 | -60.6 | 0 | 0 | 0 | 0 | 111.9 | L255 G256 T257 Q261 L262 L263 | L255-T259 WeakPolarHBondContact O-CB 3.33Å; L255-T259 PolarHBondContact O-N 3.22Å; L255-T259 PolarHBondContact O-OG1 2.86Å; G256-T259 PolarHBondContact O-N 3.37Å; T257-T259 VanDerWaalsContact C-N 3.33Å; T257-T259 PolarHBondContact O-N 3.01Å; T259-Q261 VanDerWaalsContact C-N 3.34Å; T259-Q261 PolarHBondContact O-N 3.37Å; T259-L262 PolarHBondContact O-N 3.31Å; T259-L263 HydrophobicContact CG2-CD1 3.68Å; T259-L263 HydrophobicContact CG2-CG 4.32Å; T259-L263 WeakPolarHBondContact O-CB 3.31Å; T259-L263 WeakPolarHBondContact O-CG 3.24Å; T259-L263 PolarHBondContact O-N 2.89Å |
| 260 | Y | 98.4 | Very high | 95.7 | Very high | 8 Ų | 8 | 63.7 Ų | 63.7 | 3% | 0.031 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -61.5 | -43.8 | 177.5 | -179.6 | -93.7 | 0 | 0 | 0 | 111.7 | V172 L175 A176 D179 N182 G256 T257 V264 A265 | V172-Y260 HydrophobicContact CG1-CD2 4.33Å; L175-Y260 HydrophobicContact CB-CD1 3.53Å; L175-Y260 HydrophobicContact CB-CD2 4.14Å; L175-Y260 HydrophobicContact CB-CE1 3.82Å; L175-Y260 HydrophobicContact CB-CE2 4.39Å; L175-Y260 HydrophobicContact CB-CG 3.72Å; L175-Y260 HydrophobicContact CD1-CD1 3.96Å; L175-Y260 HydrophobicContact CD1-CG 4.09Å; L175-Y260 HydrophobicContact CG-CD1 4.35Å; A176-Y260 VanDerWaalsContact CA-CE2 3.49Å; A176-Y260 HydrophobicContact CB-CD2 4.36Å; A176-Y260 HydrophobicContact CB-CE2 3.66Å; D179-Y260 HydrophobicContact CB-CE1 4.41Å; D179-Y260 WeakPolarHBondContact CB-OH 3.47Å; D179-Y260 PolarHBondContact OD2-OH 3.27Å; N182-Y260 PolarHBondContact ND2-OH 3.14Å; G256-Y260 PolarHBondContact O-N 2.91Å; T257-Y260 PolarHBondContact O-N 3.43Å; Y260-V264 HydrophobicContact CD2-CB 4.02Å; Y260-V264 HydrophobicContact CD2-CG1 4.42Å; Y260-V264 HydrophobicContact CD2-CG2 4.15Å; Y260-V264 HydrophobicContact CE2-CB 3.76Å; Y260-V264 HydrophobicContact CE2-CG1 3.67Å; Y260-V264 HydrophobicContact CE2-CG2 4.16Å; Y260-V264 WeakPolarHBondContact O-CA 3.46Å; Y260-V264 WeakPolarHBondContact O-CB 3.24Å; Y260-V264 PolarHBondContact O-N 3.43Å; Y260-A265 HydrophobicContact CD1-CB 4.32Å; Y260-A265 HydrophobicContact CE1-CB 4.04Å; Y260-A265 PolarHBondContact O-N 3.34Å |
| 261 | Q | 97.4 | Very high | 94.3 | Very high | 68 Ų | 68 | 68 Ų | 68 | 32% | 0.318 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -60.6 | -50.6 | 179.6 | -69.3 | -76.5 | 49.3 | 0 | 0 | 111.1 | V92 T257 A258 T259 A265 L266 | V92-Q261 HydrophobicContact CG1-CG 4.39Å; T257-Q261 HydrophobicContact CG2-CG 4.43Å; T257-Q261 VanDerWaalsContact O-CG 3.23Å; T257-Q261 WeakPolarHBondContact O-CG 3.45Å; T257-Q261 PolarHBondContact O-N 3.4Å; A258-Q261 PolarHBondContact O-N 2.9Å; T259-Q261 VanDerWaalsContact C-N 3.34Å; T259-Q261 PolarHBondContact O-N 3.37Å; Q261-A265 PolarHBondContact O-N 2.88Å; Q261-L266 WeakPolarHBondContact O-CG 3.43Å; Q261-L266 PolarHBondContact O-N 3.47Å |
| 262 | L | 97.5 | Very high | 92.1 | Very high | 107 Ų | 107 | 71 Ų | 71 | 56% | 0.56 | 39% | 0.39 | S | S | * | . | H | α-helix | trans | -67.5 | -44.3 | -177 | -68.9 | 172.3 | 0 | 0 | 0 | 113 | A258 T259 L266 H267 | A258-L262 WeakPolarHBondContact O-CB 3.44Å; A258-L262 VanDerWaalsContact O-CG 3.3Å; A258-L262 WeakPolarHBondContact O-CG 3.37Å; A258-L262 PolarHBondContact O-N 3.48Å; T259-L262 PolarHBondContact O-N 3.31Å; L262-L266 HydrophobicContact CD2-CD1 4.02Å; L262-H267 PolarHBondContact O-CE1 3.19Å; L262-H267 PolarHBondContact O-ND1 2.94Å |
| 263 | L | 97.7 | Very high | 89.7 | Confident | 120 Ų | 120 | 78.3 Ų | 78.3 | 63% | 0.628 | 42% | 0.424 | S | S | * | . | H | α-helix | trans | -89.6 | -25.2 | -171.2 | -61.5 | -176.4 | 0 | 0 | 0 | 113.9 | T259 H267 | T259-L263 HydrophobicContact CG2-CD1 3.68Å; T259-L263 HydrophobicContact CG2-CG 4.32Å; T259-L263 WeakPolarHBondContact O-CB 3.31Å; T259-L263 WeakPolarHBondContact O-CG 3.24Å; T259-L263 PolarHBondContact O-N 2.89Å; L263-H267 PolarHBondContact O-ND1 3.09Å |
| 264 | V | 96.5 | Very high | 87.2 | Confident | 52 Ų | 52 | 83 Ų | 83 | 32% | 0.315 | 46% | 0.455 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -123 | -55.9 | -173.1 | -177.7 | 0 | 0 | 0 | 0 | 111.5 | Y260 L266 H267 H268 | Y260-V264 HydrophobicContact CD2-CB 4.02Å; Y260-V264 HydrophobicContact CD2-CG1 4.42Å; Y260-V264 HydrophobicContact CD2-CG2 4.15Å; Y260-V264 HydrophobicContact CE2-CB 3.76Å; Y260-V264 HydrophobicContact CE2-CG1 3.67Å; Y260-V264 HydrophobicContact CE2-CG2 4.16Å; Y260-V264 WeakPolarHBondContact O-CA 3.46Å; Y260-V264 WeakPolarHBondContact O-CB 3.24Å; Y260-V264 PolarHBondContact O-N 3.43Å; V264-L266 PolarHBondContact O-N 3.18Å; V264-H267 PolarHBondContact O-N 2.87Å; V264-H267 VanDerWaalsContact O-N 3.09Å; V264-H268 PolarHBondContact O-ND1 2.83Å; V264-H268 VanDerWaalsContact O-ND1 3.1Å |
| 265 | A | 91.5 | Very high | 84.9 | Confident | 7 Ų | 7 | 83.5 Ų | 83.5 | 6% | 0.058 | 46% | 0.464 | C | S | . | . | G | 310 helix | trans | -65.1 | -37.1 | -171 | 0 | 0 | 0 | 0 | 0 | 113.4 | R181 Y260 Q261 H267 | R181-A265 PolarHBondContact NH1-O 3.4Å; Y260-A265 HydrophobicContact CD1-CB 4.32Å; Y260-A265 HydrophobicContact CE1-CB 4.04Å; Y260-A265 PolarHBondContact O-N 3.34Å; Q261-A265 PolarHBondContact O-N 2.88Å; A265-H267 VanDerWaalsContact C-N 3.25Å; A265-H267 PolarHBondContact O-N 2.87Å |
| 266 | L | 93 | Very high | 82.6 | Confident | 128 Ų | 128 | 86 Ų | 86 | 67% | 0.67 | 47% | 0.474 | S | S | * | . | G | 310 helix | trans | -73.9 | -12.2 | 176.6 | -71.8 | -178.3 | 0 | 0 | 0 | 114 | Q261 L262 V264 | Q261-L266 WeakPolarHBondContact O-CG 3.43Å; Q261-L266 PolarHBondContact O-N 3.47Å; L262-L266 HydrophobicContact CD2-CD1 4.02Å; V264-L266 PolarHBondContact O-N 3.18Å |
| 267 | H | 94.5 | Very high | 80.2 | Confident | 141 Ų | 141 | 90.8 Ų | 90.8 | 65% | 0.653 | 50% | 0.499 | S | S | * | . | G | 310 helix | trans | -104.1 | 5.1 | -177.7 | -66.4 | 85.7 | 0 | 0 | 0 | 113 | L262 L263 V264 A265 | L262-H267 PolarHBondContact O-CE1 3.19Å; L262-H267 PolarHBondContact O-ND1 2.94Å; L263-H267 PolarHBondContact O-ND1 3.09Å; V264-H267 PolarHBondContact O-N 2.87Å; V264-H267 VanDerWaalsContact O-N 3.09Å; A265-H267 VanDerWaalsContact C-N 3.25Å; A265-H267 PolarHBondContact O-N 2.87Å |
| 268 | H | 90.8 | Very high | 77.9 | Confident | 35 Ų | 35 | 96.8 Ų | 96.8 | 16% | 0.162 | 53% | 0.53 | C | S | . | . | S | Bend | trans | -67.5 | 145.6 | 169 | -81.2 | 82.7 | 0 | 0 | 0 | 109.9 | D179 R181 N182 V264 E270 | D179-H268 IonicContact OD2-CE1 3.83Å; R181-H268 HydrophobicContact CB-CB 4.48Å; R181-H268 WeakPolarHBondContact CB-CD2 3.37Å; R181-H268 WeakPolarHBondContact CB-NE2 3.35Å; R181-H268 PolarHBondContact O-CD2 2.83Å; R181-H268 PolarHBondContact O-NE2 3.4Å; N182-H268 PolarHBondContact N-NE2 3.33Å; N182-H268 PolarHBondContact OD1-CE1 2.99Å; N182-H268 PolarHBondContact OD1-NE2 2.88Å; N182-H268 VanDerWaalsContact OD1-NE2 3.11Å; V264-H268 PolarHBondContact O-ND1 2.83Å; V264-H268 VanDerWaalsContact O-ND1 3.1Å; H268-E270 PolarHBondContact O-N 3.38Å |
| 269 | P | 86.7 | Confident | 75.8 | Confident | 116 Ų | 116 | 98.7 Ų | 98.7 | 75% | 0.753 | 54% | 0.537 | S | S | * | . | P | Polyproline II helix | trans | -53.8 | 138.1 | 170.9 | -19.7 | 30.7 | 0 | 0 | 0 | 109.5 | D271 | P269-D271 PolarHBondContact O-N 3.27Š|
| 270 | E | 78.8 | Confident | 73.5 | Confident | 186 Ų | 186 | 98.2 Ų | 98.2 | 87% | 0.869 | 54% | 0.536 | S | S | * | . | P | Polyproline II helix | trans | -58.6 | 138.3 | 169 | -64.5 | -175.6 | 163 | 0 | 0 | 108.3 | H268 | H268-E270 PolarHBondContact O-N 3.38Š|
| 271 | D | 68.9 | Low | 71.3 | Confident | 141 Ų | 141 | 100.6 Ų | 100.6 | 75% | 0.754 | 56% | 0.558 | S | S | * | * | P | Polyproline II helix | trans | -55.3 | 130.4 | 171.8 | -74.4 | -41.2 | 0 | 0 | 0 | 107.1 | P269 E273 | P269-D271 PolarHBondContact O-N 3.27Å; D271-E273 PolarHBondContact O-N 3.07Å; D271-E273 VanDerWaalsContact O-N 3.12Å |
| 272 | P | 52.3 | Low | 69.2 | Low | 117 Ų | 117 | 104.1 Ų | 104.1 | 76% | 0.76 | 57% | 0.574 | S | S | * | * | P | Polyproline II helix | trans | -54.2 | 127.9 | 175 | 20.8 | -29.6 | 0 | 0 | 0 | 107.6 | ||
| 273 | E | 48.5 | Very low | 67.1 | Low | 152 Ų | 152 | 104.7 Ų | 104.7 | 71% | 0.71 | 57% | 0.573 | S | S | * | * | trans | -44.2 | 134.3 | 178.2 | -78.1 | -168 | 149.5 | 0 | 0 | 109.1 | D271 A275 | D271-E273 PolarHBondContact O-N 3.07Å; D271-E273 VanDerWaalsContact O-N 3.12Å; E273-A275 PolarHBondContact O-N 2.82Å; E273-A275 VanDerWaalsContact O-N 3.08Å | ||
| 274 | P | 47 | Very low | 64.8 | Low | 100 Ų | 100 | 106.5 Ų | 106.5 | 65% | 0.649 | 58% | 0.576 | S | S | * | * | trans | -52.1 | 127.9 | 175.1 | 20.7 | -29.5 | 0 | 0 | 0 | 107.4 | Q276 | P274-Q276 PolarHBondContact O-N 2.64Š| ||
| 275 | A | 50.4 | Low | 62.7 | Low | 69 Ų | 69 | 106.6 Ų | 106.6 | 57% | 0.57 | 58% | 0.583 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.2 | 44.9 | -173.2 | 0 | 0 | 0 | 0 | 0 | 114.2 | E273 | E273-A275 PolarHBondContact O-N 2.82Å; E273-A275 VanDerWaalsContact O-N 3.08Å |
| 276 | Q | 49.4 | Very low | 60.8 | Low | 146 Ų | 146 | 110.2 Ų | 110.2 | 68% | 0.682 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -88.2 | -21.9 | 173.2 | -74.8 | 179.3 | -33.9 | 0 | 0 | 111.4 | P274 S280 | P274-Q276 PolarHBondContact O-N 2.64Å; Q276-S280 PolarHBondContact O-N 3.2Å; Q276-S280 PolarHBondContact O-OG 3.07Å |
| 277 | D | 48.5 | Very low | 58.8 | Low | 103 Ų | 103 | 110.7 Ų | 110.7 | 55% | 0.551 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -84.4 | -23.7 | 179.8 | -75.1 | 2.5 | 0 | 0 | 0 | 113.5 | S280 A281 | D277-S280 WeakPolarHBondContact CA-OG 3.37Å; D277-S280 PolarHBondContact O-OG 2.91Å; D277-A281 WeakPolarHBondContact O-CB 3.31Å; D277-A281 PolarHBondContact O-N 3.44Å |
| 278 | L | 51.2 | Low | 56.8 | Low | 125 Ų | 125 | 111.5 Ų | 111.5 | 65% | 0.654 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -75.5 | -35.1 | 173.1 | -72.7 | 166.7 | 0 | 0 | 0 | 112.4 | Q282 | L278-Q282 WeakPolarHBondContact O-CB 3.46Å; L278-Q282 WeakPolarHBondContact O-CG 3.14Å; L278-Q282 PolarHBondContact O-N 3.02Å |
| 279 | V | 53.3 | Low | 54.7 | Low | 85 Ų | 85 | 117.7 Ų | 117.7 | 52% | 0.515 | 64% | 0.644 | S | S | . | * | H | α-helix | trans | -72.1 | -38.7 | 176 | -179.2 | 0 | 0 | 0 | 0 | 110.8 | Q282 H283 | V279-Q282 PolarHBondContact O-N 2.94Å; V279-H283 WeakPolarHBondContact O-CB 3.22Å; V279-H283 PolarHBondContact O-N 3.49Å |
| 280 | S | 52 | Low | 52.5 | Low | 57 Ų | 57 | 117.5 Ų | 117.5 | 40% | 0.399 | 64% | 0.64 | S | S | . | * | H | α-helix | trans | -75.4 | -28.4 | 177.3 | 49.4 | 0 | 0 | 0 | 0 | 113 | Q276 D277 K284 | Q276-S280 PolarHBondContact O-N 3.2Å; Q276-S280 PolarHBondContact O-OG 3.07Å; D277-S280 WeakPolarHBondContact CA-OG 3.37Å; D277-S280 PolarHBondContact O-OG 2.91Å; S280-K284 WeakPolarHBondContact O-CB 3.06Å; S280-K284 PolarHBondContact O-N 2.96Å; S280-K284 VanDerWaalsContact O-N 3.09Å |
| 281 | A | 52.3 | Low | 50.7 | Low | 58 Ų | 58 | 113.7 Ų | 113.7 | 48% | 0.479 | 63% | 0.632 | S | S | . | * | H | α-helix | trans | -69.6 | -39.7 | 167.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | D277 A285 | D277-A281 WeakPolarHBondContact O-CB 3.31Å; D277-A281 PolarHBondContact O-N 3.44Å; A281-A285 WeakPolarHBondContact O-CB 3.21Å; A281-A285 PolarHBondContact O-N 3.13Å |
| 282 | Q | 53.3 | Low | 49.6 | Very low | 142 Ų | 142 | 112.5 Ų | 112.5 | 66% | 0.664 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -69 | -36.4 | 174.4 | -79.6 | 177.9 | -32.9 | 0 | 0 | 112.7 | L278 V279 A285 S286 | L278-Q282 WeakPolarHBondContact O-CB 3.46Å; L278-Q282 WeakPolarHBondContact O-CG 3.14Å; L278-Q282 PolarHBondContact O-N 3.02Å; V279-Q282 PolarHBondContact O-N 2.94Å; Q282-A285 PolarHBondContact O-N 3.19Å; Q282-S286 WeakPolarHBondContact O-CB 3.4Å; Q282-S286 PolarHBondContact O-N 2.73Å |
| 283 | H | 51.8 | Low | 49 | Very low | 118 Ų | 118 | 111.8 Ų | 111.8 | 55% | 0.546 | 64% | 0.639 | S | S | . | * | H | α-helix | trans | -66.7 | -41.4 | 174.4 | -118.6 | -63.5 | 0 | 0 | 0 | 112.1 | V279 S286 E287 | V279-H283 WeakPolarHBondContact O-CB 3.22Å; V279-H283 PolarHBondContact O-N 3.49Å; H283-S286 PolarHBondContact O-N 3.04Å; H283-E287 PolarHBondContact O-N 3.13Å; H283-E287 VanDerWaalsContact O-N 3.1Å |
| 284 | K | 50.8 | Low | 48.7 | Very low | 159 Ų | 159 | 109.3 Ų | 109.3 | 69% | 0.691 | 65% | 0.645 | S | S | * | * | H | α-helix | trans | -66.8 | -35.1 | 174.5 | -90.8 | -178.6 | 173.3 | 176.2 | 0 | 113.3 | S280 L288 | S280-K284 WeakPolarHBondContact O-CB 3.06Å; S280-K284 PolarHBondContact O-N 2.96Å; S280-K284 VanDerWaalsContact O-N 3.09Å; K284-L288 PolarHBondContact O-N 2.8Å |
| 285 | A | 52.7 | Low | 48.5 | Very low | 54 Ų | 54 | 113.7 Ų | 113.7 | 45% | 0.446 | 66% | 0.656 | S | S | . | * | H | α-helix | trans | -69.9 | -39.8 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | A281 Q282 E287 L288 E289 | A281-A285 WeakPolarHBondContact O-CB 3.21Å; A281-A285 PolarHBondContact O-N 3.13Å; Q282-A285 PolarHBondContact O-N 3.19Å; A285-E287 PolarHBondContact O-N 3.04Å; A285-L288 PolarHBondContact O-N 3.3Å; A285-E289 PolarHBondContact O-N 2.77Å |
| 286 | S | 50.1 | Low | 48 | Very low | 82 Ų | 82 | 119.1 Ų | 119.1 | 57% | 0.573 | 67% | 0.673 | S | S | * | * | H | α-helix | trans | -68.5 | -29.3 | 177.3 | -177.6 | 0 | 0 | 0 | 0 | 113.7 | Q282 H283 | Q282-S286 WeakPolarHBondContact O-CB 3.4Å; Q282-S286 PolarHBondContact O-N 2.73Å; H283-S286 PolarHBondContact O-N 3.04Å |
| 287 | E | 52.4 | Low | 47.3 | Very low | 138 Ų | 138 | 120.5 Ų | 120.5 | 65% | 0.645 | 68% | 0.684 | S | S | * | * | H | α-helix | trans | -76.2 | -24.5 | 174.9 | -76.5 | 179.5 | 176.8 | 0 | 0 | 112.7 | H283 A285 T290 | H283-E287 PolarHBondContact O-N 3.13Å; H283-E287 VanDerWaalsContact O-N 3.1Å; A285-E287 PolarHBondContact O-N 3.04Å; E287-T290 PolarHBondContact O-OG1 3.36Å |
| 288 | L | 50.8 | Low | 46.8 | Very low | 159 Ų | 159 | 125 Ų | 125 | 83% | 0.832 | 70% | 0.701 | S | S | * | * | H | α-helix | trans | -82.9 | -17.4 | 178.2 | -125.2 | 87.1 | 0 | 0 | 0 | 113.8 | K284 A285 | K284-L288 PolarHBondContact O-N 2.8Å; A285-L288 PolarHBondContact O-N 3.3Å |
| 289 | E | 47 | Very low | 46.1 | Very low | 165 Ų | 165 | 124.1 Ų | 124.1 | 77% | 0.771 | 70% | 0.704 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97 | 13.7 | -175.3 | -75.7 | -169.3 | 165.6 | 0 | 0 | 114.9 | A285 P291 | A285-E289 PolarHBondContact O-N 2.77Å; E289-P291 VanDerWaalsContact O-CD 3.24Å; E289-P291 WeakPolarHBondContact O-CD 3.43Å |
| 290 | T | 40.8 | Very low | 45.2 | Very low | 112 Ų | 112 | 129.1 Ų | 129.1 | 69% | 0.687 | 72% | 0.719 | S | S | * | * | trans | -79.1 | 114.5 | 171.4 | -10.6 | 0 | 0 | 0 | 0 | 110.5 | E287 A292 | E287-T290 PolarHBondContact O-OG1 3.36Å; T290-A292 PolarHBondContact O-N 3.17Å | ||
| 291 | P | 40.5 | Very low | 44.3 | Very low | 106 Ų | 106 | 138.3 Ų | 138.3 | 69% | 0.688 | 76% | 0.762 | S | S | * | * | trans | -75.5 | 126.7 | 174.8 | -6.5 | 24.6 | 0 | 0 | 0 | 109.4 | E289 S293 | E289-P291 VanDerWaalsContact O-CD 3.24Å; E289-P291 WeakPolarHBondContact O-CD 3.43Å; P291-S293 PolarHBondContact O-N 3.17Å | ||
| 292 | A | 45.9 | Very low | 43.9 | Very low | 116 Ų | 116 | 142.3 Ų | 142.3 | 96% | 0.959 | 78% | 0.777 | S | S | * | * | S | Bend | trans | -67 | 78.7 | 166.1 | 0 | 0 | 0 | 0 | 0 | 110.4 | T290 | T290-A292 PolarHBondContact O-N 3.17Š|
| 293 | S | 40.5 | Very low | 43.4 | Very low | 102 Ų | 102 | 142.3 Ų | 142.3 | 71% | 0.713 | 78% | 0.782 | S | S | * | * | trans | -154.5 | 66.2 | 170.1 | 62.7 | 0 | 0 | 0 | 0 | 111.1 | P291 | P291-S293 PolarHBondContact O-N 3.17Š| ||
| 294 | A | 41.3 | Very low | 42.9 | Very low | 100 Ų | 100 | 143.7 Ų | 143.7 | 83% | 0.826 | 80% | 0.796 | S | S | * | * | trans | -148.3 | 53.6 | 166.3 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 295 | Q | 43.5 | Very low | 42.5 | Very low | 191 Ų | 191 | 142.8 Ų | 142.8 | 89% | 0.893 | 80% | 0.802 | S | S | * | * | S | Bend | trans | -155.9 | 131.2 | 162.4 | -107.1 | 167 | 12 | 0 | 0 | 108.1 | ||
| 296 | M | 39.9 | Very low | 41.8 | Very low | 184 Ų | 184 | 148.3 Ų | 148.3 | 91% | 0.906 | 82% | 0.824 | S | S | * | * | trans | 89.4 | 85.3 | -175.5 | -53.5 | -157.2 | -169.2 | 0 | 0 | 116.4 | ||||
| 297 | L | 34 | Very low | 41.3 | Very low | 175 Ų | 175 | 152.7 Ų | 152.7 | 92% | 0.916 | 84% | 0.841 | S | S | * | * | -166.9 | 87.2 | 119.6 | -128.7 | 86.6 | 0 | 0 | 0 | 110.7 | |||||
| 298 | E | 39.7 | Very low | 40.5 | Very low | 198 Ų | 198 | 153.8 Ų | 153.8 | 93% | 0.925 | 86% | 0.855 | S | S | * | * | trans | -126.6 | 89 | 153 | -97.9 | -166.8 | 149.3 | 0 | 0 | 107.4 | ||||
| 299 | C | 34.6 | Very low | 39.7 | Very low | 106 Ų | 106 | 153.4 Ų | 153.4 | 72% | 0.716 | 86% | 0.856 | S | S | * | * | trans | -166.5 | 109.4 | 151.5 | -123.5 | 0 | 0 | 0 | 0 | 112 | ||||
| 300 | K | 35 | Very low | 39.1 | Very low | 189 Ų | 189 | 152.4 Ų | 152.4 | 82% | 0.822 | 86% | 0.863 | S | S | * | * | trans | 56.8 | 130.1 | 138.8 | -67.1 | 179.4 | 176.8 | 178.9 | 0 | 121.3 | ||||
| 301 | L | 33.2 | Very low | 38.9 | Very low | 250 Ų | 250 | 156.1 Ų | 156.1 | 100% | 1.309 | 88% | 0.879 | S | S | * | * | trans | 80.6 | 0 | 160.5 | -74.6 | 154.7 | 0 | 0 | 0 | 116.9 |
Retrieved 301 of 301 residues in 1551.8 ms
(Link to these results)