| 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 | 53.1 | Low | 57.8 | Low | 169 Ų | 169 | 81.6 Ų | 81.6 | 83% | 0.833 | 39% | 0.391 | S | S | * | . | 0 | -38.8 | 0 | -176.1 | 179.8 | -110.3 | 0 | 0 | 109.8 | E3 G4 I5 | M1-E3 VanDerWaalsContact C-N 3.35Å; M1-E3 PolarHBondContact O-N 3.49Å; M1-G4 PolarHBondContact O-N 3.02Å; M1-I5 HydrophobicContact CG-CD1 4.26Å; M1-I5 PolarHBondContact O-N 3.4Å | |||
| 2 | E | 54 | Low | 58.3 | Low | 143 Ų | 143 | 75.3 Ų | 75.3 | 67% | 0.668 | 36% | 0.364 | S | S | * | . | H | α-helix | trans | -54.3 | -42.1 | 175.7 | -62.9 | 77.1 | -168.4 | 0 | 0 | 113 | G4 I5 Q6 | E2-G4 VanDerWaalsContact C-N 3.3Å; E2-G4 PolarHBondContact O-N 3.39Å; E2-I5 PolarHBondContact O-N 3.13Å; E2-Q6 WeakPolarHBondContact O-CB 3.32Å; E2-Q6 PolarHBondContact O-N 2.68Å |
| 3 | E | 54.5 | Low | 58.7 | Low | 138 Ų | 138 | 72.1 Ų | 72.1 | 65% | 0.645 | 35% | 0.348 | S | S | * | . | H | α-helix | trans | -62.4 | -34.7 | 179.9 | -62.2 | -174.7 | 167.8 | 0 | 0 | 113.4 | M1 L7 P47 | M1-E3 VanDerWaalsContact C-N 3.35Å; M1-E3 PolarHBondContact O-N 3.49Å; E3-L7 WeakPolarHBondContact O-CB 3.33Å; E3-L7 PolarHBondContact O-N 2.89Å; E3-P47 HydrophobicContact CB-CG 4.12Å |
| 4 | G | 53.4 | Low | 58.9 | Low | 9 Ų | 9 | 72 Ų | 72 | 9% | 0.093 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -71.2 | -42.9 | 175 | 0 | 0 | 0 | 0 | 0 | 112.9 | M1 E2 Q6 L7 V8 | M1-G4 PolarHBondContact O-N 3.02Å; E2-G4 VanDerWaalsContact C-N 3.3Å; E2-G4 PolarHBondContact O-N 3.39Å; G4-Q6 PolarHBondContact O-N 3.09Å; G4-L7 PolarHBondContact O-N 3Å; G4-V8 VanDerWaalsContact O-CG2 3.26Å; G4-V8 WeakPolarHBondContact O-CG2 3.17Å; G4-V8 PolarHBondContact O-N 3.46Å |
| 5 | I | 57.4 | Low | 59.1 | Low | 82 Ų | 82 | 68.3 Ų | 68.3 | 42% | 0.421 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -61.7 | -40 | 175.4 | -63.1 | 169.3 | 0 | 0 | 0 | 109.6 | M1 E2 V8 R9 | M1-I5 HydrophobicContact CG-CD1 4.26Å; M1-I5 PolarHBondContact O-N 3.4Å; E2-I5 PolarHBondContact O-N 3.13Å; I5-V8 PolarHBondContact O-N 3.49Å; I5-R9 VanDerWaalsContact O-CG 3.32Å; I5-R9 WeakPolarHBondContact O-CG 3.43Å; I5-R9 PolarHBondContact O-N 2.9Å |
| 6 | Q | 58.8 | Low | 58.9 | Low | 65 Ų | 65 | 67.4 Ų | 67.4 | 30% | 0.304 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -61.7 | -44.1 | 176.3 | -156.2 | 71.6 | 25.2 | 0 | 0 | 111.7 | E2 G4 R9 E10 P95 | E2-Q6 WeakPolarHBondContact O-CB 3.32Å; E2-Q6 PolarHBondContact O-N 2.68Å; G4-Q6 PolarHBondContact O-N 3.09Å; Q6-R9 WeakPolarHBondContact O-CB 3.22Å; Q6-R9 PolarHBondContact O-N 2.99Å; Q6-E10 PolarHBondContact O-N 3.44Å; Q6-P95 HydrophobicContact CG-CB 4.22Å; Q6-P95 HydrophobicContact CG-CG 3.77Å; Q6-P95 VanDerWaalsContact NE2-CB 3.27Å |
| 7 | L | 61.2 | Low | 58.8 | Low | 20 Ų | 20 | 68.1 Ų | 68.1 | 11% | 0.105 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -68.9 | -38.6 | -179.2 | -176.3 | 70.8 | 0 | 0 | 0 | 112.9 | E3 G4 R9 E10 L11 L42 A45 A46 | E3-L7 WeakPolarHBondContact O-CB 3.33Å; E3-L7 PolarHBondContact O-N 2.89Å; G4-L7 PolarHBondContact O-N 3Å; L7-R9 VanDerWaalsContact C-N 3.25Å; L7-R9 PolarHBondContact O-N 3.34Å; L7-E10 PolarHBondContact O-N 3.18Å; L7-L11 HydrophobicContact CD1-CD1 4.21Å; L7-L11 HydrophobicContact CD1-CG 4.36Å; L7-L11 HydrophobicContact CG-CD1 3.98Å; L7-L11 HydrophobicContact CG-CG 4.49Å; L7-L11 WeakPolarHBondContact O-CB 3.36Å; L7-L11 WeakPolarHBondContact O-CG 3.49Å; L7-L11 PolarHBondContact O-N 3.05Å; L7-L42 HydrophobicContact CB-CD1 4.02Å; L7-L42 HydrophobicContact CD2-CD1 3.6Å; L7-L42 HydrophobicContact CG-CD1 3.68Å; L7-A45 HydrophobicContact CD1-CB 3.51Å; L7-A45 HydrophobicContact CD2-CB 3.69Å; L7-A45 VanDerWaalsContact CD2-O 3.3Å; L7-A45 WeakPolarHBondContact CD2-O 3.13Å; L7-A45 HydrophobicContact CG-CB 4.09Å; L7-A46 HydrophobicContact CD2-CB 4.12Å; L7-A46 VanDerWaalsContact CD2-N 3.26Å |
| 8 | V | 62.8 | Low | 58.7 | Low | 50 Ų | 50 | 74.3 Ų | 74.3 | 30% | 0.303 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -55.9 | -45 | 172.1 | 174.3 | 0 | 0 | 0 | 0 | 110.2 | G4 I5 L11 G12 F34 L42 | G4-V8 VanDerWaalsContact O-CG2 3.26Å; G4-V8 WeakPolarHBondContact O-CG2 3.17Å; G4-V8 PolarHBondContact O-N 3.46Å; I5-V8 PolarHBondContact O-N 3.49Å; V8-L11 PolarHBondContact O-N 3.24Å; V8-G12 PolarHBondContact O-N 3.26Å; V8-F34 HydrophobicContact CG1-CE2 4.01Å; V8-L42 HydrophobicContact CB-CD1 4.27Å; V8-L42 HydrophobicContact CG2-CD1 3.55Å; V8-L42 HydrophobicContact CG2-CD2 3.47Å; V8-L42 VanDerWaalsContact CG2-CD2 3.47Å; V8-L42 HydrophobicContact CG2-CG 4.17Å |
| 9 | R | 62 | Low | 58.7 | Low | 130 Ų | 130 | 75.6 Ų | 75.6 | 49% | 0.491 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -66.5 | -44.8 | -179.9 | -69.6 | 170.3 | 175 | -163.6 | -4.8 | 112.3 | I5 Q6 L7 L11 G12 M13 | I5-R9 VanDerWaalsContact O-CG 3.32Å; I5-R9 WeakPolarHBondContact O-CG 3.43Å; I5-R9 PolarHBondContact O-N 2.9Å; Q6-R9 WeakPolarHBondContact O-CB 3.22Å; Q6-R9 PolarHBondContact O-N 2.99Å; L7-R9 VanDerWaalsContact C-N 3.25Å; L7-R9 PolarHBondContact O-N 3.34Å; R9-L11 VanDerWaalsContact C-N 3.33Å; R9-L11 PolarHBondContact O-N 3.36Å; R9-G12 PolarHBondContact O-N 3.01Å; R9-M13 WeakPolarHBondContact O-CB 3.33Å; R9-M13 WeakPolarHBondContact O-CG 3.41Å; R9-M13 PolarHBondContact O-N 3.24Å |
| 10 | E | 58.3 | Low | 58 | Low | 75 Ų | 75 | 77.8 Ų | 77.8 | 35% | 0.35 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -58.3 | -45.5 | 176.3 | -80.2 | 179.5 | -165.6 | 0 | 0 | 112.1 | Q6 L7 M13 I14 P95 | Q6-E10 PolarHBondContact O-N 3.44Å; L7-E10 PolarHBondContact O-N 3.18Å; E10-M13 PolarHBondContact O-N 3.26Å; E10-I14 WeakPolarHBondContact O-CG1 3.45Å; E10-I14 PolarHBondContact O-N 3.28Å; E10-P95 HydrophobicContact CG-CB 3.45Å; E10-P95 VanDerWaalsContact CG-CB 3.45Å; E10-P95 HydrophobicContact CG-CG 4.19Å; E10-P95 WeakPolarHBondContact OE1-CB 3.49Å; E10-P95 WeakPolarHBondContact OE1-CG 3.48Å |
| 11 | L | 60.8 | Low | 57.6 | Low | 17 Ų | 17 | 79.7 Ų | 79.7 | 9% | 0.089 | 39% | 0.391 | C | S | . | . | H | α-helix | trans | -74.4 | -34.3 | -178 | -67.3 | 171.7 | 0 | 0 | 0 | 112.6 | L7 V8 R9 M13 I14 E15 L38 R41 L42 | L7-L11 HydrophobicContact CD1-CD1 4.21Å; L7-L11 HydrophobicContact CD1-CG 4.36Å; L7-L11 HydrophobicContact CG-CD1 3.98Å; L7-L11 HydrophobicContact CG-CG 4.49Å; L7-L11 WeakPolarHBondContact O-CB 3.36Å; L7-L11 WeakPolarHBondContact O-CG 3.49Å; L7-L11 PolarHBondContact O-N 3.05Å; V8-L11 PolarHBondContact O-N 3.24Å; R9-L11 VanDerWaalsContact C-N 3.33Å; R9-L11 PolarHBondContact O-N 3.36Å; L11-M13 VanDerWaalsContact C-N 3.34Å; L11-I14 HydrophobicContact CD2-CD1 4.42Å; L11-I14 PolarHBondContact O-N 2.89Å; L11-E15 PolarHBondContact O-N 3.32Å; L11-L38 HydrophobicContact CB-CD1 3.31Å; L11-R41 HydrophobicContact CD1-CB 3.96Å; L11-R41 WeakPolarHBondContact CD1-O 3.49Å; L11-R41 HydrophobicContact CD2-CB 3.91Å; L11-R41 HydrophobicContact CG-CB 4.44Å; L11-L42 HydrophobicContact CD1-CB 3.85Å; L11-L42 HydrophobicContact CD1-CD1 4.06Å; L11-L42 VanDerWaalsContact CD1-N 3.25Å |
| 12 | G | 63.8 | Low | 57.4 | Low | 6 Ų | 6 | 80.4 Ų | 80.4 | 6% | 0.062 | 39% | 0.392 | C | S | . | . | H | α-helix | trans | -63 | -41.4 | 172.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | V8 R9 E15 W16 | V8-G12 PolarHBondContact O-N 3.26Å; R9-G12 PolarHBondContact O-N 3.01Å; G12-E15 PolarHBondContact O-N 3.45Å; G12-W16 WeakPolarHBondContact O-CB 3.31Å; G12-W16 PolarHBondContact O-N 2.62Å |
| 13 | M | 63.4 | Low | 57.4 | Low | 33 Ų | 33 | 75.2 Ų | 75.2 | 16% | 0.163 | 38% | 0.377 | C | S | . | . | H | α-helix | trans | -62.2 | -42.5 | 172.6 | -82 | -95.3 | -73.1 | 0 | 0 | 112.7 | R9 E10 L11 W16 I17 P29 L125 | R9-M13 WeakPolarHBondContact O-CB 3.33Å; R9-M13 WeakPolarHBondContact O-CG 3.41Å; R9-M13 PolarHBondContact O-N 3.24Å; E10-M13 PolarHBondContact O-N 3.26Å; L11-M13 VanDerWaalsContact C-N 3.34Å; M13-W16 PolarHBondContact O-N 3.24Å; M13-I17 WeakPolarHBondContact O-CD1 3.31Å; M13-I17 VanDerWaalsContact O-CG1 3.22Å; M13-I17 WeakPolarHBondContact O-CG1 3.46Å; M13-I17 PolarHBondContact O-N 3.05Å; M13-P29 HydrophobicContact CG-CB 4.09Å; M13-P29 HydrophobicContact SD-CB 3.99Å; M13-P29 HydrophobicContact SD-CG 3.82Å; M13-L125 HydrophobicContact CE-CD1 4.44Å; M13-L125 HydrophobicContact CE-CD2 3.92Å |
| 14 | I | 60.7 | Low | 57 | Low | 71 Ų | 71 | 73.7 Ų | 73.7 | 36% | 0.364 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -63.1 | -48.3 | 175.8 | -71.4 | 168.6 | 0 | 0 | 0 | 109.9 | E10 L11 W16 I17 Y18 | E10-I14 WeakPolarHBondContact O-CG1 3.45Å; E10-I14 PolarHBondContact O-N 3.28Å; L11-I14 HydrophobicContact CD2-CD1 4.42Å; L11-I14 PolarHBondContact O-N 2.89Å; I14-W16 VanDerWaalsContact C-N 3.27Å; I14-W16 PolarHBondContact O-N 2.9Å; I14-I17 PolarHBondContact O-N 3.25Å; I14-I17 VanDerWaalsContact O-N 3.17Å; I14-Y18 HydrophobicContact CG2-CD2 3.79Å; I14-Y18 HydrophobicContact CG2-CE2 3.92Å; I14-Y18 WeakPolarHBondContact O-CD2 3.49Å; I14-Y18 PolarHBondContact O-N 3.07Å; I14-Y18 VanDerWaalsContact O-N 3.14Å |
| 15 | E | 62 | Low | 57 | Low | 16 Ų | 16 | 78.3 Ų | 78.3 | 8% | 0.075 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -59.7 | -39.5 | 177.9 | -168.9 | 164.2 | -101.2 | 0 | 0 | 111.8 | L11 G12 Y18 L19 T35 L38 R41 | L11-E15 PolarHBondContact O-N 3.32Å; G12-E15 PolarHBondContact O-N 3.45Å; E15-Y18 CarbonylContact O-C 3.48Å; E15-Y18 PolarHBondContact O-N 2.97Å; E15-L19 VanDerWaalsContact O-CG 3.27Å; E15-L19 WeakPolarHBondContact O-CG 3.43Å; E15-L19 PolarHBondContact O-N 2.96Å; E15-T35 VanDerWaalsContact CD-OG1 3.25Å; E15-T35 PolarHBondContact OE1-OG1 3.33Å; E15-T35 PolarHBondContact OE2-OG1 3.28Å; E15-L38 PolarHBondContact OE1-N 2.93Å; E15-L38 WeakPolarHBondContact OE2-CB 3.48Å; E15-R41 IonicContact OE1-CZ 3.82Å; E15-R41 IonicContact OE1-NH2 2.68Å; E15-R41 PolarHBondContact OE1-NH2 3.39Å |
| 16 | W | 56.3 | Low | 57 | Low | 54 Ų | 54 | 82.1 Ų | 82.1 | 21% | 0.205 | 43% | 0.426 | C | S | . | . | H | α-helix | trans | -62.3 | -40.7 | 173.7 | -174.6 | 72.8 | 0 | 0 | 0 | 114 | G12 M13 I14 Y18 L19 L27 P29 V32 K122 L125 | G12-W16 WeakPolarHBondContact O-CB 3.31Å; G12-W16 PolarHBondContact O-N 2.62Å; M13-W16 PolarHBondContact O-N 3.24Å; I14-W16 VanDerWaalsContact C-N 3.27Å; I14-W16 PolarHBondContact O-N 2.9Å; W16-Y18 VanDerWaalsContact C-N 3.3Å; W16-Y18 PolarHBondContact O-N 3.47Å; W16-L19 PolarHBondContact O-N 3.37Å; W16-L27 PolarHBondContact NE1-O 3.2Å; W16-P29 HydrophobicContact CB-CB 4.37Å; W16-P29 HydrophobicContact CD2-CB 4.31Å; W16-P29 HydrophobicContact CD2-CG 4.39Å; W16-P29 HydrophobicContact CE3-CG 4.36Å; W16-P29 HydrophobicContact CG-CB 4.26Å; W16-V32 HydrophobicContact CB-CG2 4.31Å; W16-V32 HydrophobicContact CG-CG2 4.45Å; W16-K122 HydrophobicContact CH2-CB 4.19Å; W16-K122 HydrophobicContact CH2-CD 4.01Å; W16-K122 HydrophobicContact CH2-CG 3.89Å; W16-K122 HydrophobicContact CZ2-CD 4.33Å; W16-L125 HydrophobicContact CZ3-CD2 4.36Å |
| 17 | I | 56.8 | Low | 56.8 | Low | 79 Ų | 79 | 83 Ų | 83 | 41% | 0.405 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -68.3 | -30.3 | 178.5 | -69.2 | 162.8 | 0 | 0 | 0 | 112 | M13 I14 I129 | M13-I17 WeakPolarHBondContact O-CD1 3.31Å; M13-I17 VanDerWaalsContact O-CG1 3.22Å; M13-I17 WeakPolarHBondContact O-CG1 3.46Å; M13-I17 PolarHBondContact O-N 3.05Å; I14-I17 PolarHBondContact O-N 3.25Å; I14-I17 VanDerWaalsContact O-N 3.17Å; I17-I129 HydrophobicContact CD1-CD1 4.36Å |
| 18 | Y | 58.3 | Low | 56.4 | Low | 180 Ų | 180 | 83.8 Ų | 83.8 | 71% | 0.706 | 44% | 0.442 | S | S | * | . | H | α-helix | trans | -100.9 | 2.1 | -179 | -68.4 | -75.8 | 0 | 0 | 0 | 113.6 | I14 E15 W16 | I14-Y18 HydrophobicContact CG2-CD2 3.79Å; I14-Y18 HydrophobicContact CG2-CE2 3.92Å; I14-Y18 WeakPolarHBondContact O-CD2 3.49Å; I14-Y18 PolarHBondContact O-N 3.07Å; I14-Y18 VanDerWaalsContact O-N 3.14Å; E15-Y18 CarbonylContact O-C 3.48Å; E15-Y18 PolarHBondContact O-N 2.97Å; W16-Y18 VanDerWaalsContact C-N 3.3Å; W16-Y18 PolarHBondContact O-N 3.47Å |
| 19 | L | 56.9 | Low | 56 | Low | 100 Ų | 100 | 83.3 Ų | 83.3 | 52% | 0.524 | 44% | 0.44 | S | S | . | . | S | Bend | trans | -69.9 | 129.7 | 170.2 | -90.8 | 162.9 | 0 | 0 | 0 | 109 | E15 W16 V32 | E15-L19 VanDerWaalsContact O-CG 3.27Å; E15-L19 WeakPolarHBondContact O-CG 3.43Å; E15-L19 PolarHBondContact O-N 2.96Å; W16-L19 PolarHBondContact O-N 3.37Å; L19-V32 HydrophobicContact CD1-CG1 4.29Å |
| 20 | D | 46 | Very low | 55.4 | Low | 119 Ų | 119 | 84.7 Ų | 84.7 | 64% | 0.636 | 45% | 0.452 | S | S | * | . | trans | -46.6 | 131.1 | -175.9 | -148.5 | 5.3 | 0 | 0 | 0 | 111.4 | E22 G23 | D20-E22 PolarHBondContact O-N 2.97Å; D20-G23 PolarHBondContact O-N 3.02Å | ||
| 21 | P | 49.6 | Very low | 55.2 | Low | 118 Ų | 118 | 86.2 Ų | 86.2 | 77% | 0.766 | 46% | 0.463 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61.6 | -5.4 | -176 | 21.9 | -34.9 | 0 | 0 | 0 | 115.6 | ||
| 22 | E | 47.8 | Very low | 55.2 | Low | 183 Ų | 183 | 86.7 Ų | 86.7 | 86% | 0.855 | 47% | 0.466 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -86.4 | -4.7 | 173.5 | -63 | -164.3 | 147.3 | 0 | 0 | 113.8 | D20 | D20-E22 PolarHBondContact O-N 2.97Š|
| 23 | G | 55.4 | Low | 55.2 | Low | 35 Ų | 35 | 89.9 Ų | 89.9 | 36% | 0.361 | 49% | 0.492 | S | S | . | . | S | Bend | trans | -74.5 | 155.8 | 173.2 | 0 | 0 | 0 | 0 | 0 | 113.3 | D20 V25 | D20-G23 PolarHBondContact O-N 3.02Å; G23-V25 PolarHBondContact O-N 3.01Å |
| 24 | P | 45.9 | Very low | 55.3 | Low | 105 Ų | 105 | 92 Ų | 92 | 68% | 0.682 | 50% | 0.501 | S | S | * | . | trans | -60.7 | 113.6 | -175.8 | 22.5 | -29.5 | 0 | 0 | 0 | 110.6 | D26 L27 | P24-D26 PolarHBondContact O-N 3.27Å; P24-L27 HydrophobicContact CG-CD1 4.34Å | ||
| 25 | V | 53.8 | Low | 55.7 | Low | 106 Ų | 106 | 91.3 Ų | 91.3 | 64% | 0.642 | 50% | 0.499 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.5 | -2.5 | -169.5 | -166.9 | 0 | 0 | 0 | 0 | 113.5 | G23 | G23-V25 PolarHBondContact O-N 3.01Š|
| 26 | D | 56.8 | Low | 56 | Low | 162 Ų | 162 | 95 Ų | 95 | 87% | 0.866 | 52% | 0.517 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -99.2 | -4.8 | -173.1 | -92.4 | -20.2 | 0 | 0 | 0 | 115.6 | P24 A28 | P24-D26 PolarHBondContact O-N 3.27Å; D26-A28 PolarHBondContact O-N 3.48Å |
| 27 | L | 54.1 | Low | 56.6 | Low | 84 Ų | 84 | 93.8 Ų | 93.8 | 44% | 0.44 | 52% | 0.521 | S | S | . | . | trans | -78.3 | 119.5 | 177.2 | -75.5 | 165.6 | 0 | 0 | 0 | 110.5 | W16 P24 D31 | W16-L27 PolarHBondContact NE1-O 3.2Å; P24-L27 HydrophobicContact CG-CD1 4.34Å; L27-D31 HydrophobicContact CD2-CB 3.8Å | ||
| 28 | A | 54 | Low | 57.2 | Low | 36 Ų | 36 | 90.3 Ų | 90.3 | 30% | 0.298 | 50% | 0.503 | S | S | . | . | trans | -65.7 | 152.1 | 169.3 | 0 | 0 | 0 | 0 | 0 | 109.4 | D26 E30 D31 | D26-A28 PolarHBondContact O-N 3.48Å; A28-E30 PolarHBondContact O-N 3.49Å; A28-D31 WeakPolarHBondContact CB-OD2 3.46Å; A28-D31 PolarHBondContact O-N 2.78Å | ||
| 29 | P | 53.5 | Low | 58 | Low | 41 Ų | 41 | 83.9 Ų | 83.9 | 27% | 0.266 | 48% | 0.48 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -58.2 | -18.2 | 177.9 | 10.5 | -17.9 | 0 | 0 | 0 | 113.7 | M13 W16 | M13-P29 HydrophobicContact CG-CB 4.09Å; M13-P29 HydrophobicContact SD-CB 3.99Å; M13-P29 HydrophobicContact SD-CG 3.82Å; W16-P29 HydrophobicContact CB-CB 4.37Å; W16-P29 HydrophobicContact CD2-CB 4.31Å; W16-P29 HydrophobicContact CD2-CG 4.39Å; W16-P29 HydrophobicContact CE3-CG 4.36Å; W16-P29 HydrophobicContact CG-CB 4.26Å |
| 30 | E | 50.2 | Low | 58.7 | Low | 159 Ų | 159 | 83.1 Ų | 83.1 | 74% | 0.743 | 47% | 0.47 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77.3 | -22.4 | 175.6 | -46.3 | -169.6 | -140 | 0 | 0 | 112.8 | A28 | A28-E30 PolarHBondContact O-N 3.49Š|
| 31 | D | 53.4 | Low | 59.9 | Low | 107 Ų | 107 | 82 Ų | 82 | 57% | 0.572 | 46% | 0.457 | S | S | * | . | S | Bend | trans | -101 | 4.1 | -175.6 | -57.4 | -49.7 | 0 | 0 | 0 | 112.7 | L27 A28 A33 | L27-D31 HydrophobicContact CD2-CB 3.8Å; A28-D31 WeakPolarHBondContact CB-OD2 3.46Å; A28-D31 PolarHBondContact O-N 2.78Å; D31-A33 PolarHBondContact O-N 3.26Å |
| 32 | V | 60.1 | Low | 61.1 | Low | 27 Ų | 27 | 76.5 Ų | 76.5 | 16% | 0.164 | 42% | 0.421 | C | S | . | . | S | Bend | trans | -70.3 | 128.3 | 178.1 | -177.3 | 0 | 0 | 0 | 0 | 109.3 | W16 L19 F34 | W16-V32 HydrophobicContact CB-CG2 4.31Å; W16-V32 HydrophobicContact CG-CG2 4.45Å; L19-V32 HydrophobicContact CD1-CG1 4.29Å; V32-F34 PolarHBondContact O-N 2.91Å |
| 33 | A | 64.1 | Low | 62.4 | Low | 73 Ų | 73 | 68.5 Ų | 68.5 | 60% | 0.603 | 38% | 0.384 | S | S | * | . | trans | -57.8 | 140.2 | 176.8 | 0 | 0 | 0 | 0 | 0 | 110.7 | D31 T35 | D31-A33 PolarHBondContact O-N 3.26Å; A33-T35 VanDerWaalsContact O-CG2 3.3Å; A33-T35 WeakPolarHBondContact O-CG2 3.23Å; A33-T35 PolarHBondContact O-N 3.13Å | ||
| 34 | F | 65.6 | Low | 63.1 | Low | 78 Ų | 78 | 67.8 Ų | 67.8 | 34% | 0.342 | 37% | 0.373 | S | S | . | . | trans | -76.9 | 75.7 | -177.3 | -161.5 | -121.4 | 0 | 0 | 0 | 111.4 | V8 V32 L38 Q39 L42 L57 | V8-F34 HydrophobicContact CG1-CE2 4.01Å; V32-F34 PolarHBondContact O-N 2.91Å; F34-L38 HydrophobicContact CD2-CD2 3.57Å; F34-L38 HydrophobicContact CD2-CG 3.9Å; F34-L38 HydrophobicContact CE2-CD2 3.89Å; F34-L38 HydrophobicContact CE2-CG 3.77Å; F34-Q39 HydrophobicContact CD1-CG 3.62Å; F34-Q39 HydrophobicContact CE1-CG 3.37Å; F34-Q39 HydrophobicContact CG-CG 4.43Å; F34-Q39 HydrophobicContact CZ-CG 3.97Å; F34-Q39 PolarHBondContact O-NE2 3.17Å; F34-L42 HydrophobicContact CE2-CD2 4.24Å; F34-L42 HydrophobicContact CZ-CD2 3.59Å; F34-L57 HydrophobicContact CD1-CD2 4.23Å; F34-L57 HydrophobicContact CE1-CD2 3.76Å | ||
| 35 | T | 69.3 | Low | 64.1 | Low | 55 Ų | 55 | 64.7 Ų | 64.7 | 34% | 0.337 | 36% | 0.356 | S | S | . | . | trans | -66.8 | 162.4 | -171.1 | 74.6 | 0 | 0 | 0 | 0 | 113.1 | E15 A33 G37 L38 Q39 | E15-T35 VanDerWaalsContact CD-OG1 3.25Å; E15-T35 PolarHBondContact OE1-OG1 3.33Å; E15-T35 PolarHBondContact OE2-OG1 3.28Å; A33-T35 VanDerWaalsContact O-CG2 3.3Å; A33-T35 WeakPolarHBondContact O-CG2 3.23Å; A33-T35 PolarHBondContact O-N 3.13Å; T35-G37 PolarHBondContact O-N 2.94Å; T35-G37 PolarHBondContact OG1-N 3.5Å; T35-L38 PolarHBondContact O-N 2.85Å; T35-L38 VanDerWaalsContact O-N 3.15Å; T35-L38 PolarHBondContact OG1-N 3.43Å; T35-Q39 WeakPolarHBondContact O-CG 3.44Å; T35-Q39 PolarHBondContact O-N 2.86Å | ||
| 36 | Q | 67.8 | Low | 64.9 | Low | 94 Ų | 94 | 59.9 Ų | 59.9 | 44% | 0.439 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -60 | -34.2 | 175.2 | -167.6 | -175 | 19.5 | 0 | 0 | 112.2 | R40 | Q36-R40 WeakPolarHBondContact O-CG 3.49Å; Q36-R40 PolarHBondContact O-N 3.35Å |
| 37 | G | 69.3 | Low | 65.3 | Low | 29 Ų | 29 | 53.5 Ų | 53.5 | 30% | 0.299 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -64.7 | -41.7 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | T35 R41 | T35-G37 PolarHBondContact O-N 2.94Å; T35-G37 PolarHBondContact OG1-N 3.5Å; G37-R41 WeakPolarHBondContact O-CG 3.36Å; G37-R41 PolarHBondContact O-N 3.5Å; G37-R41 VanDerWaalsContact O-N 3.13Å; G37-R41 PolarHBondContact O-NE 3.29Å |
| 38 | L | 69.8 | Low | 66 | Low | 5 Ų | 5 | 53.7 Ų | 53.7 | 3% | 0.026 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -68.1 | -42.1 | 175.8 | -173.9 | 52 | 0 | 0 | 0 | 112.6 | L11 E15 F34 T35 R40 R41 L42 | L11-L38 HydrophobicContact CB-CD1 3.31Å; E15-L38 PolarHBondContact OE1-N 2.93Å; E15-L38 WeakPolarHBondContact OE2-CB 3.48Å; F34-L38 HydrophobicContact CD2-CD2 3.57Å; F34-L38 HydrophobicContact CD2-CG 3.9Å; F34-L38 HydrophobicContact CE2-CD2 3.89Å; F34-L38 HydrophobicContact CE2-CG 3.77Å; T35-L38 PolarHBondContact O-N 2.85Å; T35-L38 VanDerWaalsContact O-N 3.15Å; T35-L38 PolarHBondContact OG1-N 3.43Å; L38-R40 PolarHBondContact O-N 2.88Å; L38-R41 PolarHBondContact O-N 3.44Å; L38-L42 VanDerWaalsContact O-CB 3.32Å; L38-L42 WeakPolarHBondContact O-CB 3.13Å; L38-L42 PolarHBondContact O-N 3.13Å |
| 39 | Q | 74.4 | Confident | 66.9 | Low | 46 Ų | 46 | 58.5 Ų | 58.5 | 22% | 0.215 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -58.6 | -45.8 | 175.1 | -72 | 175.2 | 11.3 | 0 | 0 | 112.1 | F34 T35 L42 L43 L58 | F34-Q39 HydrophobicContact CD1-CG 3.62Å; F34-Q39 HydrophobicContact CE1-CG 3.37Å; F34-Q39 HydrophobicContact CG-CG 4.43Å; F34-Q39 HydrophobicContact CZ-CG 3.97Å; F34-Q39 PolarHBondContact O-NE2 3.17Å; T35-Q39 WeakPolarHBondContact O-CG 3.44Å; T35-Q39 PolarHBondContact O-N 2.86Å; Q39-L42 PolarHBondContact O-N 2.97Å; Q39-L43 WeakPolarHBondContact O-CB 3.37Å; Q39-L43 PolarHBondContact O-N 3.44Å; Q39-L58 HydrophobicContact CB-CD1 3.89Å |
| 40 | R | 72.4 | Confident | 67.8 | Low | 84 Ų | 84 | 58.6 Ų | 58.6 | 32% | 0.317 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -62 | -45.2 | 176.8 | -75.6 | 177.5 | 175.9 | 141.6 | -5.7 | 112.3 | Q36 L38 L42 L43 T44 E70 I74 | Q36-R40 WeakPolarHBondContact O-CG 3.49Å; Q36-R40 PolarHBondContact O-N 3.35Å; L38-R40 PolarHBondContact O-N 2.88Å; R40-L42 VanDerWaalsContact C-N 3.33Å; R40-L42 PolarHBondContact O-N 3.17Å; R40-L43 PolarHBondContact O-N 3.21Å; R40-T44 WeakPolarHBondContact O-CB 3.32Å; R40-T44 PolarHBondContact O-N 3.17Å; R40-T44 VanDerWaalsContact O-N 3.08Å; R40-T44 PolarHBondContact O-OG1 2.92Å; R40-E70 IonicContact CZ-OE1 3.06Å; R40-E70 IonicContact CZ-OE2 3.75Å; R40-E70 IonicContact NE-OE1 2.65Å; R40-E70 PolarHBondContact NE-OE1 2.9Å; R40-E70 IonicContact NE-OE2 3.86Å; R40-E70 IonicContact NH2-OE1 2.79Å; R40-E70 PolarHBondContact NH2-OE1 3.31Å; R40-E70 IonicContact NH2-OE2 2.8Å; R40-E70 PolarHBondContact NH2-OE2 3.07Å; R40-I74 HydrophobicContact CG-CD1 3.92Å; R40-I74 HydrophobicContact CG-CG1 4.1Å |
| 41 | R | 70.6 | Confident | 69 | Low | 94 Ų | 94 | 56.3 Ų | 56.3 | 36% | 0.355 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -63.5 | -40.4 | 176.8 | -76.5 | -174.3 | -85.8 | -148.9 | -1.5 | 111.7 | L11 E15 G37 L38 T44 A45 | L11-R41 HydrophobicContact CD1-CB 3.96Å; L11-R41 WeakPolarHBondContact CD1-O 3.49Å; L11-R41 HydrophobicContact CD2-CB 3.91Å; L11-R41 HydrophobicContact CG-CB 4.44Å; E15-R41 IonicContact OE1-CZ 3.82Å; E15-R41 IonicContact OE1-NH2 2.68Å; E15-R41 PolarHBondContact OE1-NH2 3.39Å; G37-R41 WeakPolarHBondContact O-CG 3.36Å; G37-R41 PolarHBondContact O-N 3.5Å; G37-R41 VanDerWaalsContact O-N 3.13Å; G37-R41 PolarHBondContact O-NE 3.29Å; L38-R41 PolarHBondContact O-N 3.44Å; R41-T44 WeakPolarHBondContact O-CB 2.96Å; R41-T44 PolarHBondContact O-N 3.45Å; R41-A45 PolarHBondContact O-N 2.91Å |
| 42 | L | 74.5 | Confident | 70.1 | Confident | 3 Ų | 3 | 58.2 Ų | 58.2 | 2% | 0.016 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -63.8 | -47.1 | 177.9 | -179.4 | 69 | 0 | 0 | 0 | 111.1 | L7 V8 L11 F34 L38 Q39 R40 T44 A45 A46 L54 | L7-L42 HydrophobicContact CB-CD1 4.02Å; L7-L42 HydrophobicContact CD2-CD1 3.6Å; L7-L42 HydrophobicContact CG-CD1 3.68Å; V8-L42 HydrophobicContact CB-CD1 4.27Å; V8-L42 HydrophobicContact CG2-CD1 3.55Å; V8-L42 HydrophobicContact CG2-CD2 3.47Å; V8-L42 VanDerWaalsContact CG2-CD2 3.47Å; V8-L42 HydrophobicContact CG2-CG 4.17Å; L11-L42 HydrophobicContact CD1-CB 3.85Å; L11-L42 HydrophobicContact CD1-CD1 4.06Å; L11-L42 VanDerWaalsContact CD1-N 3.25Å; F34-L42 HydrophobicContact CE2-CD2 4.24Å; F34-L42 HydrophobicContact CZ-CD2 3.59Å; L38-L42 VanDerWaalsContact O-CB 3.32Å; L38-L42 WeakPolarHBondContact O-CB 3.13Å; L38-L42 PolarHBondContact O-N 3.13Å; Q39-L42 PolarHBondContact O-N 2.97Å; R40-L42 VanDerWaalsContact C-N 3.33Å; R40-L42 PolarHBondContact O-N 3.17Å; L42-T44 PolarHBondContact O-N 3.48Å; L42-A45 PolarHBondContact O-N 3.02Å; L42-A46 WeakPolarHBondContact O-CA 3.49Å; L42-A46 WeakPolarHBondContact O-CB 3.5Å; L42-A46 PolarHBondContact O-N 3.26Å; L42-L54 HydrophobicContact CD2-CD1 3.98Å; L42-L54 HydrophobicContact CD2-CD2 3.58Å; L42-L54 HydrophobicContact CD2-CG 4.4Å; L42-L54 HydrophobicContact CG-CD1 3.91Å; L42-L54 HydrophobicContact CG-CD2 4.41Å |
| 43 | L | 74.8 | Confident | 71 | Confident | 15 Ų | 15 | 60.6 Ų | 60.6 | 8% | 0.079 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -59.5 | -36.5 | 177.9 | -152.8 | 84.2 | 0 | 0 | 0 | 112.5 | Q39 R40 L54 V55 L58 I74 | Q39-L43 WeakPolarHBondContact O-CB 3.37Å; Q39-L43 PolarHBondContact O-N 3.44Å; R40-L43 PolarHBondContact O-N 3.21Å; L43-L54 VanDerWaalsContact CD1-C 3.44Å; L43-L54 HydrophobicContact CD1-CB 3.45Å; L43-L54 VanDerWaalsContact CD1-CB 3.45Å; L43-V55 HydrophobicContact CD1-CB 4.43Å; L43-V55 HydrophobicContact CD1-CG2 3.85Å; L43-V55 VanDerWaalsContact CD1-N 3.34Å; L43-V55 HydrophobicContact CD2-CG2 3.87Å; L43-V55 HydrophobicContact CG-CG2 4.29Å; L43-L58 HydrophobicContact CD2-CD2 4.17Å; L43-I74 HydrophobicContact CB-CG2 4.18Å; L43-I74 HydrophobicContact CD2-CB 4.29Å; L43-I74 HydrophobicContact CD2-CD1 3.85Å; L43-I74 HydrophobicContact CD2-CG2 3.69Å; L43-I74 HydrophobicContact CG-CG2 4.41Å |
| 44 | T | 70.2 | Confident | 71.6 | Confident | 20 Ų | 20 | 58.9 Ų | 58.9 | 12% | 0.123 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -69.8 | -41 | -178.8 | -60.8 | 0 | 0 | 0 | 0 | 112.2 | R40 R41 L42 G78 W81 | R40-T44 WeakPolarHBondContact O-CB 3.32Å; R40-T44 PolarHBondContact O-N 3.17Å; R40-T44 VanDerWaalsContact O-N 3.08Å; R40-T44 PolarHBondContact O-OG1 2.92Å; R41-T44 WeakPolarHBondContact O-CB 2.96Å; R41-T44 PolarHBondContact O-N 3.45Å; L42-T44 PolarHBondContact O-N 3.48Å; T44-G78 VanDerWaalsContact CG2-CA 3.45Å; T44-W81 HydrophobicContact CG2-CB 3.87Å; T44-W81 HydrophobicContact CG2-CG 4Å |
| 45 | A | 67.4 | Low | 72.4 | Confident | 41 Ų | 41 | 56.7 Ų | 56.7 | 34% | 0.339 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -92.9 | -9.4 | -178.1 | 0 | 0 | 0 | 0 | 0 | 113.5 | L7 R41 L42 | L7-A45 HydrophobicContact CD1-CB 3.51Å; L7-A45 HydrophobicContact CD2-CB 3.69Å; L7-A45 VanDerWaalsContact CD2-O 3.3Å; L7-A45 WeakPolarHBondContact CD2-O 3.13Å; L7-A45 HydrophobicContact CG-CB 4.09Å; R41-A45 PolarHBondContact O-N 2.91Å; L42-A45 PolarHBondContact O-N 3.02Å |
| 46 | A | 70 | Confident | 72.9 | Confident | 5 Ų | 5 | 57.6 Ų | 57.6 | 4% | 0.041 | 31% | 0.312 | C | S | . | . | S | Bend | trans | -63.9 | 141.1 | -173.5 | 0 | 0 | 0 | 0 | 0 | 113.3 | L7 L42 R51 L54 | L7-A46 HydrophobicContact CD2-CB 4.12Å; L7-A46 VanDerWaalsContact CD2-N 3.26Å; L42-A46 WeakPolarHBondContact O-CA 3.49Å; L42-A46 WeakPolarHBondContact O-CB 3.5Å; L42-A46 PolarHBondContact O-N 3.26Å; A46-R51 HydrophobicContact CB-CG 4.05Å; A46-L54 HydrophobicContact CB-CD1 3.56Å |
| 47 | P | 65.4 | Low | 73.5 | Confident | 28 Ų | 28 | 57.3 Ų | 57.3 | 18% | 0.182 | 31% | 0.312 | C | S | . | . | trans | -54.7 | 149.9 | 165.9 | -19.7 | 30.3 | 0 | 0 | 0 | 111.4 | E3 E49 L50 R51 | E3-P47 HydrophobicContact CB-CG 4.12Å; P47-E49 WeakPolarHBondContact CB-OE2 3.44Å; P47-E49 PolarHBondContact O-N 3.36Å; P47-E49 VanDerWaalsContact O-N 3.14Å; P47-L50 HydrophobicContact CG-CD1 4.44Å; P47-L50 PolarHBondContact O-N 3.4Å; P47-R51 PolarHBondContact O-N 3.33Å | ||
| 48 | S | 68.4 | Low | 74.1 | Confident | 87 Ų | 87 | 56.3 Ų | 56.3 | 61% | 0.608 | 30% | 0.3 | S | S | * | . | H | α-helix | trans | -58.8 | -30.9 | -174.7 | 68.2 | 0 | 0 | 0 | 0 | 113.4 | L50 | S48-L50 VanDerWaalsContact C-N 3.28Å; S48-L50 PolarHBondContact O-N 3.06Å |
| 49 | E | 74.2 | Confident | 74.7 | Confident | 137 Ų | 137 | 57.8 Ų | 57.8 | 64% | 0.64 | 31% | 0.309 | S | S | * | . | H | α-helix | trans | -66.8 | -27.8 | -179.6 | -56 | 75.3 | -163.5 | 0 | 0 | 112.2 | P47 | P47-E49 WeakPolarHBondContact CB-OE2 3.44Å; P47-E49 PolarHBondContact O-N 3.36Å; P47-E49 VanDerWaalsContact O-N 3.14Å |
| 50 | L | 72.7 | Confident | 75.1 | Confident | 44 Ų | 44 | 65.9 Ų | 65.9 | 23% | 0.23 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -104 | -15.2 | -175.6 | -62.2 | -179.3 | 0 | 0 | 0 | 113.2 | P47 S48 L52 S53 L54 | P47-L50 HydrophobicContact CG-CD1 4.44Å; P47-L50 PolarHBondContact O-N 3.4Å; S48-L50 VanDerWaalsContact C-N 3.28Å; S48-L50 PolarHBondContact O-N 3.06Å; L50-L52 PolarHBondContact O-N 2.84Å; L50-S53 PolarHBondContact O-N 2.91Å; L50-L54 HydrophobicContact CB-CD1 4.19Å; L50-L54 WeakPolarHBondContact O-CB 3.42Å; L50-L54 VanDerWaalsContact O-CG 3.27Å; L50-L54 WeakPolarHBondContact O-CG 3.31Å; L50-L54 PolarHBondContact O-N 3.27Å |
| 51 | R | 73.9 | Confident | 75.4 | Confident | 110 Ų | 110 | 66 Ų | 66 | 42% | 0.415 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -57.8 | -43.7 | -176.8 | -85 | 174.9 | 25.9 | 124.9 | 1.7 | 113.3 | A46 P47 S53 L54 V55 | A46-R51 HydrophobicContact CB-CG 4.05Å; P47-R51 PolarHBondContact O-N 3.33Å; R51-S53 PolarHBondContact O-N 3.43Å; R51-L54 PolarHBondContact O-N 3.19Å; R51-V55 WeakPolarHBondContact O-CB 3.33Å; R51-V55 VanDerWaalsContact O-CG2 3.24Å; R51-V55 WeakPolarHBondContact O-CG2 3.35Å; R51-V55 PolarHBondContact O-N 3.41Å |
| 52 | L | 76.4 | Confident | 76 | Confident | 147 Ų | 147 | 64.3 Ų | 64.3 | 77% | 0.77 | 36% | 0.362 | S | S | * | . | H | α-helix | trans | -62.8 | -44.7 | -179.5 | -79.7 | 166.9 | 0 | 0 | 0 | 111.8 | L50 L54 V55 S56 | L50-L52 PolarHBondContact O-N 2.84Å; L52-L54 VanDerWaalsContact C-N 3.33Å; L52-L54 PolarHBondContact O-N 3.14Å; L52-V55 PolarHBondContact O-N 3.23Å; L52-S56 PolarHBondContact O-N 3.01Å; L52-S56 VanDerWaalsContact O-N 3.12Å |
| 53 | S | 78.8 | Confident | 76.5 | Confident | 78 Ų | 78 | 68 Ų | 68 | 55% | 0.545 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -63.6 | -40 | 177 | -56.4 | 0 | 0 | 0 | 0 | 111.6 | L50 R51 S56 L57 | L50-S53 PolarHBondContact O-N 2.91Å; R51-S53 PolarHBondContact O-N 3.43Å; S53-S56 PolarHBondContact O-N 3.48Å; S53-S56 PolarHBondContact O-OG 3.21Å; S53-L57 PolarHBondContact O-N 2.97Å |
| 54 | L | 78.5 | Confident | 76.7 | Confident | 37 Ų | 37 | 73.1 Ų | 73.1 | 19% | 0.194 | 42% | 0.417 | C | S | . | . | H | α-helix | trans | -74.1 | -35 | 179 | -66.7 | 170.9 | 0 | 0 | 0 | 113.2 | L42 L43 A46 L50 R51 L52 S56 L57 L58 | L42-L54 HydrophobicContact CD2-CD1 3.98Å; L42-L54 HydrophobicContact CD2-CD2 3.58Å; L42-L54 HydrophobicContact CD2-CG 4.4Å; L42-L54 HydrophobicContact CG-CD1 3.91Å; L42-L54 HydrophobicContact CG-CD2 4.41Å; L43-L54 VanDerWaalsContact CD1-C 3.44Å; L43-L54 HydrophobicContact CD1-CB 3.45Å; L43-L54 VanDerWaalsContact CD1-CB 3.45Å; A46-L54 HydrophobicContact CB-CD1 3.56Å; L50-L54 HydrophobicContact CB-CD1 4.19Å; L50-L54 WeakPolarHBondContact O-CB 3.42Å; L50-L54 VanDerWaalsContact O-CG 3.27Å; L50-L54 WeakPolarHBondContact O-CG 3.31Å; L50-L54 PolarHBondContact O-N 3.27Å; R51-L54 PolarHBondContact O-N 3.19Å; L52-L54 VanDerWaalsContact C-N 3.33Å; L52-L54 PolarHBondContact O-N 3.14Å; L54-S56 VanDerWaalsContact C-N 3.27Å; L54-S56 PolarHBondContact O-N 3Å; L54-L57 WeakPolarHBondContact O-CB 3.46Å; L54-L57 PolarHBondContact O-N 3.31Å; L54-L58 PolarHBondContact O-N 3.32Å; L54-L58 VanDerWaalsContact O-N 3.11Å |
| 55 | V | 80.8 | Confident | 76.9 | Confident | 32 Ų | 32 | 77.9 Ų | 77.9 | 19% | 0.194 | 44% | 0.441 | C | S | . | . | H | α-helix | trans | -59.2 | -44.9 | 172.2 | 167.2 | 0 | 0 | 0 | 0 | 108.9 | L43 R51 L52 L57 L58 V59 I71 | L43-V55 HydrophobicContact CD1-CB 4.43Å; L43-V55 HydrophobicContact CD1-CG2 3.85Å; L43-V55 VanDerWaalsContact CD1-N 3.34Å; L43-V55 HydrophobicContact CD2-CG2 3.87Å; L43-V55 HydrophobicContact CG-CG2 4.29Å; R51-V55 WeakPolarHBondContact O-CB 3.33Å; R51-V55 VanDerWaalsContact O-CG2 3.24Å; R51-V55 WeakPolarHBondContact O-CG2 3.35Å; R51-V55 PolarHBondContact O-N 3.41Å; L52-V55 PolarHBondContact O-N 3.23Å; V55-L57 PolarHBondContact O-N 3.3Å; V55-L58 PolarHBondContact O-N 2.86Å; V55-L58 VanDerWaalsContact O-N 3.13Å; V55-V59 HydrophobicContact CG1-CG1 4.28Å; V55-V59 WeakPolarHBondContact O-CG2 3.5Å; V55-V59 PolarHBondContact O-N 3.45Å; V55-I71 HydrophobicContact CG1-CD1 3.81Å; V55-I71 HydrophobicContact CG1-CG1 4.18Å |
| 56 | S | 80.8 | Confident | 77.3 | Confident | 74 Ų | 74 | 80.5 Ų | 80.5 | 52% | 0.517 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -61.2 | -32.4 | -179.2 | 80.7 | 0 | 0 | 0 | 0 | 113.1 | L52 S53 L54 | L52-S56 PolarHBondContact O-N 3.01Å; L52-S56 VanDerWaalsContact O-N 3.12Å; S53-S56 PolarHBondContact O-N 3.48Å; S53-S56 PolarHBondContact O-OG 3.21Å; L54-S56 VanDerWaalsContact C-N 3.27Å; L54-S56 PolarHBondContact O-N 3Å |
| 57 | L | 80.6 | Confident | 77.6 | Confident | 87 Ų | 87 | 81 Ų | 81 | 46% | 0.455 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -72 | -41.8 | 176.3 | -164.6 | 113.6 | 0 | 0 | 0 | 111.4 | F34 S53 L54 V55 R60 | F34-L57 HydrophobicContact CD1-CD2 4.23Å; F34-L57 HydrophobicContact CE1-CD2 3.76Å; S53-L57 PolarHBondContact O-N 2.97Å; L54-L57 WeakPolarHBondContact O-CB 3.46Å; L54-L57 PolarHBondContact O-N 3.31Å; V55-L57 PolarHBondContact O-N 3.3Å; L57-R60 WeakPolarHBondContact O-CB 3.34Å |
| 58 | L | 81.3 | Confident | 78 | Confident | 8 Ų | 8 | 83.9 Ų | 83.9 | 4% | 0.042 | 47% | 0.467 | C | S | . | . | H | α-helix | trans | -66.9 | -43.3 | -179.2 | 180 | 75 | 0 | 0 | 0 | 112.3 | Q39 L43 L54 V55 R60 M62 E70 I74 | Q39-L58 HydrophobicContact CB-CD1 3.89Å; L43-L58 HydrophobicContact CD2-CD2 4.17Å; L54-L58 PolarHBondContact O-N 3.32Å; L54-L58 VanDerWaalsContact O-N 3.11Å; V55-L58 PolarHBondContact O-N 2.86Å; V55-L58 VanDerWaalsContact O-N 3.13Å; L58-R60 PolarHBondContact O-N 3.1Å; L58-M62 VanDerWaalsContact O-CE 3.28Å; L58-M62 WeakPolarHBondContact O-CE 3.47Å; L58-E70 HydrophobicContact CD2-CG 3.88Å; L58-E70 HydrophobicContact CG-CG 4.32Å; L58-I74 HydrophobicContact CD2-CD1 3.21Å |
| 59 | V | 82 | Confident | 78.4 | Confident | 36 Ų | 36 | 84.8 Ų | 84.8 | 22% | 0.218 | 46% | 0.463 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -85.1 | 3.2 | -176.2 | -55 | 0 | 0 | 0 | 0 | 113.5 | V55 G61 M62 A67 I71 | V55-V59 HydrophobicContact CG1-CG1 4.28Å; V55-V59 WeakPolarHBondContact O-CG2 3.5Å; V55-V59 PolarHBondContact O-N 3.45Å; V59-G61 PolarHBondContact O-N 2.98Å; V59-M62 HydrophobicContact CB-SD 4.46Å; V59-M62 PolarHBondContact O-N 3.36Å; V59-M62 VanDerWaalsContact O-N 3.16Å; V59-A67 HydrophobicContact CB-CB 3.9Å; V59-A67 HydrophobicContact CG1-CB 3.84Å; V59-I71 HydrophobicContact CG1-CD1 4Å; V59-I71 HydrophobicContact CG1-CG1 4.13Å |
| 60 | R | 83.8 | Confident | 78.6 | Confident | 216 Ų | 216 | 79.3 Ų | 79.3 | 82% | 0.815 | 44% | 0.437 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.4 | 117.5 | -178.4 | -172.6 | 178.1 | -178.1 | -175.7 | 0.3 | 110.2 | L57 L58 M62 | L57-R60 WeakPolarHBondContact O-CB 3.34Å; L58-R60 PolarHBondContact O-N 3.1Å; R60-M62 VanDerWaalsContact C-N 3.35Å |
| 61 | G | 78.8 | Confident | 78.8 | Confident | 86 Ų | 86 | 80.5 Ų | 80.5 | 89% | 0.887 | 44% | 0.443 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 85.3 | 4.4 | 179.8 | 0 | 0 | 0 | 0 | 0 | 114.7 | V59 | V59-G61 PolarHBondContact O-N 2.98Š|
| 62 | M | 81.8 | Confident | 78.8 | Confident | 60 Ų | 60 | 80.4 Ų | 80.4 | 30% | 0.296 | 45% | 0.447 | S | S | . | . | trans | -85.5 | 154.4 | 170.5 | -65.1 | -177.4 | 177.8 | 0 | 0 | 111.2 | L58 V59 R60 E66 A67 E70 | L58-M62 VanDerWaalsContact O-CE 3.28Å; L58-M62 WeakPolarHBondContact O-CE 3.47Å; V59-M62 HydrophobicContact CB-SD 4.46Å; V59-M62 PolarHBondContact O-N 3.36Å; V59-M62 VanDerWaalsContact O-N 3.16Å; R60-M62 VanDerWaalsContact C-N 3.35Å; M62-E66 HydrophobicContact CB-CB 4.07Å; M62-A67 HydrophobicContact CB-CB 4.39Å; M62-E70 HydrophobicContact CE-CG 4.27Å; M62-E70 HydrophobicContact SD-CB 4.36Å; M62-E70 HydrophobicContact SD-CG 4.36Å | ||
| 63 | T | 86.7 | Confident | 78.8 | Confident | 80 Ų | 80 | 76.9 Ų | 76.9 | 49% | 0.491 | 43% | 0.432 | S | S | . | . | trans | -70.5 | 161.1 | 164.2 | 65.3 | 0 | 0 | 0 | 0 | 110.7 | L65 E66 A67 | T63-L65 PolarHBondContact O-N 3.33Å; T63-E66 WeakPolarHBondContact CB-OE2 3.43Å; T63-E66 WeakPolarHBondContact CG2-OE2 3.32Å; T63-E66 PolarHBondContact N-OE2 3Å; T63-E66 PolarHBondContact O-N 2.94Å; T63-E66 VanDerWaalsContact OG1-CG 3.28Å; T63-E66 WeakPolarHBondContact OG1-CG 3.38Å; T63-E66 PolarHBondContact OG1-N 2.95Å; T63-E66 PolarHBondContact OG1-OE2 3.01Å; T63-A67 WeakPolarHBondContact O-CB 2.95Å; T63-A67 PolarHBondContact O-N 3.38Å | ||
| 64 | V | 78.2 | Confident | 78.5 | Confident | 123 Ų | 123 | 73.6 Ų | 73.6 | 75% | 0.745 | 41% | 0.408 | S | S | * | . | H | α-helix | trans | -57.2 | -38.7 | 179.1 | 178.9 | 0 | 0 | 0 | 0 | 111.6 | V68 | V64-V68 VanDerWaalsContact O-CG2 3.26Å; V64-V68 WeakPolarHBondContact O-CG2 3.47Å; V64-V68 PolarHBondContact O-N 2.91Å |
| 65 | L | 74.8 | Confident | 78 | Confident | 120 Ų | 120 | 74 Ų | 74 | 63% | 0.628 | 42% | 0.416 | S | S | * | . | H | α-helix | trans | -67.8 | -45.7 | 179.4 | -178.3 | 61.5 | 0 | 0 | 0 | 111.9 | T63 A67 V68 M69 | T63-L65 PolarHBondContact O-N 3.33Å; L65-A67 VanDerWaalsContact C-N 3.34Å; L65-V68 PolarHBondContact O-N 3.12Å; L65-M69 HydrophobicContact CG-CE 4.39Å; L65-M69 WeakPolarHBondContact O-CG 3.47Å; L65-M69 PolarHBondContact O-N 3.37Å |
| 66 | E | 75.9 | Confident | 77.3 | Confident | 95 Ų | 95 | 76.1 Ų | 76.1 | 44% | 0.444 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -61.6 | -44 | 176 | -71 | 163.3 | 147.6 | 0 | 0 | 111.2 | M62 T63 V68 M69 E70 | M62-E66 HydrophobicContact CB-CB 4.07Å; T63-E66 WeakPolarHBondContact CB-OE2 3.43Å; T63-E66 WeakPolarHBondContact CG2-OE2 3.32Å; T63-E66 PolarHBondContact N-OE2 3Å; T63-E66 PolarHBondContact O-N 2.94Å; T63-E66 VanDerWaalsContact OG1-CG 3.28Å; T63-E66 WeakPolarHBondContact OG1-CG 3.38Å; T63-E66 PolarHBondContact OG1-N 2.95Å; T63-E66 PolarHBondContact OG1-OE2 3.01Å; E66-V68 PolarHBondContact O-N 2.97Å; E66-M69 PolarHBondContact O-N 3.39Å; E66-E70 WeakPolarHBondContact O-CB 3.49Å; E66-E70 PolarHBondContact O-N 2.94Å |
| 67 | A | 76 | Confident | 76.5 | Confident | 15 Ų | 15 | 76.2 Ų | 76.2 | 12% | 0.124 | 42% | 0.424 | C | S | . | . | H | α-helix | trans | -60.5 | -43 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | V59 M62 T63 L65 I71 | V59-A67 HydrophobicContact CB-CB 3.9Å; V59-A67 HydrophobicContact CG1-CB 3.84Å; M62-A67 HydrophobicContact CB-CB 4.39Å; T63-A67 WeakPolarHBondContact O-CB 2.95Å; T63-A67 PolarHBondContact O-N 3.38Å; L65-A67 VanDerWaalsContact C-N 3.34Å; A67-I71 WeakPolarHBondContact O-CB 3.44Å; A67-I71 WeakPolarHBondContact O-CD1 3.25Å; A67-I71 WeakPolarHBondContact O-CG1 3.16Å; A67-I71 PolarHBondContact O-N 3.06Å |
| 68 | V | 73.2 | Confident | 75.7 | Confident | 89 Ų | 89 | 72.2 Ų | 72.2 | 54% | 0.539 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -64.5 | -47 | 177.7 | 168.6 | 0 | 0 | 0 | 0 | 111.3 | V64 L65 E66 E70 I71 Q72 | V64-V68 VanDerWaalsContact O-CG2 3.26Å; V64-V68 WeakPolarHBondContact O-CG2 3.47Å; V64-V68 PolarHBondContact O-N 2.91Å; L65-V68 PolarHBondContact O-N 3.12Å; E66-V68 PolarHBondContact O-N 2.97Å; V68-E70 VanDerWaalsContact C-N 3.34Å; V68-E70 PolarHBondContact O-N 2.99Å; V68-I71 PolarHBondContact O-N 3.24Å; V68-Q72 WeakPolarHBondContact O-CB 3.19Å; V68-Q72 PolarHBondContact O-N 3.01Å |
| 69 | M | 77.6 | Confident | 74.7 | Confident | 107 Ų | 107 | 76.1 Ų | 76.1 | 53% | 0.527 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -63.4 | -41.8 | 178.9 | -69.5 | -169.6 | -55.7 | 0 | 0 | 112.1 | L65 E66 Q72 T73 | L65-M69 HydrophobicContact CG-CE 4.39Å; L65-M69 WeakPolarHBondContact O-CG 3.47Å; L65-M69 PolarHBondContact O-N 3.37Å; E66-M69 PolarHBondContact O-N 3.39Å; M69-Q72 PolarHBondContact O-N 3.35Å; M69-T73 WeakPolarHBondContact O-CB 3.45Å; M69-T73 PolarHBondContact O-N 2.9Å; M69-T73 PolarHBondContact O-OG1 3.37Å |
| 70 | E | 77.1 | Confident | 73.6 | Confident | 21 Ų | 21 | 79.8 Ų | 79.8 | 10% | 0.098 | 44% | 0.442 | C | S | . | . | H | α-helix | trans | -65.1 | -46.3 | 179.8 | -172.3 | 71.4 | -176 | 0 | 0 | 111.2 | R40 L58 M62 E66 V68 T73 I74 | R40-E70 IonicContact CZ-OE1 3.06Å; R40-E70 IonicContact CZ-OE2 3.75Å; R40-E70 IonicContact NE-OE1 2.65Å; R40-E70 PolarHBondContact NE-OE1 2.9Å; R40-E70 IonicContact NE-OE2 3.86Å; R40-E70 IonicContact NH2-OE1 2.79Å; R40-E70 PolarHBondContact NH2-OE1 3.31Å; R40-E70 IonicContact NH2-OE2 2.8Å; R40-E70 PolarHBondContact NH2-OE2 3.07Å; L58-E70 HydrophobicContact CD2-CG 3.88Å; L58-E70 HydrophobicContact CG-CG 4.32Å; M62-E70 HydrophobicContact CE-CG 4.27Å; M62-E70 HydrophobicContact SD-CB 4.36Å; M62-E70 HydrophobicContact SD-CG 4.36Å; E66-E70 WeakPolarHBondContact O-CB 3.49Å; E66-E70 PolarHBondContact O-N 2.94Å; V68-E70 VanDerWaalsContact C-N 3.34Å; V68-E70 PolarHBondContact O-N 2.99Å; E70-T73 PolarHBondContact O-N 3.5Å; E70-I74 HydrophobicContact CG-CD1 4.12Å; E70-I74 WeakPolarHBondContact O-CD1 3.02Å; E70-I74 VanDerWaalsContact O-CG1 3.25Å; E70-I74 WeakPolarHBondContact O-CG1 3.36Å; E70-I74 PolarHBondContact O-N 3.17Å; E70-I74 VanDerWaalsContact O-N 3.07Å |
| 71 | I | 77.9 | Confident | 72 | Confident | 70 Ų | 70 | 76.1 Ų | 76.1 | 36% | 0.359 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -62.6 | -44.3 | 176.9 | -70.1 | 167.4 | 0 | 0 | 0 | 111.1 | V55 V59 A67 V68 I74 A75 | V55-I71 HydrophobicContact CG1-CD1 3.81Å; V55-I71 HydrophobicContact CG1-CG1 4.18Å; V59-I71 HydrophobicContact CG1-CD1 4Å; V59-I71 HydrophobicContact CG1-CG1 4.13Å; A67-I71 WeakPolarHBondContact O-CB 3.44Å; A67-I71 WeakPolarHBondContact O-CD1 3.25Å; A67-I71 WeakPolarHBondContact O-CG1 3.16Å; A67-I71 PolarHBondContact O-N 3.06Å; V68-I71 PolarHBondContact O-N 3.24Å; I71-I74 PolarHBondContact O-N 3.48Å; I71-A75 WeakPolarHBondContact O-CB 3.3Å; I71-A75 PolarHBondContact O-N 3.48Å |
| 72 | Q | 74.4 | Confident | 70.9 | Confident | 107 Ų | 107 | 79 Ų | 79 | 50% | 0.5 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -62.4 | -46.7 | 179.4 | -175.4 | 59.4 | 51.3 | 0 | 0 | 111.1 | V68 M69 I74 A75 D76 | V68-Q72 WeakPolarHBondContact O-CB 3.19Å; V68-Q72 PolarHBondContact O-N 3.01Å; M69-Q72 PolarHBondContact O-N 3.35Å; Q72-I74 VanDerWaalsContact C-N 3.29Å; Q72-I74 PolarHBondContact O-N 3.38Å; Q72-A75 WeakPolarHBondContact O-CB 3.26Å; Q72-A75 PolarHBondContact O-N 2.98Å; Q72-A75 VanDerWaalsContact O-N 3.13Å; Q72-D76 PolarHBondContact NE2-OD1 3.38Å; Q72-D76 PolarHBondContact NE2-OD2 3.05Å; Q72-D76 VanDerWaalsContact NE2-OD2 3.15Å; Q72-D76 PolarHBondContact O-N 3.44Å |
| 73 | T | 75.1 | Confident | 69.3 | Low | 74 Ų | 74 | 83.4 Ų | 83.4 | 45% | 0.454 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -57.2 | -43.3 | 177.3 | -57.5 | 0 | 0 | 0 | 0 | 111.3 | M69 E70 D76 V77 | M69-T73 WeakPolarHBondContact O-CB 3.45Å; M69-T73 PolarHBondContact O-N 2.9Å; M69-T73 PolarHBondContact O-OG1 3.37Å; E70-T73 PolarHBondContact O-N 3.5Å; T73-D76 PolarHBondContact O-N 3.34Å; T73-V77 HydrophobicContact CG2-CG2 4.49Å; T73-V77 WeakPolarHBondContact O-CB 3.16Å; T73-V77 VanDerWaalsContact O-CG2 3.26Å; T73-V77 WeakPolarHBondContact O-CG2 3.42Å; T73-V77 PolarHBondContact O-N 3.14Å |
| 74 | I | 72.4 | Confident | 67.4 | Low | 9 Ų | 9 | 83.7 Ų | 83.7 | 5% | 0.046 | 44% | 0.438 | C | S | . | . | H | α-helix | trans | -72.4 | -34.2 | 179.5 | -62.2 | 162.3 | 0 | 0 | 0 | 111.8 | R40 L43 L58 E70 I71 Q72 D76 G78 | R40-I74 HydrophobicContact CG-CD1 3.92Å; R40-I74 HydrophobicContact CG-CG1 4.1Å; L43-I74 HydrophobicContact CB-CG2 4.18Å; L43-I74 HydrophobicContact CD2-CB 4.29Å; L43-I74 HydrophobicContact CD2-CD1 3.85Å; L43-I74 HydrophobicContact CD2-CG2 3.69Å; L43-I74 HydrophobicContact CG-CG2 4.41Å; L58-I74 HydrophobicContact CD2-CD1 3.21Å; E70-I74 HydrophobicContact CG-CD1 4.12Å; E70-I74 WeakPolarHBondContact O-CD1 3.02Å; E70-I74 VanDerWaalsContact O-CG1 3.25Å; E70-I74 WeakPolarHBondContact O-CG1 3.36Å; E70-I74 PolarHBondContact O-N 3.17Å; E70-I74 VanDerWaalsContact O-N 3.07Å; I71-I74 PolarHBondContact O-N 3.48Å; Q72-I74 VanDerWaalsContact C-N 3.29Å; Q72-I74 PolarHBondContact O-N 3.38Å; I74-D76 VanDerWaalsContact C-N 3.34Å; I74-G78 WeakPolarHBondContact O-CA 3.22Å; I74-G78 PolarHBondContact O-N 3.14Å |
| 75 | A | 69.9 | Low | 65.9 | Low | 44 Ų | 44 | 82.3 Ų | 82.3 | 36% | 0.364 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -61.7 | -44.8 | 173.7 | 0 | 0 | 0 | 0 | 0 | 111 | I71 Q72 G78 L79 | I71-A75 WeakPolarHBondContact O-CB 3.3Å; I71-A75 PolarHBondContact O-N 3.48Å; Q72-A75 WeakPolarHBondContact O-CB 3.26Å; Q72-A75 PolarHBondContact O-N 2.98Å; Q72-A75 VanDerWaalsContact O-N 3.13Å; A75-G78 PolarHBondContact O-N 3.45Å; A75-L79 WeakPolarHBondContact O-CB 3.32Å; A75-L79 VanDerWaalsContact O-CG 3.24Å; A75-L79 WeakPolarHBondContact O-CG 3.46Å; A75-L79 PolarHBondContact O-N 3.47Å |
| 76 | D | 65.8 | Low | 64.2 | Low | 78 Ų | 78 | 82.4 Ų | 82.4 | 42% | 0.417 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -67.4 | -47.3 | 179.9 | -64.9 | -27.5 | 0 | 0 | 0 | 111.7 | Q72 T73 I74 G78 L79 L80 | Q72-D76 PolarHBondContact NE2-OD1 3.38Å; Q72-D76 PolarHBondContact NE2-OD2 3.05Å; Q72-D76 VanDerWaalsContact NE2-OD2 3.15Å; Q72-D76 PolarHBondContact O-N 3.44Å; T73-D76 PolarHBondContact O-N 3.34Å; I74-D76 VanDerWaalsContact C-N 3.34Å; D76-G78 VanDerWaalsContact C-N 3.31Å; D76-G78 PolarHBondContact O-N 3.27Å; D76-L79 PolarHBondContact O-N 2.66Å; D76-L80 WeakPolarHBondContact O-CG 3.36Å; D76-L80 PolarHBondContact O-N 3.36Å; D76-L80 VanDerWaalsContact O-N 3.08Å |
| 77 | V | 62.7 | Low | 62.8 | Low | 75 Ų | 75 | 80.8 Ų | 80.8 | 46% | 0.455 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -63 | -38.9 | 174.5 | 173.3 | 0 | 0 | 0 | 0 | 111.1 | T73 L80 W81 | T73-V77 HydrophobicContact CG2-CG2 4.49Å; T73-V77 WeakPolarHBondContact O-CB 3.16Å; T73-V77 VanDerWaalsContact O-CG2 3.26Å; T73-V77 WeakPolarHBondContact O-CG2 3.42Å; T73-V77 PolarHBondContact O-N 3.14Å; V77-L80 PolarHBondContact O-N 3Å; V77-W81 WeakPolarHBondContact O-CB 3.1Å; V77-W81 PolarHBondContact O-N 3.46Å |
| 78 | G | 64.7 | Low | 61.4 | Low | 4 Ų | 4 | 92.1 Ų | 92.1 | 4% | 0.041 | 48% | 0.479 | C | S | . | . | H | α-helix | trans | -71 | -29.6 | 179.4 | 0 | 0 | 0 | 0 | 0 | 114 | T44 I74 A75 D76 R82 | T44-G78 VanDerWaalsContact CG2-CA 3.45Å; I74-G78 WeakPolarHBondContact O-CA 3.22Å; I74-G78 PolarHBondContact O-N 3.14Å; A75-G78 PolarHBondContact O-N 3.45Å; D76-G78 VanDerWaalsContact C-N 3.31Å; D76-G78 PolarHBondContact O-N 3.27Å; G78-R82 WeakPolarHBondContact O-CB 3.14Å; G78-R82 PolarHBondContact O-N 3.21Å |
| 79 | L | 61.1 | Low | 60 | Low | 90 Ų | 90 | 92.6 Ų | 92.6 | 47% | 0.471 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -69.1 | -42 | 169.8 | -74.9 | 168.1 | 0 | 0 | 0 | 111.6 | A75 D76 Q83 | A75-L79 WeakPolarHBondContact O-CB 3.32Å; A75-L79 VanDerWaalsContact O-CG 3.24Å; A75-L79 WeakPolarHBondContact O-CG 3.46Å; A75-L79 PolarHBondContact O-N 3.47Å; D76-L79 PolarHBondContact O-N 2.66Å; L79-Q83 WeakPolarHBondContact O-CB 3.35Å; L79-Q83 WeakPolarHBondContact O-CG 3.27Å; L79-Q83 PolarHBondContact O-N 3.42Å; L79-Q83 VanDerWaalsContact O-N 3.09Å; L79-Q83 PolarHBondContact O-NE2 3.44Å; L79-Q83 VanDerWaalsContact O-NE2 3.13Å |
| 80 | L | 57.7 | Low | 58.2 | Low | 112 Ų | 112 | 96.1 Ų | 96.1 | 59% | 0.586 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -63.8 | -43 | 174.5 | -70.6 | 167.9 | 0 | 0 | 0 | 111.4 | D76 V77 Q83 S84 | D76-L80 WeakPolarHBondContact O-CG 3.36Å; D76-L80 PolarHBondContact O-N 3.36Å; D76-L80 VanDerWaalsContact O-N 3.08Å; V77-L80 PolarHBondContact O-N 3Å; L80-Q83 PolarHBondContact O-N 2.94Å; L80-S84 WeakPolarHBondContact O-CB 3.49Å; L80-S84 PolarHBondContact O-N 3.3Å; L80-S84 VanDerWaalsContact O-N 3.07Å; L80-S84 PolarHBondContact O-OG 3.31Å |
| 81 | W | 50.6 | Low | 56.7 | Low | 140 Ų | 140 | 99.3 Ų | 99.3 | 53% | 0.53 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -62.7 | -50.9 | 176.7 | -168.2 | -98.9 | 0 | 0 | 0 | 110.8 | T44 V77 Q83 S84 H85 | T44-W81 HydrophobicContact CG2-CB 3.87Å; T44-W81 HydrophobicContact CG2-CG 4Å; V77-W81 WeakPolarHBondContact O-CB 3.1Å; V77-W81 PolarHBondContact O-N 3.46Å; W81-Q83 VanDerWaalsContact C-N 3.29Å; W81-Q83 PolarHBondContact O-N 3.28Å; W81-S84 PolarHBondContact O-N 3.5Å; W81-H85 AromaticContact CD1-CE1 3.51Å; W81-H85 AromaticContact CD1-ND1 3.73Å; W81-H85 AromaticContact CD2-CE1 3.31Å; W81-H85 AromaticContact CE2-CE1 2.96Å; W81-H85 AromaticContact CE2-ND1 3.94Å; W81-H85 AromaticContact CE2-NE2 3.4Å; W81-H85 AromaticContact CE3-CE1 3.93Å; W81-H85 AromaticContact CG-CE1 3.67Å; W81-H85 AromaticContact CG-ND1 3.97Å; W81-H85 AromaticContact CH2-CE1 3.93Å; W81-H85 AromaticContact CZ2-CE1 3.32Å; W81-H85 WeakPolarHBondContact CZ2-CE1 3.43Å; W81-H85 AromaticContact CZ2-NE2 3.37Å; W81-H85 WeakPolarHBondContact CZ2-NE2 3.3Å; W81-H85 AromaticContact NE1-CE1 3.09Å; W81-H85 PolarHBondContact NE1-CE1 3.49Å; W81-H85 AromaticContact NE1-ND1 3.71Å; W81-H85 AromaticContact NE1-NE2 3.46Å; W81-H85 PolarHBondContact NE1-NE2 2.84Å; W81-H85 PolarHBondContact O-N 2.84Å; W81-H85 PolarHBondContact O-ND1 3.29Å |
| 82 | R | 55.2 | Low | 55.5 | Low | 147 Ų | 147 | 104 Ų | 104 | 56% | 0.555 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -58.1 | -39.3 | 178.6 | -115.3 | -168 | -69.4 | -95.7 | -1.1 | 113.1 | G78 S84 | G78-R82 WeakPolarHBondContact O-CB 3.14Å; G78-R82 PolarHBondContact O-N 3.21Å; R82-S84 VanDerWaalsContact C-N 3.28Å; R82-S84 PolarHBondContact O-N 3.32Å |
| 83 | Q | 48.8 | Very low | 54.4 | Low | 152 Ų | 152 | 100.1 Ų | 100.1 | 71% | 0.71 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -68.9 | -27.7 | 177.1 | -75.7 | 174.4 | 73.1 | 0 | 0 | 112.7 | L79 L80 W81 H85 | L79-Q83 WeakPolarHBondContact O-CB 3.35Å; L79-Q83 WeakPolarHBondContact O-CG 3.27Å; L79-Q83 PolarHBondContact O-N 3.42Å; L79-Q83 VanDerWaalsContact O-N 3.09Å; L79-Q83 PolarHBondContact O-NE2 3.44Å; L79-Q83 VanDerWaalsContact O-NE2 3.13Å; L80-Q83 PolarHBondContact O-N 2.94Å; W81-Q83 VanDerWaalsContact C-N 3.29Å; W81-Q83 PolarHBondContact O-N 3.28Å; Q83-H85 VanDerWaalsContact C-N 3.33Å; Q83-H85 PolarHBondContact O-N 3.06Å |
| 84 | S | 46.3 | Very low | 53 | Low | 85 Ų | 85 | 98.7 Ų | 98.7 | 59% | 0.594 | 52% | 0.517 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85.5 | 2.5 | -178.8 | -54.6 | 0 | 0 | 0 | 0 | 114.4 | L80 W81 R82 P86 | L80-S84 WeakPolarHBondContact O-CB 3.49Å; L80-S84 PolarHBondContact O-N 3.3Å; L80-S84 VanDerWaalsContact O-N 3.07Å; L80-S84 PolarHBondContact O-OG 3.31Å; W81-S84 PolarHBondContact O-N 3.5Å; R82-S84 VanDerWaalsContact C-N 3.28Å; R82-S84 PolarHBondContact O-N 3.32Å; S84-P86 WeakPolarHBondContact O-CD 3.47Å |
| 85 | H | 46.2 | Very low | 51.7 | Low | 95 Ų | 95 | 99.8 Ų | 99.8 | 44% | 0.44 | 53% | 0.525 | S | S | . | . | trans | -111.3 | 71.9 | -179.6 | -71.3 | 70.2 | 0 | 0 | 0 | 113.3 | W81 Q83 G87 | W81-H85 AromaticContact CD1-CE1 3.51Å; W81-H85 AromaticContact CD1-ND1 3.73Å; W81-H85 AromaticContact CD2-CE1 3.31Å; W81-H85 AromaticContact CE2-CE1 2.96Å; W81-H85 AromaticContact CE2-ND1 3.94Å; W81-H85 AromaticContact CE2-NE2 3.4Å; W81-H85 AromaticContact CE3-CE1 3.93Å; W81-H85 AromaticContact CG-CE1 3.67Å; W81-H85 AromaticContact CG-ND1 3.97Å; W81-H85 AromaticContact CH2-CE1 3.93Å; W81-H85 AromaticContact CZ2-CE1 3.32Å; W81-H85 WeakPolarHBondContact CZ2-CE1 3.43Å; W81-H85 AromaticContact CZ2-NE2 3.37Å; W81-H85 WeakPolarHBondContact CZ2-NE2 3.3Å; W81-H85 AromaticContact NE1-CE1 3.09Å; W81-H85 PolarHBondContact NE1-CE1 3.49Å; W81-H85 AromaticContact NE1-ND1 3.71Å; W81-H85 AromaticContact NE1-NE2 3.46Å; W81-H85 PolarHBondContact NE1-NE2 2.84Å; W81-H85 PolarHBondContact O-N 2.84Å; W81-H85 PolarHBondContact O-ND1 3.29Å; Q83-H85 VanDerWaalsContact C-N 3.33Å; Q83-H85 PolarHBondContact O-N 3.06Å; H85-G87 PolarHBondContact O-N 3.28Å | ||
| 86 | P | 39.5 | Very low | 50.7 | Low | 122 Ų | 122 | 101.6 Ų | 101.6 | 79% | 0.792 | 53% | 0.528 | S | S | * | . | S | Bend | trans | -76.7 | 100.3 | 161 | 31 | -27.1 | 0 | 0 | 0 | 108.5 | S84 | S84-P86 WeakPolarHBondContact O-CD 3.47Š|
| 87 | G | 47.3 | Very low | 50.7 | Low | 60 Ų | 60 | 98.4 Ų | 98.4 | 62% | 0.619 | 51% | 0.512 | S | S | * | . | S | Bend | trans | 93.5 | 100.2 | 171.4 | 0 | 0 | 0 | 0 | 0 | 114 | H85 T89 | H85-G87 PolarHBondContact O-N 3.28Å; G87-T89 PolarHBondContact O-N 3.46Å |
| 88 | R | 46.4 | Very low | 50.9 | Low | 253 Ų | 253 | 98.3 Ų | 98.3 | 96% | 0.955 | 51% | 0.512 | S | S | * | . | trans | -49 | 106.8 | 164.6 | -92.2 | 174.3 | 156.2 | 166 | -6.7 | 110 | K90 | R88-K90 VanDerWaalsContact C-N 3.27Å; R88-K90 PolarHBondContact O-N 3.09Å | ||
| 89 | T | 43 | Very low | 51.2 | Low | 100 Ų | 100 | 103.7 Ų | 103.7 | 61% | 0.613 | 53% | 0.531 | S | S | * | . | trans | -68.4 | 90.1 | 159.8 | 20.9 | 0 | 0 | 0 | 0 | 109 | G87 L91 | G87-T89 PolarHBondContact O-N 3.46Å; T89-L91 PolarHBondContact O-N 2.94Å | ||
| 90 | K | 40.4 | Very low | 51.7 | Low | 181 Ų | 181 | 107.6 Ų | 107.6 | 79% | 0.787 | 54% | 0.544 | S | S | * | . | trans | -60.6 | 114.1 | 167 | -165.1 | 170.8 | -176.3 | 176.9 | 0 | 107.3 | R88 M92 | R88-K90 VanDerWaalsContact C-N 3.27Å; R88-K90 PolarHBondContact O-N 3.09Å; K90-M92 PolarHBondContact O-N 3.32Å | ||
| 91 | L | 45 | Very low | 52.5 | Low | 87 Ų | 87 | 105.4 Ų | 105.4 | 46% | 0.455 | 53% | 0.533 | S | S | . | . | trans | -55.5 | 122.7 | 161.4 | -65.7 | 171.5 | 0 | 0 | 0 | 105.9 | T89 L93 Y128 | T89-L91 PolarHBondContact O-N 2.94Å; L91-L93 CarbonylContact C-O 3.24Å; L91-L93 VanDerWaalsContact C-O 3.24Å; L91-L93 WeakPolarHBondContact CB-O 3.32Å; L91-L93 CarbonylContact O-C 3.57Å; L91-L93 PolarHBondContact O-N 3.2Å; L91-L93 VanDerWaalsContact O-O 3.07Å; L91-Y128 HydrophobicContact CD2-CE1 4.25Å | ||
| 92 | M | 52.5 | Low | 53.4 | Low | 169 Ų | 169 | 98.8 Ų | 98.8 | 83% | 0.833 | 51% | 0.508 | S | S | * | . | S | Bend | trans | -61.7 | -29.6 | -175.1 | -75.4 | -100.4 | 177.5 | 0 | 0 | 111.5 | K90 Y128 | K90-M92 PolarHBondContact O-N 3.32Å; M92-Y128 PolarHBondContact N-OH 3.47Å |
| 93 | L | 52.2 | Low | 54.5 | Low | 25 Ų | 25 | 93.3 Ų | 93.3 | 13% | 0.131 | 49% | 0.489 | C | S | . | . | S | Bend | trans | -93.8 | 132.8 | 162.5 | -72.7 | 148.6 | 0 | 0 | 0 | 107.3 | L91 P97 D101 W105 Y128 | L91-L93 CarbonylContact C-O 3.24Å; L91-L93 VanDerWaalsContact C-O 3.24Å; L91-L93 WeakPolarHBondContact CB-O 3.32Å; L91-L93 CarbonylContact O-C 3.57Å; L91-L93 PolarHBondContact O-N 3.2Å; L91-L93 VanDerWaalsContact O-O 3.07Å; L93-P97 HydrophobicContact CB-CB 3.92Å; L93-P97 HydrophobicContact CD1-CB 4.47Å; L93-P97 HydrophobicContact CD2-CB 4.42Å; L93-D101 HydrophobicContact CD2-CB 3.33Å; L93-W105 HydrophobicContact CD1-CB 3.48Å; L93-W105 VanDerWaalsContact CD1-CB 3.48Å; L93-W105 HydrophobicContact CD1-CD2 4.36Å; L93-W105 HydrophobicContact CD1-CG 3.6Å; L93-W105 HydrophobicContact CG-CB 4.31Å; L93-W105 HydrophobicContact CG-CG 4.36Å; L93-Y128 HydrophobicContact CD1-CD2 3.92Å; L93-Y128 HydrophobicContact CD1-CE2 3.56Å |
| 94 | G | 45.3 | Very low | 55.8 | Low | 45 Ų | 45 | 87.7 Ų | 87.7 | 46% | 0.464 | 47% | 0.472 | S | S | . | . | trans | -55.7 | 176.5 | -178.5 | 0 | 0 | 0 | 0 | 0 | 114.1 | N96 P97 | G94-N96 PolarHBondContact O-N 3.34Å; G94-P97 WeakPolarHBondContact O-CD 3.37Å | ||
| 95 | P | 46.1 | Very low | 57.6 | Low | 32 Ų | 32 | 85.2 Ų | 85.2 | 21% | 0.208 | 45% | 0.45 | C | S | . | . | S | Bend | trans | -70.1 | -3.3 | -159.8 | -19.8 | 32.7 | 0 | 0 | 0 | 117.5 | Q6 E10 | Q6-P95 HydrophobicContact CG-CB 4.22Å; Q6-P95 HydrophobicContact CG-CG 3.77Å; Q6-P95 VanDerWaalsContact NE2-CB 3.27Å; E10-P95 HydrophobicContact CG-CB 3.45Å; E10-P95 VanDerWaalsContact CG-CB 3.45Å; E10-P95 HydrophobicContact CG-CG 4.19Å; E10-P95 WeakPolarHBondContact OE1-CB 3.49Å; E10-P95 WeakPolarHBondContact OE1-CG 3.48Å |
| 96 | N | 49.2 | Very low | 59.2 | Low | 81 Ų | 81 | 80.7 Ų | 80.7 | 43% | 0.433 | 43% | 0.429 | S | S | . | . | S | Bend | trans | -139.9 | 79.4 | 169.6 | -172 | 0.2 | 0 | 0 | 0 | 108.1 | G94 T98 | G94-N96 PolarHBondContact O-N 3.34Å; N96-T98 PolarHBondContact O-N 3.15Å |
| 97 | P | 63.9 | Low | 61.2 | Low | 12 Ų | 12 | 78.3 Ų | 78.3 | 8% | 0.078 | 41% | 0.409 | C | S | . | . | trans | -67.8 | 120.8 | -179.7 | 29.3 | -33.2 | 0 | 0 | 0 | 108.6 | L93 G94 D101 L102 L125 | L93-P97 HydrophobicContact CB-CB 3.92Å; L93-P97 HydrophobicContact CD1-CB 4.47Å; L93-P97 HydrophobicContact CD2-CB 4.42Å; G94-P97 WeakPolarHBondContact O-CD 3.37Å; P97-D101 HydrophobicContact CB-CB 4.44Å; P97-L102 HydrophobicContact CB-CD2 3.89Å; P97-L102 HydrophobicContact CB-CG 3.96Å; P97-L102 HydrophobicContact CG-CD2 3.76Å; P97-L102 HydrophobicContact CG-CG 4.11Å; P97-L125 HydrophobicContact CG-CD1 4Å | ||
| 98 | T | 68.4 | Low | 62.6 | Low | 73 Ų | 73 | 80.2 Ų | 80.2 | 45% | 0.448 | 41% | 0.413 | S | S | . | . | trans | -65.7 | 161.5 | 175 | 70.9 | 0 | 0 | 0 | 0 | 109.4 | N96 K100 D101 L102 | N96-T98 PolarHBondContact O-N 3.15Å; T98-K100 PolarHBondContact O-N 3.46Å; T98-K100 VanDerWaalsContact O-N 3.09Å; T98-D101 VanDerWaalsContact CB-OD2 3.31Å; T98-D101 WeakPolarHBondContact CB-OD2 3.32Å; T98-D101 WeakPolarHBondContact CG2-OD2 3.38Å; T98-D101 PolarHBondContact N-OD2 3.42Å; T98-D101 WeakPolarHBondContact O-CA 3.24Å; T98-D101 PolarHBondContact O-N 3.02Å; T98-D101 PolarHBondContact OG1-N 2.8Å; T98-D101 PolarHBondContact OG1-OD1 3.37Å; T98-D101 PolarHBondContact OG1-OD2 2.9Å; T98-L102 PolarHBondContact O-N 3.12Å | ||
| 99 | R | 70.1 | Confident | 64 | Low | 117 Ų | 117 | 72.4 Ų | 72.4 | 44% | 0.442 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -51.1 | -37.1 | 174.8 | -175.5 | 177.3 | -180 | -159.9 | -2.3 | 112.3 | L103 D117 L124 | R99-L103 HydrophobicContact CG-CD1 3.98Å; R99-L103 WeakPolarHBondContact O-CB 3.39Å; R99-L103 WeakPolarHBondContact O-CD1 3.27Å; R99-L103 VanDerWaalsContact O-CG 3.22Å; R99-L103 WeakPolarHBondContact O-CG 3.3Å; R99-L103 PolarHBondContact O-N 2.93Å; R99-D117 PolarHBondContact NH2-O 3.07Å; R99-L124 HydrophobicContact CG-CD1 3.96Å |
| 100 | K | 72.6 | Confident | 65.6 | Low | 171 Ų | 171 | 70.7 Ų | 70.7 | 74% | 0.743 | 39% | 0.39 | S | S | * | . | H | α-helix | trans | -65 | -40.7 | 176.6 | -175.3 | -177.6 | 175.4 | -176.9 | 0 | 111.7 | T98 L103 G104 | T98-K100 PolarHBondContact O-N 3.46Å; T98-K100 VanDerWaalsContact O-N 3.09Å; K100-L103 PolarHBondContact O-N 2.68Å; K100-G104 PolarHBondContact O-N 2.94Å |
| 101 | D | 73.1 | Confident | 67.6 | Low | 66 Ų | 66 | 62.9 Ų | 62.9 | 35% | 0.353 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -72.1 | -39.6 | -178.6 | -47.3 | -44.9 | 0 | 0 | 0 | 111.2 | L93 P97 T98 G104 W105 | L93-D101 HydrophobicContact CD2-CB 3.33Å; P97-D101 HydrophobicContact CB-CB 4.44Å; T98-D101 VanDerWaalsContact CB-OD2 3.31Å; T98-D101 WeakPolarHBondContact CB-OD2 3.32Å; T98-D101 WeakPolarHBondContact CG2-OD2 3.38Å; T98-D101 PolarHBondContact N-OD2 3.42Å; T98-D101 WeakPolarHBondContact O-CA 3.24Å; T98-D101 PolarHBondContact O-N 3.02Å; T98-D101 PolarHBondContact OG1-N 2.8Å; T98-D101 PolarHBondContact OG1-OD1 3.37Å; T98-D101 PolarHBondContact OG1-OD2 2.9Å; D101-G104 PolarHBondContact O-N 2.93Å; D101-W105 WeakPolarHBondContact O-CB 3.39Å; D101-W105 PolarHBondContact O-N 3.48Å |
| 102 | L | 70.9 | Confident | 69.5 | Low | 1 Ų | 1 | 61.4 Ų | 61.4 | 1% | 0.005 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -60.2 | -48.7 | 171.7 | -69.6 | 172.3 | 0 | 0 | 0 | 111.6 | P97 T98 W105 L106 T121 L124 L125 Y128 | P97-L102 HydrophobicContact CB-CD2 3.89Å; P97-L102 HydrophobicContact CB-CG 3.96Å; P97-L102 HydrophobicContact CG-CD2 3.76Å; P97-L102 HydrophobicContact CG-CG 4.11Å; T98-L102 PolarHBondContact O-N 3.12Å; L102-W105 PolarHBondContact O-N 3.45Å; L102-L106 WeakPolarHBondContact O-CB 3.42Å; L102-L106 WeakPolarHBondContact O-CD1 3.45Å; L102-L106 VanDerWaalsContact O-CG 3.23Å; L102-L106 WeakPolarHBondContact O-CG 3.44Å; L102-L106 PolarHBondContact O-N 2.99Å; L102-T121 HydrophobicContact CD1-CG2 4Å; L102-L124 HydrophobicContact CB-CB 4.34Å; L102-L124 HydrophobicContact CD1-CB 4.12Å; L102-L125 HydrophobicContact CD1-CB 4.44Å; L102-L125 HydrophobicContact CD1-CD1 4.24Å; L102-L125 HydrophobicContact CD2-CD1 3.96Å; L102-Y128 HydrophobicContact CD2-CD1 4.25Å; L102-Y128 HydrophobicContact CD2-CG 3.98Å |
| 103 | L | 77.7 | Confident | 70.9 | Confident | 32 Ų | 32 | 60.6 Ų | 60.6 | 17% | 0.168 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -60.5 | -47.8 | 177.8 | -76.9 | 166.1 | 0 | 0 | 0 | 111.6 | R99 K100 W105 L106 L107 V116 L124 | R99-L103 HydrophobicContact CG-CD1 3.98Å; R99-L103 WeakPolarHBondContact O-CB 3.39Å; R99-L103 WeakPolarHBondContact O-CD1 3.27Å; R99-L103 VanDerWaalsContact O-CG 3.22Å; R99-L103 WeakPolarHBondContact O-CG 3.3Å; R99-L103 PolarHBondContact O-N 2.93Å; K100-L103 PolarHBondContact O-N 2.68Å; L103-W105 VanDerWaalsContact C-N 3.32Å; L103-W105 PolarHBondContact O-N 3.48Å; L103-L106 PolarHBondContact O-N 3.44Å; L103-L107 WeakPolarHBondContact O-CB 3.4Å; L103-L107 WeakPolarHBondContact O-CD1 3.35Å; L103-L107 WeakPolarHBondContact O-CG 3.37Å; L103-L107 PolarHBondContact O-N 3.43Å; L103-V116 HydrophobicContact CD2-CB 3.61Å; L103-V116 HydrophobicContact CD2-CG2 3.61Å; L103-L124 HydrophobicContact CD2-CD1 4.22Å; L103-L124 HydrophobicContact CD2-CD2 4.35Å; L103-L124 HydrophobicContact CG-CD1 4.17Å |
| 104 | G | 75.9 | Confident | 72.4 | Confident | 35 Ų | 35 | 66.9 Ų | 66.9 | 36% | 0.361 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -59 | -43.3 | 179.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | K100 D101 S108 | K100-G104 PolarHBondContact O-N 2.94Å; D101-G104 PolarHBondContact O-N 2.93Å; G104-S108 WeakPolarHBondContact O-CB 3.42Å; G104-S108 PolarHBondContact O-N 2.8Å; G104-S108 VanDerWaalsContact O-N 3.13Å; G104-S108 PolarHBondContact O-OG 2.95Å |
| 105 | W | 83.1 | Confident | 74 | Confident | 33 Ų | 33 | 69.6 Ų | 69.6 | 13% | 0.125 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -70.1 | -45.8 | 179.9 | -170.3 | 96.9 | 0 | 0 | 0 | 112.7 | L93 D101 L102 L103 S108 H109 Y128 E131 A132 | L93-W105 HydrophobicContact CD1-CB 3.48Å; L93-W105 VanDerWaalsContact CD1-CB 3.48Å; L93-W105 HydrophobicContact CD1-CD2 4.36Å; L93-W105 HydrophobicContact CD1-CG 3.6Å; L93-W105 HydrophobicContact CG-CB 4.31Å; L93-W105 HydrophobicContact CG-CG 4.36Å; D101-W105 WeakPolarHBondContact O-CB 3.39Å; D101-W105 PolarHBondContact O-N 3.48Å; L102-W105 PolarHBondContact O-N 3.45Å; L103-W105 VanDerWaalsContact C-N 3.32Å; L103-W105 PolarHBondContact O-N 3.48Å; W105-S108 PolarHBondContact O-N 3.45Å; W105-H109 AromaticContact CD1-CE1 3.97Å; W105-H109 AromaticContact CD2-CE1 3.91Å; W105-H109 AromaticContact CD2-ND1 3.61Å; W105-H109 AromaticContact CE2-CE1 3.32Å; W105-H109 AromaticContact CE2-ND1 3.49Å; W105-H109 AromaticContact CE2-NE2 3.75Å; W105-H109 HydrophobicContact CE3-CB 4.38Å; W105-H109 AromaticContact CE3-ND1 3.96Å; W105-H109 HydrophobicContact CH2-CB 4.3Å; W105-H109 AromaticContact CH2-CD2 3.78Å; W105-H109 AromaticContact CH2-CG 3.79Å; W105-H109 AromaticContact CZ2-CD2 3.66Å; W105-H109 AromaticContact CZ2-CE1 3.55Å; W105-H109 AromaticContact CZ2-CG 3.84Å; W105-H109 AromaticContact CZ2-ND1 3.76Å; W105-H109 AromaticContact CZ2-NE2 3.46Å; W105-H109 WeakPolarHBondContact CZ2-NE2 3.42Å; W105-H109 HydrophobicContact CZ3-CB 4.09Å; W105-H109 AromaticContact CZ3-CG 3.95Å; W105-H109 AromaticContact NE1-CE1 3.37Å; W105-H109 PolarHBondContact NE1-CE1 3.26Å; W105-H109 AromaticContact NE1-ND1 3.84Å; W105-H109 PolarHBondContact O-N 2.69Å; W105-H109 PolarHBondContact O-ND1 3.11Å; W105-Y128 AromaticContact CD2-CD2 3.83Å; W105-Y128 HydrophobicContact CD2-CD2 3.83Å; W105-Y128 AromaticContact CD2-CE2 3.86Å; W105-Y128 HydrophobicContact CD2-CE2 3.86Å; W105-Y128 AromaticContact CE2-CE2 3.91Å; W105-Y128 AromaticContact CE3-CD2 3.58Å; W105-Y128 HydrophobicContact CE3-CD2 3.58Å; W105-Y128 HydrophobicContact CE3-CE2 4.07Å; W105-Y128 HydrophobicContact CG-CD2 4.46Å; W105-Y128 HydrophobicContact CG-CE2 4.34Å; W105-Y128 HydrophobicContact CH2-CD2 4.32Å; W105-Y128 HydrophobicContact CH2-CE2 4.41Å; W105-Y128 HydrophobicContact CZ2-CE2 4.2Å; W105-Y128 AromaticContact CZ3-CD2 3.86Å; W105-Y128 HydrophobicContact CZ3-CD2 3.86Å; W105-Y128 HydrophobicContact CZ3-CE2 4.35Å; W105-E131 HydrophobicContact CH2-CB 4.17Å; W105-E131 HydrophobicContact CH2-CG 4.13Å; W105-E131 HydrophobicContact CZ3-CB 3.92Å; W105-E131 HydrophobicContact CZ3-CG 3.98Å; W105-A132 HydrophobicContact CH2-CB 4.25Å |
| 106 | L | 81.6 | Confident | 75.8 | Confident | 0 Ų | 0 | 68 Ų | 68 | 0% | 0 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -62.3 | -44.7 | -179.8 | -72.9 | 167.6 | 0 | 0 | 0 | 111.6 | L102 L103 S108 H109 G110 V111 V116 L124 L127 | L102-L106 WeakPolarHBondContact O-CB 3.42Å; L102-L106 WeakPolarHBondContact O-CD1 3.45Å; L102-L106 VanDerWaalsContact O-CG 3.23Å; L102-L106 WeakPolarHBondContact O-CG 3.44Å; L102-L106 PolarHBondContact O-N 2.99Å; L103-L106 PolarHBondContact O-N 3.44Å; L106-S108 VanDerWaalsContact C-N 3.32Å; L106-S108 PolarHBondContact O-N 3.09Å; L106-H109 CarbonylContact O-C 3.55Å; L106-H109 PolarHBondContact O-N 2.73Å; L106-G110 PolarHBondContact O-N 3.23Å; L106-V111 HydrophobicContact CB-CB 4.09Å; L106-V111 HydrophobicContact CB-CG2 4.17Å; L106-V111 HydrophobicContact CD2-CG2 3.89Å; L106-V111 VanDerWaalsContact O-CB 3.32Å; L106-V111 WeakPolarHBondContact O-CB 3.36Å; L106-V111 WeakPolarHBondContact O-CG2 3.47Å; L106-V111 PolarHBondContact O-N 3.07Å; L106-V116 HydrophobicContact CB-CG1 4.27Å; L106-V116 HydrophobicContact CD1-CG1 3.97Å; L106-L124 HydrophobicContact CD1-CB 4.28Å; L106-L124 HydrophobicContact CD1-CD2 3.99Å; L106-L127 HydrophobicContact CD1-CB 4.38Å; L106-L127 HydrophobicContact CD2-CB 4.07Å |
| 107 | L | 80.1 | Confident | 77.1 | Confident | 71 Ų | 71 | 68 Ų | 68 | 37% | 0.372 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -63.3 | -39.6 | 176.3 | -68.5 | 171.8 | 0 | 0 | 0 | 111.6 | L103 H109 G110 R113 V116 | L103-L107 WeakPolarHBondContact O-CB 3.4Å; L103-L107 WeakPolarHBondContact O-CD1 3.35Å; L103-L107 WeakPolarHBondContact O-CG 3.37Å; L103-L107 PolarHBondContact O-N 3.43Å; L107-H109 PolarHBondContact O-N 3.13Å; L107-G110 PolarHBondContact O-N 3.28Å; L107-R113 HydrophobicContact CD2-CB 3.79Å; L107-R113 HydrophobicContact CD2-CG 4.09Å; L107-V116 HydrophobicContact CD2-CG2 3.83Å; L107-V116 HydrophobicContact CG-CG2 4.25Å |
| 108 | S | 77.4 | Confident | 78 | Confident | 101 Ų | 101 | 78.4 Ų | 78.4 | 71% | 0.706 | 40% | 0.397 | S | S | * | . | H | α-helix | trans | -69.4 | -20.2 | 177.7 | -56.7 | 0 | 0 | 0 | 0 | 113.2 | G104 W105 L106 | G104-S108 WeakPolarHBondContact O-CB 3.42Å; G104-S108 PolarHBondContact O-N 2.8Å; G104-S108 VanDerWaalsContact O-N 3.13Å; G104-S108 PolarHBondContact O-OG 2.95Å; W105-S108 PolarHBondContact O-N 3.45Å; L106-S108 VanDerWaalsContact C-N 3.32Å; L106-S108 PolarHBondContact O-N 3.09Å |
| 109 | H | 75.3 | Confident | 78.6 | Confident | 89 Ų | 89 | 78.6 Ų | 78.6 | 41% | 0.412 | 39% | 0.393 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -100.1 | 15.8 | 176.9 | -74.6 | 71.6 | 0 | 0 | 0 | 113 | W105 L106 L107 | W105-H109 AromaticContact CD1-CE1 3.97Å; W105-H109 AromaticContact CD2-CE1 3.91Å; W105-H109 AromaticContact CD2-ND1 3.61Å; W105-H109 AromaticContact CE2-CE1 3.32Å; W105-H109 AromaticContact CE2-ND1 3.49Å; W105-H109 AromaticContact CE2-NE2 3.75Å; W105-H109 HydrophobicContact CE3-CB 4.38Å; W105-H109 AromaticContact CE3-ND1 3.96Å; W105-H109 HydrophobicContact CH2-CB 4.3Å; W105-H109 AromaticContact CH2-CD2 3.78Å; W105-H109 AromaticContact CH2-CG 3.79Å; W105-H109 AromaticContact CZ2-CD2 3.66Å; W105-H109 AromaticContact CZ2-CE1 3.55Å; W105-H109 AromaticContact CZ2-CG 3.84Å; W105-H109 AromaticContact CZ2-ND1 3.76Å; W105-H109 AromaticContact CZ2-NE2 3.46Å; W105-H109 WeakPolarHBondContact CZ2-NE2 3.42Å; W105-H109 HydrophobicContact CZ3-CB 4.09Å; W105-H109 AromaticContact CZ3-CG 3.95Å; W105-H109 AromaticContact NE1-CE1 3.37Å; W105-H109 PolarHBondContact NE1-CE1 3.26Å; W105-H109 AromaticContact NE1-ND1 3.84Å; W105-H109 PolarHBondContact O-N 2.69Å; W105-H109 PolarHBondContact O-ND1 3.11Å; L106-H109 CarbonylContact O-C 3.55Å; L106-H109 PolarHBondContact O-N 2.73Å; L107-H109 PolarHBondContact O-N 3.13Å |
| 110 | G | 76.4 | Confident | 79 | Confident | 64 Ų | 64 | 76.7 Ų | 76.7 | 66% | 0.66 | 40% | 0.396 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 84.3 | 11.6 | 170.9 | 0 | 0 | 0 | 0 | 0 | 115.1 | L106 L107 | L106-G110 PolarHBondContact O-N 3.23Å; L107-G110 PolarHBondContact O-N 3.28Å |
| 111 | V | 83.2 | Confident | 78.9 | Confident | 16 Ų | 16 | 71.9 Ų | 71.9 | 10% | 0.097 | 38% | 0.381 | C | S | . | . | trans | -72.9 | 125.9 | 171.6 | -175.2 | 0 | 0 | 0 | 0 | 109 | L106 Q115 V116 | L106-V111 HydrophobicContact CB-CB 4.09Å; L106-V111 HydrophobicContact CB-CG2 4.17Å; L106-V111 HydrophobicContact CD2-CG2 3.89Å; L106-V111 VanDerWaalsContact O-CB 3.32Å; L106-V111 WeakPolarHBondContact O-CB 3.36Å; L106-V111 WeakPolarHBondContact O-CG2 3.47Å; L106-V111 PolarHBondContact O-N 3.07Å; V111-Q115 HydrophobicContact CG1-CB 4.28Å; V111-V116 HydrophobicContact CB-CG1 4.47Å; V111-V116 HydrophobicContact CG1-CG1 3.62Å | ||
| 112 | P | 84.4 | Confident | 78.8 | Confident | 57 Ų | 57 | 73.1 Ų | 73.1 | 37% | 0.37 | 38% | 0.383 | S | S | . | . | trans | -60.4 | 142.4 | -177.6 | -23.1 | 32.5 | 0 | 0 | 0 | 112.4 | E114 Q115 | P112-E114 VanDerWaalsContact CB-OE2 3.32Å; P112-E114 WeakPolarHBondContact CB-OE2 3.18Å; P112-E114 PolarHBondContact O-N 3.01Å; P112-Q115 HydrophobicContact CB-CG 4.37Å; P112-Q115 HydrophobicContact CG-CG 4.48Å; P112-Q115 WeakPolarHBondContact O-CB 3.44Å; P112-Q115 PolarHBondContact O-N 2.78Å | ||
| 113 | R | 81.9 | Confident | 79.1 | Confident | 152 Ų | 152 | 75.3 Ų | 75.3 | 57% | 0.574 | 40% | 0.396 | S | S | * | . | H | α-helix | trans | -61.1 | -34.4 | -177.6 | -169.7 | 168.2 | -178.7 | 174.4 | -0.3 | 112 | L107 Q115 V116 D117 | L107-R113 HydrophobicContact CD2-CB 3.79Å; L107-R113 HydrophobicContact CD2-CG 4.09Å; R113-Q115 PolarHBondContact O-N 3.08Å; R113-V116 WeakPolarHBondContact O-CG2 3.38Å; R113-V116 PolarHBondContact O-N 2.83Å; R113-D117 HydrophobicContact CG-CB 4.22Å; R113-D117 IonicContact NE-OD1 3.74Å; R113-D117 VanDerWaalsContact O-CB 3.31Å; R113-D117 WeakPolarHBondContact O-CB 3.45Å; R113-D117 PolarHBondContact O-N 3.13Å |
| 114 | E | 84.1 | Confident | 79.1 | Confident | 157 Ų | 157 | 73.8 Ų | 73.8 | 73% | 0.734 | 39% | 0.388 | S | S | * | . | H | α-helix | trans | -61.9 | -29.8 | 177.8 | -56.2 | 71.4 | -150.4 | 0 | 0 | 112 | P112 V116 | P112-E114 VanDerWaalsContact CB-OE2 3.32Å; P112-E114 WeakPolarHBondContact CB-OE2 3.18Å; P112-E114 PolarHBondContact O-N 3.01Å; E114-V116 VanDerWaalsContact C-N 3.33Å |
| 115 | Q | 78.4 | Confident | 79 | Confident | 101 Ų | 101 | 73.1 Ų | 73.1 | 47% | 0.472 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -79.4 | -14.2 | 177.9 | -69.8 | -174.6 | 15.1 | 0 | 0 | 113.3 | V111 P112 R113 Q119 | V111-Q115 HydrophobicContact CG1-CB 4.28Å; P112-Q115 HydrophobicContact CB-CG 4.37Å; P112-Q115 HydrophobicContact CG-CG 4.48Å; P112-Q115 WeakPolarHBondContact O-CB 3.44Å; P112-Q115 PolarHBondContact O-N 2.78Å; R113-Q115 PolarHBondContact O-N 3.08Å; Q115-Q119 WeakPolarHBondContact O-CG 3.24Å |
| 116 | V | 83.3 | Confident | 78.8 | Confident | 0 Ų | 0 | 76.9 Ų | 76.9 | 0% | 0 | 40% | 0.395 | C | S | . | . | H | α-helix | trans | -122 | -29.1 | -172.1 | -61.3 | 0 | 0 | 0 | 0 | 114.2 | L103 L106 L107 V111 R113 E114 R118 Q119 L124 L127 | L103-V116 HydrophobicContact CD2-CB 3.61Å; L103-V116 HydrophobicContact CD2-CG2 3.61Å; L106-V116 HydrophobicContact CB-CG1 4.27Å; L106-V116 HydrophobicContact CD1-CG1 3.97Å; L107-V116 HydrophobicContact CD2-CG2 3.83Å; L107-V116 HydrophobicContact CG-CG2 4.25Å; V111-V116 HydrophobicContact CB-CG1 4.47Å; V111-V116 HydrophobicContact CG1-CG1 3.62Å; R113-V116 WeakPolarHBondContact O-CG2 3.38Å; R113-V116 PolarHBondContact O-N 2.83Å; E114-V116 VanDerWaalsContact C-N 3.33Å; V116-R118 VanDerWaalsContact C-N 3.31Å; V116-R118 PolarHBondContact O-N 3.31Å; V116-Q119 PolarHBondContact O-N 3.23Å; V116-L124 HydrophobicContact CB-CD2 3.58Å; V116-L124 HydrophobicContact CG1-CD2 3.79Å; V116-L127 HydrophobicContact CG1-CD1 4.49Å |
| 117 | D | 78.1 | Confident | 78.7 | Confident | 80 Ų | 80 | 79 Ų | 79 | 43% | 0.428 | 41% | 0.407 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -66 | -30.4 | -170.2 | -151 | 45.7 | 0 | 0 | 0 | 113.3 | R99 R113 | R99-D117 PolarHBondContact NH2-O 3.07Å; R113-D117 HydrophobicContact CG-CB 4.22Å; R113-D117 IonicContact NE-OD1 3.74Å; R113-D117 VanDerWaalsContact O-CB 3.31Å; R113-D117 WeakPolarHBondContact O-CB 3.45Å; R113-D117 PolarHBondContact O-N 3.13Å |
| 118 | R | 81.7 | Confident | 78.6 | Confident | 230 Ų | 230 | 76.1 Ų | 76.1 | 87% | 0.868 | 39% | 0.391 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -109.7 | 5 | -179.6 | -64.6 | -166.8 | 175.1 | -164.1 | -0.9 | 114.7 | V116 | V116-R118 VanDerWaalsContact C-N 3.31Å; V116-R118 PolarHBondContact O-N 3.31Å |
| 119 | Q | 81.1 | Confident | 78.4 | Confident | 77 Ų | 77 | 73.8 Ų | 73.8 | 36% | 0.36 | 37% | 0.37 | S | S | . | . | S | Bend | trans | -85.5 | 147.1 | -176.2 | -68 | -62.7 | 4.8 | 0 | 0 | 112.9 | Q115 V116 V123 L124 | Q115-Q119 WeakPolarHBondContact O-CG 3.24Å; V116-Q119 PolarHBondContact O-N 3.23Å; Q119-V123 HydrophobicContact CB-CB 4.16Å; Q119-V123 HydrophobicContact CB-CG1 4.08Å; Q119-V123 HydrophobicContact CG-CG1 4.02Å; Q119-L124 HydrophobicContact CB-CD2 4.02Å; Q119-L124 HydrophobicContact CB-CG 4.24Å |
| 120 | P | 78.3 | Confident | 78.5 | Confident | 78 Ų | 78 | 76.8 Ų | 76.8 | 51% | 0.506 | 38% | 0.382 | S | S | . | . | trans | -59.9 | 151.2 | 168.4 | -19.4 | 30.7 | 0 | 0 | 0 | 112.1 | K122 V123 L124 | P120-K122 PolarHBondContact O-N 2.9Å; P120-K122 VanDerWaalsContact O-N 3.17Å; P120-V123 HydrophobicContact CB-CG2 4.37Å; P120-V123 HydrophobicContact CG-CG2 4.21Å; P120-V123 WeakPolarHBondContact O-CB 3.47Å; P120-V123 PolarHBondContact O-N 3.33Å; P120-L124 PolarHBondContact O-N 3.43Å; P120-L124 VanDerWaalsContact O-N 3.13Å | ||
| 121 | T | 69.9 | Low | 78.5 | Confident | 70 Ų | 70 | 76.1 Ų | 76.1 | 43% | 0.429 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -56.1 | -35.6 | -179.5 | -49.3 | 0 | 0 | 0 | 0 | 112.9 | L102 L124 L125 | L102-T121 HydrophobicContact CD1-CG2 4Å; T121-L124 WeakPolarHBondContact O-CB 3.46Å; T121-L124 PolarHBondContact O-N 3.37Å; T121-L125 WeakPolarHBondContact O-CB 3.32Å; T121-L125 PolarHBondContact O-N 3.13Å |
| 122 | K | 72.7 | Confident | 77.8 | Confident | 92 Ų | 92 | 76 Ų | 76 | 40% | 0.4 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -59.1 | -46.8 | 175 | -176.4 | 177.1 | 179.7 | 177.1 | 0 | 112.2 | W16 P120 L124 L125 E126 | W16-K122 HydrophobicContact CH2-CB 4.19Å; W16-K122 HydrophobicContact CH2-CD 4.01Å; W16-K122 HydrophobicContact CH2-CG 3.89Å; W16-K122 HydrophobicContact CZ2-CD 4.33Å; P120-K122 PolarHBondContact O-N 2.9Å; P120-K122 VanDerWaalsContact O-N 3.17Å; K122-L124 VanDerWaalsContact C-N 3.32Å; K122-L124 PolarHBondContact O-N 2.91Å; K122-L125 WeakPolarHBondContact O-CB 3.45Å; K122-L125 PolarHBondContact O-N 2.76Å; K122-E126 PolarHBondContact O-N 2.97Å |
| 123 | V | 77.5 | Confident | 77 | Confident | 47 Ų | 47 | 80 Ų | 80 | 29% | 0.285 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -64.9 | -38.6 | 178.5 | 177.8 | 0 | 0 | 0 | 0 | 110.7 | Q119 P120 L125 E126 L127 | Q119-V123 HydrophobicContact CB-CB 4.16Å; Q119-V123 HydrophobicContact CB-CG1 4.08Å; Q119-V123 HydrophobicContact CG-CG1 4.02Å; P120-V123 HydrophobicContact CB-CG2 4.37Å; P120-V123 HydrophobicContact CG-CG2 4.21Å; P120-V123 WeakPolarHBondContact O-CB 3.47Å; P120-V123 PolarHBondContact O-N 3.33Å; V123-L125 VanDerWaalsContact C-N 3.34Å; V123-L125 PolarHBondContact O-N 3.08Å; V123-E126 PolarHBondContact O-N 3.3Å; V123-L127 HydrophobicContact CG1-CD1 4.3Å; V123-L127 WeakPolarHBondContact O-CG 3.4Å; V123-L127 PolarHBondContact O-N 3.13Å |
| 124 | L | 77.4 | Confident | 76.3 | Confident | 0 Ų | 0 | 80.9 Ų | 80.9 | 0% | 0 | 38% | 0.377 | C | S | . | . | H | α-helix | trans | -63.7 | -39.3 | 174.1 | -62.7 | 177.1 | 0 | 0 | 0 | 112.3 | R99 L102 L103 L106 V116 Q119 P120 T121 K122 L127 Y128 | R99-L124 HydrophobicContact CG-CD1 3.96Å; L102-L124 HydrophobicContact CB-CB 4.34Å; L102-L124 HydrophobicContact CD1-CB 4.12Å; L103-L124 HydrophobicContact CD2-CD1 4.22Å; L103-L124 HydrophobicContact CD2-CD2 4.35Å; L103-L124 HydrophobicContact CG-CD1 4.17Å; L106-L124 HydrophobicContact CD1-CB 4.28Å; L106-L124 HydrophobicContact CD1-CD2 3.99Å; V116-L124 HydrophobicContact CB-CD2 3.58Å; V116-L124 HydrophobicContact CG1-CD2 3.79Å; Q119-L124 HydrophobicContact CB-CD2 4.02Å; Q119-L124 HydrophobicContact CB-CG 4.24Å; P120-L124 PolarHBondContact O-N 3.43Å; P120-L124 VanDerWaalsContact O-N 3.13Å; T121-L124 WeakPolarHBondContact O-CB 3.46Å; T121-L124 PolarHBondContact O-N 3.37Å; K122-L124 VanDerWaalsContact C-N 3.32Å; K122-L124 PolarHBondContact O-N 2.91Å; L124-L127 PolarHBondContact O-N 3.32Å; L124-Y128 WeakPolarHBondContact O-CB 3.25Å; L124-Y128 PolarHBondContact O-N 3.43Å |
| 125 | L | 73.9 | Confident | 75.1 | Confident | 20 Ų | 20 | 76.2 Ų | 76.2 | 11% | 0.105 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -67.9 | -41.7 | 178.1 | -166.5 | 72 | 0 | 0 | 0 | 111.6 | M13 W16 P97 L102 T121 K122 V123 Y128 I129 | M13-L125 HydrophobicContact CE-CD1 4.44Å; M13-L125 HydrophobicContact CE-CD2 3.92Å; W16-L125 HydrophobicContact CZ3-CD2 4.36Å; P97-L125 HydrophobicContact CG-CD1 4Å; L102-L125 HydrophobicContact CD1-CB 4.44Å; L102-L125 HydrophobicContact CD1-CD1 4.24Å; L102-L125 HydrophobicContact CD2-CD1 3.96Å; T121-L125 WeakPolarHBondContact O-CB 3.32Å; T121-L125 PolarHBondContact O-N 3.13Å; K122-L125 WeakPolarHBondContact O-CB 3.45Å; K122-L125 PolarHBondContact O-N 2.76Å; V123-L125 VanDerWaalsContact C-N 3.34Å; V123-L125 PolarHBondContact O-N 3.08Å; L125-Y128 HydrophobicContact CD1-CD1 4.46Å; L125-Y128 WeakPolarHBondContact O-CB 3.26Å; L125-Y128 PolarHBondContact O-N 3.39Å; L125-I129 HydrophobicContact CG-CD1 4.34Å; L125-I129 VanDerWaalsContact O-CG1 3.31Å; L125-I129 WeakPolarHBondContact O-CG1 3.41Å; L125-I129 PolarHBondContact O-N 3.07Å |
| 126 | E | 78.4 | Confident | 74 | Confident | 113 Ų | 113 | 78.4 Ų | 78.4 | 53% | 0.528 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -62.3 | -43.7 | 174.5 | -74.3 | 178.3 | -167.4 | 0 | 0 | 112 | K122 V123 Y128 I129 K130 | K122-E126 PolarHBondContact O-N 2.97Å; V123-E126 PolarHBondContact O-N 3.3Å; E126-Y128 VanDerWaalsContact C-N 3.34Å; E126-Y128 PolarHBondContact O-N 3.16Å; E126-I129 PolarHBondContact O-N 3.43Å; E126-K130 WeakPolarHBondContact O-CB 3.28Å; E126-K130 PolarHBondContact O-N 2.96Å |
| 127 | L | 79.1 | Confident | 72.3 | Confident | 45 Ų | 45 | 81.1 Ų | 81.1 | 24% | 0.236 | 39% | 0.394 | C | S | . | . | H | α-helix | trans | -61.1 | -42.8 | 173.9 | -74.3 | 170.5 | 0 | 0 | 0 | 111.5 | L106 V116 V123 L124 K130 E131 | L106-L127 HydrophobicContact CD1-CB 4.38Å; L106-L127 HydrophobicContact CD2-CB 4.07Å; V116-L127 HydrophobicContact CG1-CD1 4.49Å; V123-L127 HydrophobicContact CG1-CD1 4.3Å; V123-L127 WeakPolarHBondContact O-CG 3.4Å; V123-L127 PolarHBondContact O-N 3.13Å; L124-L127 PolarHBondContact O-N 3.32Å; L127-K130 PolarHBondContact O-N 2.8Å; L127-E131 WeakPolarHBondContact O-CB 3.43Å; L127-E131 PolarHBondContact O-N 2.65Å |
| 128 | Y | 77.3 | Confident | 70.4 | Confident | 9 Ų | 9 | 84.1 Ų | 84.1 | 4% | 0.035 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -59.2 | -47.8 | 175.3 | 166.5 | -106.9 | 0 | 0 | 0 | 111.9 | L91 M92 L93 L102 W105 L124 L125 E126 K130 E131 A132 | L91-Y128 HydrophobicContact CD2-CE1 4.25Å; M92-Y128 PolarHBondContact N-OH 3.47Å; L93-Y128 HydrophobicContact CD1-CD2 3.92Å; L93-Y128 HydrophobicContact CD1-CE2 3.56Å; L102-Y128 HydrophobicContact CD2-CD1 4.25Å; L102-Y128 HydrophobicContact CD2-CG 3.98Å; W105-Y128 AromaticContact CD2-CD2 3.83Å; W105-Y128 HydrophobicContact CD2-CD2 3.83Å; W105-Y128 AromaticContact CD2-CE2 3.86Å; W105-Y128 HydrophobicContact CD2-CE2 3.86Å; W105-Y128 AromaticContact CE2-CE2 3.91Å; W105-Y128 AromaticContact CE3-CD2 3.58Å; W105-Y128 HydrophobicContact CE3-CD2 3.58Å; W105-Y128 HydrophobicContact CE3-CE2 4.07Å; W105-Y128 HydrophobicContact CG-CD2 4.46Å; W105-Y128 HydrophobicContact CG-CE2 4.34Å; W105-Y128 HydrophobicContact CH2-CD2 4.32Å; W105-Y128 HydrophobicContact CH2-CE2 4.41Å; W105-Y128 HydrophobicContact CZ2-CE2 4.2Å; W105-Y128 AromaticContact CZ3-CD2 3.86Å; W105-Y128 HydrophobicContact CZ3-CD2 3.86Å; W105-Y128 HydrophobicContact CZ3-CE2 4.35Å; L124-Y128 WeakPolarHBondContact O-CB 3.25Å; L124-Y128 PolarHBondContact O-N 3.43Å; L125-Y128 HydrophobicContact CD1-CD1 4.46Å; L125-Y128 WeakPolarHBondContact O-CB 3.26Å; L125-Y128 PolarHBondContact O-N 3.39Å; E126-Y128 VanDerWaalsContact C-N 3.34Å; E126-Y128 PolarHBondContact O-N 3.16Å; Y128-K130 VanDerWaalsContact C-N 3.33Å; Y128-K130 PolarHBondContact O-N 3.18Å; Y128-E131 PolarHBondContact O-N 3.48Å; Y128-A132 HydrophobicContact CE2-CB 4.35Å; Y128-A132 WeakPolarHBondContact O-CB 3.4Å; Y128-A132 PolarHBondContact O-N 3.46Å |
| 129 | I | 73.7 | Confident | 68.3 | Low | 52 Ų | 52 | 77.6 Ų | 77.6 | 27% | 0.267 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -62.7 | -42.3 | 178.8 | -67.7 | 164.7 | 0 | 0 | 0 | 110.7 | I17 L125 E126 K133 | I17-I129 HydrophobicContact CD1-CD1 4.36Å; L125-I129 HydrophobicContact CG-CD1 4.34Å; L125-I129 VanDerWaalsContact O-CG1 3.31Å; L125-I129 WeakPolarHBondContact O-CG1 3.41Å; L125-I129 PolarHBondContact O-N 3.07Å; E126-I129 PolarHBondContact O-N 3.43Å; I129-K133 HydrophobicContact CG2-CD 4.15Å; I129-K133 WeakPolarHBondContact O-CB 3.38Å; I129-K133 VanDerWaalsContact O-CG 3.25Å; I129-K133 WeakPolarHBondContact O-CG 3.37Å; I129-K133 PolarHBondContact O-N 3.15Å; I129-K133 VanDerWaalsContact O-N 3.1Å |
| 130 | K | 78.2 | Confident | 66.3 | Low | 152 Ų | 152 | 80.4 Ų | 80.4 | 66% | 0.661 | 41% | 0.41 | S | S | * | . | H | α-helix | trans | -64 | -47.2 | 179 | -175.1 | 178.1 | 179.1 | 179.2 | 0 | 111.5 | E126 L127 Y128 K133 R134 | E126-K130 WeakPolarHBondContact O-CB 3.28Å; E126-K130 PolarHBondContact O-N 2.96Å; L127-K130 PolarHBondContact O-N 2.8Å; Y128-K130 VanDerWaalsContact C-N 3.33Å; Y128-K130 PolarHBondContact O-N 3.18Å; K130-K133 PolarHBondContact O-N 3.05Å; K130-R134 PolarHBondContact O-N 2.79Å |
| 131 | E | 76.3 | Confident | 64.2 | Low | 50 Ų | 50 | 87.2 Ų | 87.2 | 23% | 0.234 | 43% | 0.427 | C | S | . | . | H | α-helix | trans | -72.6 | -37.7 | -177.9 | -163.1 | 57 | -135.7 | 0 | 0 | 111.8 | W105 L127 Y128 K133 R134 S135 | W105-E131 HydrophobicContact CH2-CB 4.17Å; W105-E131 HydrophobicContact CH2-CG 4.13Å; W105-E131 HydrophobicContact CZ3-CB 3.92Å; W105-E131 HydrophobicContact CZ3-CG 3.98Å; L127-E131 WeakPolarHBondContact O-CB 3.43Å; L127-E131 PolarHBondContact O-N 2.65Å; Y128-E131 PolarHBondContact O-N 3.48Å; E131-K133 VanDerWaalsContact C-N 3.26Å; E131-K133 PolarHBondContact O-N 3.48Å; E131-R134 WeakPolarHBondContact O-CB 3.26Å; E131-R134 PolarHBondContact O-N 2.98Å; E131-S135 WeakPolarHBondContact O-CB 3.28Å; E131-S135 PolarHBondContact O-N 3.32Å; E131-S135 PolarHBondContact O-OG 3.03Å |
| 132 | A | 67.4 | Low | 62.7 | Low | 14 Ų | 14 | 86.7 Ų | 86.7 | 12% | 0.116 | 44% | 0.436 | C | S | . | . | H | α-helix | trans | -66.2 | -26.5 | 174 | 0 | 0 | 0 | 0 | 0 | 113.3 | W105 Y128 S135 R136 | W105-A132 HydrophobicContact CH2-CB 4.25Å; Y128-A132 HydrophobicContact CE2-CB 4.35Å; Y128-A132 WeakPolarHBondContact O-CB 3.4Å; Y128-A132 PolarHBondContact O-N 3.46Å; A132-S135 WeakPolarHBondContact CA-OG 3.35Å; A132-S135 PolarHBondContact O-OG 3.24Å; A132-S135 VanDerWaalsContact O-OG 3.13Å; A132-R136 WeakPolarHBondContact O-CD 3.35Å; A132-R136 VanDerWaalsContact O-CG 3.3Å; A132-R136 WeakPolarHBondContact O-CG 3.18Å |
| 133 | K | 68.1 | Low | 61 | Low | 141 Ų | 141 | 89.4 Ų | 89.4 | 61% | 0.613 | 45% | 0.454 | S | S | * | . | H | α-helix | trans | -77.5 | -39.4 | 170.5 | -74.8 | 173.5 | 179.8 | 179.2 | 0 | 111.6 | I129 K130 E131 R136 G137 | I129-K133 HydrophobicContact CG2-CD 4.15Å; I129-K133 WeakPolarHBondContact O-CB 3.38Å; I129-K133 VanDerWaalsContact O-CG 3.25Å; I129-K133 WeakPolarHBondContact O-CG 3.37Å; I129-K133 PolarHBondContact O-N 3.15Å; I129-K133 VanDerWaalsContact O-N 3.1Å; K130-K133 PolarHBondContact O-N 3.05Å; E131-K133 VanDerWaalsContact C-N 3.26Å; E131-K133 PolarHBondContact O-N 3.48Å; K133-R136 PolarHBondContact O-N 3.25Å; K133-G137 PolarHBondContact O-N 2.81Å |
| 134 | R | 67.9 | Low | 59 | Low | 170 Ų | 170 | 94.1 Ų | 94.1 | 64% | 0.642 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -63.1 | -43.6 | 176.5 | -175.4 | -178.7 | 179.7 | 128.7 | 3 | 112 | K130 E131 R136 G137 | K130-R134 PolarHBondContact O-N 2.79Å; E131-R134 WeakPolarHBondContact O-CB 3.26Å; E131-R134 PolarHBondContact O-N 2.98Å; R134-R136 PolarHBondContact O-N 2.91Å; R134-G137 PolarHBondContact O-N 2.89Å |
| 135 | S | 57.5 | Low | 57.2 | Low | 60 Ų | 60 | 102.6 Ų | 102.6 | 42% | 0.42 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -65 | -25.1 | 178.1 | 63.8 | 0 | 0 | 0 | 0 | 113.3 | E131 A132 | E131-S135 WeakPolarHBondContact O-CB 3.28Å; E131-S135 PolarHBondContact O-N 3.32Å; E131-S135 PolarHBondContact O-OG 3.03Å; A132-S135 WeakPolarHBondContact CA-OG 3.35Å; A132-S135 PolarHBondContact O-OG 3.24Å; A132-S135 VanDerWaalsContact O-OG 3.13Å |
| 136 | R | 56.8 | Low | 55.7 | Low | 146 Ų | 146 | 109.4 Ų | 109.4 | 55% | 0.551 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -80.6 | -17.1 | 171.9 | -68.2 | 174.2 | -175 | -176.5 | 2.2 | 113.9 | A132 K133 R134 H138 | A132-R136 WeakPolarHBondContact O-CD 3.35Å; A132-R136 VanDerWaalsContact O-CG 3.3Å; A132-R136 WeakPolarHBondContact O-CG 3.18Å; K133-R136 PolarHBondContact O-N 3.25Å; R134-R136 PolarHBondContact O-N 2.91Å; R136-H138 VanDerWaalsContact C-N 3.35Å |
| 137 | G | 46.2 | Very low | 54 | Low | 57 Ų | 57 | 112.4 Ų | 112.4 | 59% | 0.588 | 56% | 0.562 | S | S | * | * | S | Bend | trans | -82.6 | -8.3 | 179.4 | 0 | 0 | 0 | 0 | 0 | 114.4 | K133 R134 P139 | K133-G137 PolarHBondContact O-N 2.81Å; R134-G137 PolarHBondContact O-N 2.89Å; G137-P139 WeakPolarHBondContact O-CD 3.4Å |
| 138 | H | 38.3 | Very low | 52.7 | Low | 144 Ų | 144 | 114.9 Ų | 114.9 | 67% | 0.667 | 58% | 0.581 | S | S | * | * | trans | -90.2 | 106.2 | 168.5 | -89.8 | -63.6 | 0 | 0 | 0 | 109.4 | R136 N140 | R136-H138 VanDerWaalsContact C-N 3.35Å; H138-N140 PolarHBondContact O-N 3.35Å; H138-N140 VanDerWaalsContact O-N 3.14Å | ||
| 139 | P | 39.2 | Very low | 51.8 | Low | 93 Ų | 93 | 119.7 Ų | 119.7 | 60% | 0.604 | 61% | 0.614 | S | S | * | * | trans | -57.5 | 121.8 | 150.8 | 25.9 | -29.2 | 0 | 0 | 0 | 105.9 | G137 Y141 | G137-P139 WeakPolarHBondContact O-CD 3.4Å; P139-Y141 HydrophobicContact CB-CD2 4.26Å; P139-Y141 HydrophobicContact CB-CE2 4.46Å; P139-Y141 HydrophobicContact CG-CD2 4.39Å; P139-Y141 PolarHBondContact O-N 3.05Å | ||
| 140 | N | 39.1 | Very low | 50.9 | Low | 136 Ų | 136 | 122.6 Ų | 122.6 | 73% | 0.727 | 64% | 0.635 | S | S | * | * | trans | -63.3 | 82.2 | 175.5 | -169.6 | 15.5 | 0 | 0 | 0 | 109.1 | H138 G142 | H138-N140 PolarHBondContact O-N 3.35Å; H138-N140 VanDerWaalsContact O-N 3.14Å; N140-G142 PolarHBondContact O-N 3.43Å | ||
| 141 | Y | 33.6 | Very low | 49.7 | Very low | 221 Ų | 221 | 120.9 Ų | 120.9 | 87% | 0.867 | 64% | 0.64 | S | S | * | * | trans | -88.9 | 93.5 | 160.9 | -88.2 | -83.9 | 0 | 0 | 0 | 107.1 | P139 | P139-Y141 HydrophobicContact CB-CD2 4.26Å; P139-Y141 HydrophobicContact CB-CE2 4.46Å; P139-Y141 HydrophobicContact CG-CD2 4.39Å; P139-Y141 PolarHBondContact O-N 3.05Å | ||
| 142 | G | 38.3 | Very low | 48.5 | Very low | 59 Ų | 59 | 123.9 Ų | 123.9 | 61% | 0.608 | 66% | 0.664 | S | S | * | * | trans | 177.3 | 36.4 | -178.4 | 0 | 0 | 0 | 0 | 0 | 114.5 | N140 | N140-G142 PolarHBondContact O-N 3.43Š| ||
| 143 | L | 36.4 | Very low | 47.8 | Very low | 149 Ų | 149 | 133.4 Ų | 133.4 | 78% | 0.78 | 70% | 0.698 | S | S | * | * | trans | -124.3 | 83.6 | 161.4 | -101.3 | 158.7 | 0 | 0 | 0 | 107.5 | E145 | L143-E145 PolarHBondContact O-N 3.35Š| ||
| 144 | N | 37 | Very low | 47.1 | Very low | 145 Ų | 145 | 131.6 Ų | 131.6 | 78% | 0.775 | 70% | 0.704 | S | S | * | * | trans | -86.8 | 87.5 | 160.7 | -164.9 | 56.1 | 0 | 0 | 0 | 107.2 | ||||
| 145 | E | 39.2 | Very low | 46.7 | Very low | 179 Ų | 179 | 130.5 Ų | 130.5 | 84% | 0.836 | 71% | 0.711 | S | S | * | * | trans | -122.6 | 93.6 | 142.9 | -85 | -169.4 | 113.3 | 0 | 0 | 106.7 | L143 Q147 | L143-E145 PolarHBondContact O-N 3.35Å; E145-Q147 PolarHBondContact O-N 2.97Å | ||
| 146 | E | 41.3 | Very low | 46.2 | Very low | 162 Ų | 162 | 136.5 Ų | 136.5 | 76% | 0.757 | 73% | 0.732 | S | S | * | * | trans | -15.7 | 94.3 | 158.4 | -149.8 | 174.8 | 109.4 | 0 | 0 | 114.2 | ||||
| 147 | Q | 44.1 | Very low | 45.7 | Very low | 176 Ų | 176 | 134 Ų | 134 | 82% | 0.822 | 74% | 0.742 | S | S | * | * | P | Polyproline II helix | trans | -73.7 | 123.3 | 153.7 | -173.7 | 177.5 | -28 | 0 | 0 | 106.3 | E145 | E145-Q147 PolarHBondContact O-N 2.97Š|
| 148 | P | 51.1 | Low | 45.3 | Very low | 97 Ų | 97 | 137.9 Ų | 137.9 | 63% | 0.63 | 76% | 0.759 | S | S | * | * | P | Polyproline II helix | trans | -60.2 | 141.9 | -178.6 | 23.5 | -31 | 0 | 0 | 0 | 109.2 | ||
| 149 | P | 58 | Low | 45.3 | Very low | 111 Ų | 111 | 134.6 Ų | 134.6 | 72% | 0.721 | 76% | 0.764 | S | S | * | * | P | Polyproline II helix | trans | -57.2 | 141 | 178.8 | 23.8 | -32.3 | 0 | 0 | 0 | 109.2 | ||
| 150 | P | 54.6 | Low | 45.5 | Very low | 112 Ų | 112 | 138.4 Ų | 138.4 | 73% | 0.727 | 77% | 0.774 | S | S | * | * | P | Polyproline II helix | trans | -54.6 | 140.5 | 172.9 | 24.1 | -32.1 | 0 | 0 | 0 | 108.8 | ||
| 151 | P | 53.6 | Low | 45.7 | Very low | 116 Ų | 116 | 139 Ų | 139 | 75% | 0.753 | 77% | 0.772 | S | S | * | * | P | Polyproline II helix | trans | -56 | 142.4 | -178.8 | 23.5 | -32.5 | 0 | 0 | 0 | 109.6 | Y153 | P151-Y153 PolarHBondContact O-N 2.75Š|
| 152 | P | 50.6 | Low | 46.4 | Very low | 114 Ų | 114 | 135.6 Ų | 135.6 | 74% | 0.74 | 76% | 0.764 | S | S | * | * | P | Polyproline II helix | trans | -60.2 | 128.1 | 178.2 | 26.4 | -31.7 | 0 | 0 | 0 | 107.7 | S154 | P152-S154 PolarHBondContact O-N 2.95Š|
| 153 | Y | 52.8 | Low | 46.8 | Very low | 213 Ų | 213 | 139 Ų | 139 | 84% | 0.835 | 78% | 0.775 | S | S | * | * | trans | -55.5 | 105.6 | 176.8 | -160.3 | -94 | 0 | 0 | 0 | 108 | P151 D155 | P151-Y153 PolarHBondContact O-N 2.75Å; Y153-D155 PolarHBondContact O-N 2.72Å; Y153-D155 VanDerWaalsContact O-N 3.12Å | ||
| 154 | S | 53.9 | Low | 47.3 | Very low | 104 Ų | 104 | 138.1 Ų | 138.1 | 73% | 0.727 | 78% | 0.776 | S | S | * | * | trans | -72.8 | 102.7 | 172.7 | -77.3 | 0 | 0 | 0 | 0 | 108.2 | P152 Q156 | P152-S154 PolarHBondContact O-N 2.95Å; S154-Q156 PolarHBondContact O-N 3.38Å | ||
| 155 | D | 58.9 | Low | 47.6 | Very low | 147 Ų | 147 | 142.5 Ų | 142.5 | 79% | 0.786 | 78% | 0.782 | S | S | * | * | trans | -55.8 | 101.2 | 154.8 | -104.3 | -67.9 | 0 | 0 | 0 | 108.9 | Y153 | Y153-D155 PolarHBondContact O-N 2.72Å; Y153-D155 VanDerWaalsContact O-N 3.12Å | ||
| 156 | Q | 46.4 | Very low | 47.8 | Very low | 186 Ų | 186 | 143 Ų | 143 | 87% | 0.869 | 78% | 0.784 | S | S | * | * | trans | -129.7 | 104.4 | 154.3 | -90.3 | -176.2 | -9.5 | 0 | 0 | 109.4 | S154 | S154-Q156 PolarHBondContact O-N 3.38Š| ||
| 157 | A | 46.8 | Very low | 48.2 | Very low | 93 Ų | 93 | 146.3 Ų | 146.3 | 77% | 0.769 | 81% | 0.807 | S | S | * | * | trans | -52.2 | 131.7 | 164.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 158 | C | 37.6 | Very low | 48.4 | Very low | 138 Ų | 138 | 144.9 Ų | 144.9 | 93% | 0.932 | 81% | 0.806 | S | S | * | * | trans | 175.6 | 123.4 | 146.7 | -101.2 | 0 | 0 | 0 | 0 | 106.8 | ||||
| 159 | G | 38 | Very low | 48.2 | Very low | 75 Ų | 75 | 147.4 Ų | 147.4 | 77% | 0.773 | 82% | 0.815 | S | S | * | * | cis | -166.9 | 166.5 | 4.4 | 0 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 160 | E | 44.9 | Very low | 47.7 | Very low | 174 Ų | 174 | 149.4 Ų | 149.4 | 81% | 0.813 | 82% | 0.82 | S | S | * | * | trans | -55.7 | 151.8 | 178.2 | -94.7 | 159.7 | 104.5 | 0 | 0 | 115.6 | ||||
| 161 | E | 43.4 | Very low | 47.3 | Very low | 149 Ų | 149 | 151.6 Ų | 151.6 | 70% | 0.696 | 83% | 0.826 | S | S | * | * | trans | 96.5 | 119.9 | 135.6 | -78.2 | -173 | 109.4 | 0 | 0 | 124.6 | ||||
| 162 | Q | 47 | Very low | 46.9 | Very low | 149 Ų | 149 | 153.8 Ų | 153.8 | 70% | 0.696 | 83% | 0.83 | S | S | * | * | trans | 81.1 | 133.7 | 138.2 | -67.3 | -175.8 | 21 | 0 | 0 | 122.6 | ||||
| 163 | P | 46.9 | Very low | 46.7 | Very low | 129 Ų | 129 | 156.5 Ų | 156.5 | 84% | 0.838 | 84% | 0.836 | S | S | * | * | P | Polyproline II helix | trans | -89.6 | 116.5 | 163.6 | 33.8 | -24.9 | 0 | 0 | 0 | 110.3 | ||
| 164 | V | 46.6 | Very low | 46.2 | Very low | 132 Ų | 132 | 152.4 Ų | 152.4 | 80% | 0.8 | 84% | 0.836 | S | S | * | * | P | Polyproline II helix | trans | -87.3 | 126.8 | 169 | -179.5 | 0 | 0 | 0 | 0 | 109.3 | ||
| 165 | R | 44.4 | Very low | 45.6 | Very low | 237 Ų | 237 | 156.2 Ų | 156.2 | 89% | 0.894 | 85% | 0.845 | S | S | * | * | P | Polyproline II helix | trans | -60.9 | 141.8 | 173.3 | -76.1 | -173.6 | 169.7 | -179 | -2.7 | 111.4 | ||
| 166 | H | 42.5 | Very low | 44.5 | Very low | 189 Ų | 189 | 156.9 Ų | 156.9 | 88% | 0.875 | 85% | 0.85 | S | S | * | * | trans | -98 | 114.6 | 159.2 | -96.9 | -84.1 | 0 | 0 | 0 | 109.4 | ||||
| 167 | D | 49.7 | Very low | 44.3 | Very low | 232 Ų | 232 | 154.3 Ų | 154.3 | 100% | 1.241 | 85% | 0.848 | S | S | * | * | trans | -141.6 | 0 | 131.1 | -152.5 | -99.5 | 0 | 0 | 0 | 107.3 |
Retrieved 167 of 167 residues in 166.3 ms
(Link to these results)