| 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 | 81.3 | Confident | 93.6 | Very high | 111 Ų | 111 | 46.9 Ų | 46.9 | 55% | 0.547 | 26% | 0.261 | S | S | . | . | 0 | -61.1 | 0 | -170.3 | -178.1 | 67.5 | 0 | 0 | 112.9 | F3 G4 L5 L173 N177 | M1-F3 VanDerWaalsContact C-N 3.26Å; M1-F3 PolarHBondContact O-N 3.5Å; M1-G4 CarbonylContact O-C 3.58Å; M1-G4 WeakPolarHBondContact O-CA 3.34Å; M1-G4 PolarHBondContact O-N 3.32Å; M1-L5 PolarHBondContact O-N 2.84Å; M1-L173 HydrophobicContact CB-CD1 4.21Å; M1-L173 HydrophobicContact CE-CD1 3.86Å; M1-L173 HydrophobicContact CE-CD2 3.81Å; M1-L173 HydrophobicContact CE-CG 3.52Å; M1-L173 HydrophobicContact SD-CD1 3.63Å; M1-L173 HydrophobicContact SD-CD2 3.74Å; M1-L173 HydrophobicContact SD-CG 3.8Å; M1-N177 WeakPolarHBondContact CE-ND2 3.42Å; M1-N177 WeakPolarHBondContact CE-OD1 3.31Å | |||
| 2 | I | 90.2 | Very high | 93.9 | Very high | 14 Ų | 14 | 48.5 Ų | 48.5 | 7% | 0.072 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -57.7 | -39 | -179.2 | -55.6 | -160.7 | 0 | 0 | 0 | 112.6 | G4 L5 Q6 L51 I52 L55 | I2-G4 VanDerWaalsContact C-N 3.29Å; I2-G4 PolarHBondContact O-N 3.34Å; I2-L5 WeakPolarHBondContact O-CB 3.4Å; I2-L5 PolarHBondContact O-N 3.25Å; I2-L5 VanDerWaalsContact O-N 3.12Å; I2-Q6 PolarHBondContact O-N 3.15Å; I2-L51 HydrophobicContact CD1-CB 4.45Å; I2-L51 HydrophobicContact CD1-CD2 3.21Å; I2-L51 HydrophobicContact CD1-CG 3.56Å; I2-I52 HydrophobicContact CB-CG1 4.43Å; I2-I52 HydrophobicContact CG2-CD1 4.32Å; I2-I52 HydrophobicContact CG2-CG1 3.71Å; I2-L55 HydrophobicContact CD1-CD1 3.69Å; I2-L55 HydrophobicContact CG1-CD1 4.34Å |
| 3 | F | 93.6 | Very high | 94 | Very high | 57 Ų | 57 | 46.5 Ų | 46.5 | 25% | 0.25 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -57.6 | -41.1 | 171.5 | -166.9 | -94 | 0 | 0 | 0 | 112.8 | M1 Q6 L7 I52 P127 I130 I131 | M1-F3 VanDerWaalsContact C-N 3.26Å; M1-F3 PolarHBondContact O-N 3.5Å; F3-Q6 WeakPolarHBondContact O-CB 3.42Å; F3-Q6 PolarHBondContact O-N 3.06Å; F3-Q6 VanDerWaalsContact O-N 3.16Å; F3-L7 HydrophobicContact CD1-CD1 3.93Å; F3-L7 HydrophobicContact CD1-CG 4.23Å; F3-L7 HydrophobicContact CE1-CD1 3.78Å; F3-L7 HydrophobicContact CE1-CD2 4.17Å; F3-L7 HydrophobicContact CE1-CG 3.99Å; F3-L7 WeakPolarHBondContact O-CG 3.47Å; F3-L7 PolarHBondContact O-N 3.09Å; F3-I52 HydrophobicContact CD2-CD1 4.13Å; F3-P127 HydrophobicContact CZ-CB 4.06Å; F3-P127 WeakPolarHBondContact CZ-O 3.27Å; F3-I130 HydrophobicContact CE2-CB 4.29Å; F3-I130 HydrophobicContact CE2-CD1 4.37Å; F3-I130 HydrophobicContact CE2-CG2 3.78Å; F3-I130 HydrophobicContact CZ-CB 3.9Å; F3-I130 HydrophobicContact CZ-CG2 3.74Å; F3-I131 HydrophobicContact CD1-CG1 4.35Å; F3-I131 HydrophobicContact CE1-CD1 4.22Å; F3-I131 HydrophobicContact CE1-CG1 3.58Å; F3-I131 HydrophobicContact CZ-CG1 4.42Å |
| 4 | G | 94.1 | Very high | 94.1 | Very high | 37 Ų | 37 | 46.5 Ų | 46.5 | 38% | 0.381 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -65.3 | -37.9 | 173.9 | 0 | 0 | 0 | 0 | 0 | 113.1 | M1 I2 Q6 L7 L8 | M1-G4 CarbonylContact O-C 3.58Å; M1-G4 WeakPolarHBondContact O-CA 3.34Å; M1-G4 PolarHBondContact O-N 3.32Å; I2-G4 VanDerWaalsContact C-N 3.29Å; I2-G4 PolarHBondContact O-N 3.34Å; G4-Q6 VanDerWaalsContact C-N 3.27Å; G4-Q6 PolarHBondContact O-N 3.37Å; G4-L7 PolarHBondContact O-N 3.27Å; G4-L8 WeakPolarHBondContact O-CB 3.5Å; G4-L8 PolarHBondContact O-N 3.41Å |
| 5 | L | 93.7 | Very high | 94.2 | Very high | 47 Ų | 47 | 53.4 Ų | 53.4 | 25% | 0.246 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -61 | -37.2 | 171 | -81.6 | 166.8 | 0 | 0 | 0 | 111.6 | M1 I2 S9 | M1-L5 PolarHBondContact O-N 2.84Å; I2-L5 WeakPolarHBondContact O-CB 3.4Å; I2-L5 PolarHBondContact O-N 3.25Å; I2-L5 VanDerWaalsContact O-N 3.12Å; L5-S9 VanDerWaalsContact O-CB 3.3Å; L5-S9 WeakPolarHBondContact O-CB 3.35Å; L5-S9 PolarHBondContact O-N 3.39Å; L5-S9 PolarHBondContact O-OG 3.15Å |
| 6 | Q | 95.4 | Very high | 94.2 | Very high | 21 Ų | 21 | 56.9 Ų | 56.9 | 10% | 0.098 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -68.4 | -41.7 | 176 | -71.9 | -54.3 | -35.4 | 0 | 0 | 113 | I2 F3 G4 S9 G10 I44 H45 A49 I52 | I2-Q6 PolarHBondContact O-N 3.15Å; F3-Q6 WeakPolarHBondContact O-CB 3.42Å; F3-Q6 PolarHBondContact O-N 3.06Å; F3-Q6 VanDerWaalsContact O-N 3.16Å; G4-Q6 VanDerWaalsContact C-N 3.27Å; G4-Q6 PolarHBondContact O-N 3.37Å; Q6-S9 WeakPolarHBondContact CA-OG 3.42Å; Q6-S9 PolarHBondContact O-OG 3.46Å; Q6-G10 WeakPolarHBondContact O-CA 3.26Å; Q6-G10 PolarHBondContact O-N 2.83Å; Q6-I44 PolarHBondContact NE2-O 2.91Å; Q6-H45 PolarHBondContact NE2-O 2.95Å; Q6-H45 PolarHBondContact O-CE1 3.45Å; Q6-H45 PolarHBondContact O-ND1 3.26Å; Q6-H45 PolarHBondContact OE1-CE1 3.01Å; Q6-H45 VanDerWaalsContact OE1-CE1 3.22Å; Q6-H45 PolarHBondContact OE1-ND1 3.34Å; Q6-H45 PolarHBondContact OE1-O 3.31Å; Q6-H45 VanDerWaalsContact OE1-O 3.04Å; Q6-A49 VanDerWaalsContact NE2-N 3.15Å; Q6-I52 HydrophobicContact CB-CD1 4.19Å; Q6-I52 HydrophobicContact CG-CD1 3.46Å; Q6-I52 VanDerWaalsContact CG-CD1 3.46Å; Q6-I52 HydrophobicContact CG-CG1 4.49Å |
| 7 | L | 96.4 | Very high | 94.1 | Very high | 45 Ų | 45 | 56.3 Ų | 56.3 | 24% | 0.236 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -60.8 | -47.1 | 173.6 | -67.1 | 170.5 | 0 | 0 | 0 | 111.3 | F3 G4 L11 P127 I131 | F3-L7 HydrophobicContact CD1-CD1 3.93Å; F3-L7 HydrophobicContact CD1-CG 4.23Å; F3-L7 HydrophobicContact CE1-CD1 3.78Å; F3-L7 HydrophobicContact CE1-CD2 4.17Å; F3-L7 HydrophobicContact CE1-CG 3.99Å; F3-L7 WeakPolarHBondContact O-CG 3.47Å; F3-L7 PolarHBondContact O-N 3.09Å; G4-L7 PolarHBondContact O-N 3.27Å; L7-L11 VanDerWaalsContact O-CB 3.24Å; L7-L11 WeakPolarHBondContact O-CB 3.44Å; L7-L11 PolarHBondContact O-N 2.92Å; L7-P127 HydrophobicContact CD2-CB 3.56Å; L7-I131 HydrophobicContact CD1-CD1 3.64Å; L7-I131 HydrophobicContact CD1-CG1 4.42Å |
| 8 | L | 96.6 | Very high | 94 | Very high | 97 Ų | 97 | 55.7 Ų | 55.7 | 51% | 0.508 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -66.7 | -49.9 | -178 | -177.7 | 63.4 | 0 | 0 | 0 | 111.8 | G4 G10 L11 L12 | G4-L8 WeakPolarHBondContact O-CB 3.5Å; G4-L8 PolarHBondContact O-N 3.41Å; L8-G10 VanDerWaalsContact C-N 3.35Å; L8-G10 PolarHBondContact O-N 3.4Å; L8-L11 PolarHBondContact O-N 2.96Å; L8-L12 HydrophobicContact CD1-CD1 4.31Å; L8-L12 HydrophobicContact CG-CD1 4.24Å; L8-L12 VanDerWaalsContact O-CG 3.31Å; L8-L12 WeakPolarHBondContact O-CG 3.38Å; L8-L12 PolarHBondContact O-N 3.19Å |
| 9 | S | 96.5 | Very high | 93.6 | Very high | 7 Ų | 7 | 53.8 Ų | 53.8 | 5% | 0.049 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -63.5 | -40.8 | 177.6 | 54.5 | 0 | 0 | 0 | 0 | 111.7 | L5 Q6 L12 L13 L41 H45 | L5-S9 VanDerWaalsContact O-CB 3.3Å; L5-S9 WeakPolarHBondContact O-CB 3.35Å; L5-S9 PolarHBondContact O-N 3.39Å; L5-S9 PolarHBondContact O-OG 3.15Å; Q6-S9 WeakPolarHBondContact CA-OG 3.42Å; Q6-S9 PolarHBondContact O-OG 3.46Å; S9-L12 PolarHBondContact O-N 3.4Å; S9-L13 WeakPolarHBondContact O-CG 3.45Å; S9-L13 PolarHBondContact O-N 3.33Å; S9-L41 WeakPolarHBondContact O-CD2 3.48Å; S9-H45 PolarHBondContact OG-ND1 3.48Å |
| 10 | G | 95.7 | Very high | 93.2 | Very high | 13 Ų | 13 | 58.1 Ų | 58.1 | 13% | 0.134 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -61.5 | -48.3 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | Q6 L8 L12 L13 V14 H45 | Q6-G10 WeakPolarHBondContact O-CA 3.26Å; Q6-G10 PolarHBondContact O-N 2.83Å; L8-G10 VanDerWaalsContact C-N 3.35Å; L8-G10 PolarHBondContact O-N 3.4Å; G10-L12 VanDerWaalsContact C-N 3.3Å; G10-L12 PolarHBondContact O-N 2.95Å; G10-L13 PolarHBondContact O-N 3.36Å; G10-L13 VanDerWaalsContact O-N 3.17Å; G10-V14 VanDerWaalsContact O-CG2 3.31Å; G10-V14 WeakPolarHBondContact O-CG2 3.03Å; G10-V14 PolarHBondContact O-N 3.48Å; G10-H45 WeakPolarHBondContact CA-CE1 3.35Å; G10-H45 PolarHBondContact N-CE1 3.41Å; G10-H45 PolarHBondContact N-ND1 3.01Å |
| 11 | L | 96.3 | Very high | 92.6 | Very high | 67 Ų | 67 | 61 Ų | 61 | 35% | 0.351 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -56.4 | -44.7 | 176.6 | -179 | 69.4 | 0 | 0 | 0 | 111.7 | L7 L8 V14 F15 Y124 | L7-L11 VanDerWaalsContact O-CB 3.24Å; L7-L11 WeakPolarHBondContact O-CB 3.44Å; L7-L11 PolarHBondContact O-N 2.92Å; L8-L11 PolarHBondContact O-N 2.96Å; L11-V14 PolarHBondContact O-N 3.33Å; L11-F15 HydrophobicContact CG-CE2 4.38Å; L11-F15 WeakPolarHBondContact O-CD2 3.41Å; L11-Y124 HydrophobicContact CD1-CE2 4.11Å; L11-Y124 WeakPolarHBondContact CD1-OH 3.34Å |
| 12 | L | 96.8 | Very high | 92.9 | Very high | 66 Ų | 66 | 61.9 Ų | 61.9 | 35% | 0.346 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -67.6 | -35 | 179.6 | -68.7 | 172.9 | 0 | 0 | 0 | 112.6 | L8 S9 G10 V14 F15 Y16 L41 | L8-L12 HydrophobicContact CD1-CD1 4.31Å; L8-L12 HydrophobicContact CG-CD1 4.24Å; L8-L12 VanDerWaalsContact O-CG 3.31Å; L8-L12 WeakPolarHBondContact O-CG 3.38Å; L8-L12 PolarHBondContact O-N 3.19Å; S9-L12 PolarHBondContact O-N 3.4Å; G10-L12 VanDerWaalsContact C-N 3.3Å; G10-L12 PolarHBondContact O-N 2.95Å; L12-V14 VanDerWaalsContact C-N 3.35Å; L12-F15 HydrophobicContact CD2-CE2 4.47Å; L12-Y16 WeakPolarHBondContact O-CD2 3.25Å; L12-L41 HydrophobicContact CB-CD1 3.63Å; L12-L41 HydrophobicContact CB-CD2 4.09Å; L12-L41 HydrophobicContact CB-CG 4.44Å; L12-L41 HydrophobicContact CD1-CD1 3.69Å; L12-L41 HydrophobicContact CG-CD1 4.3Å |
| 13 | L | 95.8 | Very high | 92.6 | Very high | 22 Ų | 22 | 62.4 Ų | 62.4 | 12% | 0.115 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -65.8 | -37 | 174.1 | -72.2 | 170.3 | 0 | 0 | 0 | 112.5 | S9 G10 F15 Y16 Y17 I31 L41 R42 H45 | S9-L13 WeakPolarHBondContact O-CG 3.45Å; S9-L13 PolarHBondContact O-N 3.33Å; G10-L13 PolarHBondContact O-N 3.36Å; G10-L13 VanDerWaalsContact O-N 3.17Å; L13-F15 PolarHBondContact O-N 3.37Å; L13-Y16 PolarHBondContact O-N 3.04Å; L13-Y17 PolarHBondContact O-N 3.12Å; L13-Y17 VanDerWaalsContact O-N 3.15Å; L13-I31 HydrophobicContact CD2-CD1 4.42Å; L13-I31 HydrophobicContact CD2-CG2 3.7Å; L13-L41 HydrophobicContact CB-CD2 4.38Å; L13-L41 HydrophobicContact CD1-CD2 4.17Å; L13-L41 HydrophobicContact CD2-CD2 3.38Å; L13-L41 HydrophobicContact CG-CD2 3.31Å; L13-R42 HydrophobicContact CD2-CB 4.45Å; L13-H45 HydrophobicContact CD1-CB 3.72Å |
| 14 | V | 95 | Very high | 92.3 | Very high | 47 Ų | 47 | 60.2 Ų | 60.2 | 29% | 0.285 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -60.3 | -32 | -176.5 | 164.3 | 0 | 0 | 0 | 0 | 112.1 | G10 L11 L12 Y16 Y17 F120 Y124 | G10-V14 VanDerWaalsContact O-CG2 3.31Å; G10-V14 WeakPolarHBondContact O-CG2 3.03Å; G10-V14 PolarHBondContact O-N 3.48Å; L11-V14 PolarHBondContact O-N 3.33Å; L12-V14 VanDerWaalsContact C-N 3.35Å; V14-Y16 PolarHBondContact O-N 2.94Å; V14-Y16 VanDerWaalsContact O-N 3.15Å; V14-Y17 PolarHBondContact O-N 3.08Å; V14-F120 HydrophobicContact CB-CZ 4.28Å; V14-F120 HydrophobicContact CG1-CZ 3.96Å; V14-F120 HydrophobicContact CG2-CE2 3.96Å; V14-F120 HydrophobicContact CG2-CZ 3.7Å; V14-Y124 HydrophobicContact CG2-CD2 4.06Å; V14-Y124 HydrophobicContact CG2-CE2 4.39Å |
| 15 | F | 95 | Very high | 92 | Very high | 150 Ų | 150 | 65.2 Ų | 65.2 | 66% | 0.658 | 33% | 0.328 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61.2 | -23.4 | 176.9 | -69.8 | -59.9 | 0 | 0 | 0 | 114.1 | L11 L12 L13 | L11-F15 HydrophobicContact CG-CE2 4.38Å; L11-F15 WeakPolarHBondContact O-CD2 3.41Å; L12-F15 HydrophobicContact CD2-CE2 4.47Å; L13-F15 PolarHBondContact O-N 3.37Å |
| 16 | Y | 94.3 | Very high | 91.9 | Very high | 109 Ų | 109 | 67.7 Ų | 67.7 | 43% | 0.427 | 34% | 0.341 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -110.8 | -13.8 | -176.8 | -56.8 | -76.7 | 0 | 0 | 0 | 113.3 | L12 L13 V14 F30 I31 V35 | L12-Y16 WeakPolarHBondContact O-CD2 3.25Å; L13-Y16 PolarHBondContact O-N 3.04Å; V14-Y16 PolarHBondContact O-N 2.94Å; V14-Y16 VanDerWaalsContact O-N 3.15Å; Y16-F30 HydrophobicContact CD1-CE1 4.27Å; Y16-I31 VanDerWaalsContact CB-CG1 3.5Å; Y16-I31 HydrophobicContact CG-CG1 4.4Å; Y16-V35 HydrophobicContact CD1-CG1 4.37Å; Y16-V35 HydrophobicContact CD1-CG2 3.58Å; Y16-V35 HydrophobicContact CD2-CG1 4.16Å; Y16-V35 HydrophobicContact CD2-CG2 4.37Å; Y16-V35 HydrophobicContact CE1-CG1 3.96Å; Y16-V35 HydrophobicContact CE1-CG2 3.82Å; Y16-V35 HydrophobicContact CE2-CG1 3.74Å; Y16-V35 HydrophobicContact CG-CG1 4.45Å; Y16-V35 HydrophobicContact CG-CG2 3.87Å |
| 17 | Y | 93.3 | Very high | 91.9 | Very high | 47 Ų | 47 | 72.3 Ų | 72.3 | 18% | 0.184 | 36% | 0.357 | C | S | . | . | trans | -95.9 | 139.1 | -175 | -176.1 | -103.7 | 0 | 0 | 0 | 112.3 | L13 V14 P19 A24 R27 I28 F120 | L13-Y17 PolarHBondContact O-N 3.12Å; L13-Y17 VanDerWaalsContact O-N 3.15Å; V14-Y17 PolarHBondContact O-N 3.08Å; Y17-P19 HydrophobicContact CE1-CB 3.99Å; Y17-A24 HydrophobicContact CE2-CB 4.26Å; Y17-R27 HydrophobicContact CD2-CB 4.28Å; Y17-I28 HydrophobicContact CD2-CG1 4.2Å; Y17-I28 HydrophobicContact CE2-CD1 4.3Å; Y17-I28 HydrophobicContact CE2-CG1 3.89Å; Y17-F120 AromaticContact CD1-CD2 3.78Å; Y17-F120 HydrophobicContact CD1-CD2 3.78Å; Y17-F120 AromaticContact CD1-CE2 3.42Å; Y17-F120 HydrophobicContact CD1-CE2 3.42Å; Y17-F120 VanDerWaalsContact CD1-CE2 3.42Å; Y17-F120 HydrophobicContact CD1-CZ 4.02Å; Y17-F120 AromaticContact CE1-CD2 3.72Å; Y17-F120 HydrophobicContact CE1-CD2 3.72Å; Y17-F120 AromaticContact CE1-CE2 3.89Å; Y17-F120 HydrophobicContact CE1-CE2 3.89Å; Y17-F120 HydrophobicContact CE1-CG 4.42Å | ||
| 18 | V | 91.4 | Very high | 91.7 | Very high | 46 Ų | 46 | 72.1 Ų | 72.1 | 28% | 0.279 | 36% | 0.356 | S | S | . | . | trans | -126.8 | 115.7 | 176.8 | -173.9 | 0 | 0 | 0 | 0 | 109.4 | R20 R27 | V18-R20 HydrophobicContact CG1-CG 3.97Å; V18-R20 PolarHBondContact O-N 3.14Å; V18-R27 HydrophobicContact CB-CG 4.23Å; V18-R27 HydrophobicContact CG2-CG 4.43Å | ||
| 19 | P | 87.9 | Confident | 91.5 | Very high | 20 Ų | 20 | 70.4 Ų | 70.4 | 13% | 0.13 | 35% | 0.347 | C | S | . | . | trans | -78.2 | 82.9 | -179 | 32.1 | -36.6 | 0 | 0 | 0 | 111.2 | Y17 L116 Q117 F120 | Y17-P19 HydrophobicContact CE1-CB 3.99Å; P19-L116 HydrophobicContact CB-CD2 4.29Å; P19-L116 HydrophobicContact CB-CG 4.06Å; P19-Q117 HydrophobicContact CB-CG 4.38Å; P19-Q117 HydrophobicContact CG-CG 4.18Å; P19-Q117 WeakPolarHBondContact O-CG 3.39Å; P19-F120 HydrophobicContact CB-CB 3.85Å; P19-F120 HydrophobicContact CB-CD1 4.22Å; P19-F120 HydrophobicContact CB-CG 3.99Å; P19-F120 HydrophobicContact CG-CB 4.17Å; P19-F120 HydrophobicContact CG-CD1 3.65Å; P19-F120 HydrophobicContact CG-CE1 4.16Å; P19-F120 HydrophobicContact CG-CG 3.95Å | ||
| 20 | R | 85.2 | Confident | 91.4 | Very high | 139 Ų | 139 | 74.1 Ų | 74.1 | 53% | 0.525 | 36% | 0.362 | S | S | . | . | trans | -124.3 | 143.9 | 171.6 | -69.9 | 176.4 | -157.7 | -165.6 | 7.2 | 110.4 | V18 V22 A24 L116 | V18-R20 HydrophobicContact CG1-CG 3.97Å; V18-R20 PolarHBondContact O-N 3.14Å; R20-V22 VanDerWaalsContact C-N 3.3Å; R20-V22 WeakPolarHBondContact CB-O 3.34Å; R20-V22 PolarHBondContact O-N 2.84Å; R20-A24 WeakPolarHBondContact O-CB 3.26Å; R20-A24 PolarHBondContact O-N 2.9Å; R20-L116 WeakPolarHBondContact O-CD2 3.32Å | ||
| 21 | E | 80.6 | Confident | 91.3 | Very high | 119 Ų | 119 | 73.6 Ų | 73.6 | 56% | 0.556 | 36% | 0.357 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57 | -45.5 | 179.1 | -172.9 | 176.4 | 165.2 | 0 | 0 | 111.6 | R112 R113 | E21-R112 WeakPolarHBondContact OE2-CA 3.31Å; E21-R113 HydrophobicContact CB-CB 4.45Å; E21-R113 PolarHBondContact OE2-N 3.25Å |
| 22 | V | 86.3 | Confident | 91.2 | Very high | 130 Ų | 130 | 73.1 Ų | 73.1 | 79% | 0.788 | 35% | 0.353 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -92.1 | 125.3 | 170.9 | -174.9 | 0 | 0 | 0 | 0 | 109.1 | R20 | R20-V22 VanDerWaalsContact C-N 3.3Å; R20-V22 WeakPolarHBondContact CB-O 3.34Å; R20-V22 PolarHBondContact O-N 2.84Å |
| 23 | G | 85.3 | Confident | 91 | Very high | 24 Ų | 24 | 78.8 Ų | 78.8 | 25% | 0.247 | 37% | 0.37 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 87.7 | -0.4 | 172.4 | 0 | 0 | 0 | 0 | 0 | 116.7 | F25 D26 R27 | G23-F25 VanDerWaalsContact C-N 3.27Å; G23-F25 PolarHBondContact O-N 3.2Å; G23-D26 WeakPolarHBondContact CA-OD2 3.43Å; G23-D26 PolarHBondContact O-N 3.42Å; G23-R27 WeakPolarHBondContact O-CG 3.5Å; G23-R27 PolarHBondContact O-N 3.17Å; G23-R27 VanDerWaalsContact O-N 3.09Å |
| 24 | A | 86.6 | Confident | 90.9 | Very high | 11 Ų | 11 | 84 Ų | 84 | 9% | 0.091 | 39% | 0.394 | C | S | . | . | H | α-helix | trans | -58.8 | -41.2 | 172.9 | 0 | 0 | 0 | 0 | 0 | 112 | Y17 R20 D26 R27 I28 L116 | Y17-A24 HydrophobicContact CE2-CB 4.26Å; R20-A24 WeakPolarHBondContact O-CB 3.26Å; R20-A24 PolarHBondContact O-N 2.9Å; A24-D26 VanDerWaalsContact C-N 3.32Å; A24-D26 PolarHBondContact O-N 3.49Å; A24-R27 PolarHBondContact O-N 3.34Å; A24-I28 WeakPolarHBondContact O-CG1 3.24Å; A24-I28 PolarHBondContact O-N 3.12Å; A24-I28 VanDerWaalsContact O-N 3.11Å; A24-L116 HydrophobicContact CB-CD2 3.97Å |
| 25 | F | 88.1 | Confident | 90.9 | Very high | 143 Ų | 143 | 82.7 Ų | 82.7 | 63% | 0.627 | 39% | 0.386 | S | S | * | . | H | α-helix | trans | -66.1 | -35.1 | 176.8 | -169.7 | -107.8 | 0 | 0 | 0 | 112.3 | G23 R27 I28 I29 | G23-F25 VanDerWaalsContact C-N 3.27Å; G23-F25 PolarHBondContact O-N 3.2Å; F25-R27 VanDerWaalsContact C-N 3.31Å; F25-R27 PolarHBondContact O-N 3.35Å; F25-I28 HydrophobicContact CD2-CG2 4.43Å; F25-I28 HydrophobicContact CE2-CG2 4.45Å; F25-I28 WeakPolarHBondContact O-CA 3.5Å; F25-I28 VanDerWaalsContact O-CB 3.23Å; F25-I28 WeakPolarHBondContact O-CB 3.25Å; F25-I28 PolarHBondContact O-N 3Å; F25-I29 HydrophobicContact CD1-CD1 3.68Å; F25-I29 HydrophobicContact CD1-CG1 4.21Å; F25-I29 HydrophobicContact CE1-CD1 3.54Å; F25-I29 HydrophobicContact CE1-CG1 4Å; F25-I29 HydrophobicContact CZ-CD1 4.41Å; F25-I29 HydrophobicContact CZ-CG1 4.44Å; F25-I29 WeakPolarHBondContact O-CG1 3.31Å; F25-I29 PolarHBondContact O-N 3.34Å |
| 26 | D | 92.6 | Very high | 90.8 | Very high | 99 Ų | 99 | 83.6 Ų | 83.6 | 53% | 0.529 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -66.2 | -36 | 175.8 | -55.2 | -34.3 | 0 | 0 | 0 | 111.4 | G23 A24 I28 I29 F30 | G23-D26 WeakPolarHBondContact CA-OD2 3.43Å; G23-D26 PolarHBondContact O-N 3.42Å; A24-D26 VanDerWaalsContact C-N 3.32Å; A24-D26 PolarHBondContact O-N 3.49Å; D26-I28 VanDerWaalsContact C-N 3.29Å; D26-I28 PolarHBondContact O-N 3.06Å; D26-I29 PolarHBondContact O-N 3Å; D26-F30 WeakPolarHBondContact O-CB 3.23Å; D26-F30 PolarHBondContact O-N 3Å |
| 27 | R | 93.6 | Very high | 90.7 | Very high | 117 Ų | 117 | 86 Ų | 86 | 44% | 0.442 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -64.3 | -35.7 | 171.4 | -62.3 | -60.1 | 176.9 | -177.2 | -2.8 | 112.1 | Y17 V18 G23 A24 F25 F30 I31 | Y17-R27 HydrophobicContact CD2-CB 4.28Å; V18-R27 HydrophobicContact CB-CG 4.23Å; V18-R27 HydrophobicContact CG2-CG 4.43Å; G23-R27 WeakPolarHBondContact O-CG 3.5Å; G23-R27 PolarHBondContact O-N 3.17Å; G23-R27 VanDerWaalsContact O-N 3.09Å; A24-R27 PolarHBondContact O-N 3.34Å; F25-R27 VanDerWaalsContact C-N 3.31Å; F25-R27 PolarHBondContact O-N 3.35Å; R27-F30 PolarHBondContact O-N 3.31Å; R27-I31 WeakPolarHBondContact O-CD1 3.37Å; R27-I31 VanDerWaalsContact O-CG1 3.26Å; R27-I31 WeakPolarHBondContact O-CG1 3.24Å; R27-I31 PolarHBondContact O-N 3.11Å |
| 28 | I | 92.1 | Very high | 90.7 | Very high | 41 Ų | 41 | 83.9 Ų | 83.9 | 21% | 0.21 | 39% | 0.391 | C | S | . | . | H | α-helix | trans | -61.9 | -48 | 172.4 | -70.4 | -174.2 | 0 | 0 | 0 | 110.8 | Y17 A24 F25 D26 F30 I31 M32 | Y17-I28 HydrophobicContact CD2-CG1 4.2Å; Y17-I28 HydrophobicContact CE2-CD1 4.3Å; Y17-I28 HydrophobicContact CE2-CG1 3.89Å; A24-I28 WeakPolarHBondContact O-CG1 3.24Å; A24-I28 PolarHBondContact O-N 3.12Å; A24-I28 VanDerWaalsContact O-N 3.11Å; F25-I28 HydrophobicContact CD2-CG2 4.43Å; F25-I28 HydrophobicContact CE2-CG2 4.45Å; F25-I28 WeakPolarHBondContact O-CA 3.5Å; F25-I28 VanDerWaalsContact O-CB 3.23Å; F25-I28 WeakPolarHBondContact O-CB 3.25Å; F25-I28 PolarHBondContact O-N 3Å; D26-I28 VanDerWaalsContact C-N 3.29Å; D26-I28 PolarHBondContact O-N 3.06Å; I28-F30 VanDerWaalsContact C-N 3.35Å; I28-I31 PolarHBondContact O-N 3.06Å; I28-M32 VanDerWaalsContact O-CG 3.27Å; I28-M32 WeakPolarHBondContact O-CG 3.5Å; I28-M32 PolarHBondContact O-N 3.21Å; I28-M32 VanDerWaalsContact O-N 3.12Å |
| 29 | I | 93.2 | Very high | 90.7 | Very high | 62 Ų | 62 | 84.5 Ų | 84.5 | 32% | 0.318 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -61.3 | -45.2 | 177.1 | -65.6 | 168 | 0 | 0 | 0 | 110.5 | F25 D26 I31 M32 R33 | F25-I29 HydrophobicContact CD1-CD1 3.68Å; F25-I29 HydrophobicContact CD1-CG1 4.21Å; F25-I29 HydrophobicContact CE1-CD1 3.54Å; F25-I29 HydrophobicContact CE1-CG1 4Å; F25-I29 HydrophobicContact CZ-CD1 4.41Å; F25-I29 HydrophobicContact CZ-CG1 4.44Å; F25-I29 WeakPolarHBondContact O-CG1 3.31Å; F25-I29 PolarHBondContact O-N 3.34Å; D26-I29 PolarHBondContact O-N 3Å; I29-I31 VanDerWaalsContact C-N 3.33Å; I29-I31 PolarHBondContact O-N 2.93Å; I29-M32 WeakPolarHBondContact O-CA 3.48Å; I29-M32 WeakPolarHBondContact O-CB 3.32Å; I29-M32 PolarHBondContact O-N 2.98Å; I29-R33 HydrophobicContact CG2-CG 4.26Å; I29-R33 PolarHBondContact O-N 3.33Å |
| 30 | F | 93.9 | Very high | 90.9 | Very high | 84 Ų | 84 | 88.3 Ų | 88.3 | 37% | 0.368 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -56 | -46.4 | 177.1 | 175.7 | -97 | 0 | 0 | 0 | 111.8 | Y16 D26 R27 I28 M32 R33 E34 V35 | Y16-F30 HydrophobicContact CD1-CE1 4.27Å; D26-F30 WeakPolarHBondContact O-CB 3.23Å; D26-F30 PolarHBondContact O-N 3Å; R27-F30 PolarHBondContact O-N 3.31Å; I28-F30 VanDerWaalsContact C-N 3.35Å; F30-M32 VanDerWaalsContact C-N 3.26Å; F30-M32 PolarHBondContact O-N 3.4Å; F30-R33 PolarHBondContact O-N 2.92Å; F30-E34 HydrophobicContact CD2-CB 3.59Å; F30-E34 HydrophobicContact CD2-CG 3.55Å; F30-E34 HydrophobicContact CE2-CB 3.48Å; F30-E34 VanDerWaalsContact CE2-CB 3.48Å; F30-E34 HydrophobicContact CE2-CG 3.82Å; F30-E34 HydrophobicContact CG-CB 4.29Å; F30-E34 HydrophobicContact CG-CG 4.4Å; F30-E34 HydrophobicContact CZ-CB 4.11Å; F30-E34 WeakPolarHBondContact O-CB 3.42Å; F30-E34 PolarHBondContact O-N 3.07Å; F30-V35 HydrophobicContact CD1-CG2 3.98Å; F30-V35 HydrophobicContact CE1-CG2 3.62Å; F30-V35 HydrophobicContact CZ-CG2 4.33Å; F30-V35 PolarHBondContact O-N 3.33Å |
| 31 | I | 94.8 | Very high | 91.4 | Very high | 2 Ų | 2 | 83.6 Ų | 83.6 | 1% | 0.01 | 39% | 0.39 | C | S | . | . | H | α-helix | trans | -58.9 | -40.3 | 174.5 | -69.5 | 164.1 | 0 | 0 | 0 | 111.4 | L13 Y16 R27 I28 I29 G38 | L13-I31 HydrophobicContact CD2-CD1 4.42Å; L13-I31 HydrophobicContact CD2-CG2 3.7Å; Y16-I31 VanDerWaalsContact CB-CG1 3.5Å; Y16-I31 HydrophobicContact CG-CG1 4.4Å; R27-I31 WeakPolarHBondContact O-CD1 3.37Å; R27-I31 VanDerWaalsContact O-CG1 3.26Å; R27-I31 WeakPolarHBondContact O-CG1 3.24Å; R27-I31 PolarHBondContact O-N 3.11Å; I28-I31 PolarHBondContact O-N 3.06Å; I29-I31 VanDerWaalsContact C-N 3.33Å; I29-I31 PolarHBondContact O-N 2.93Å; I31-G38 CarbonylContact O-C 3.39Å; I31-G38 VanDerWaalsContact O-CA 3.26Å; I31-G38 WeakPolarHBondContact O-CA 3.49Å |
| 32 | M | 93.4 | Very high | 92 | Very high | 58 Ų | 58 | 80.9 Ų | 80.9 | 29% | 0.286 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -74.7 | -29.3 | -176 | -67.9 | -64.9 | -89.8 | 0 | 0 | 113.5 | I28 I29 F30 F39 R42 | I28-M32 VanDerWaalsContact O-CG 3.27Å; I28-M32 WeakPolarHBondContact O-CG 3.5Å; I28-M32 PolarHBondContact O-N 3.21Å; I28-M32 VanDerWaalsContact O-N 3.12Å; I29-M32 WeakPolarHBondContact O-CA 3.48Å; I29-M32 WeakPolarHBondContact O-CB 3.32Å; I29-M32 PolarHBondContact O-N 2.98Å; F30-M32 VanDerWaalsContact C-N 3.26Å; F30-M32 PolarHBondContact O-N 3.4Å; M32-F39 HydrophobicContact CE-CD2 3.27Å; M32-F39 HydrophobicContact CE-CE2 3.59Å; M32-F39 HydrophobicContact CE-CG 4.43Å; M32-F39 HydrophobicContact SD-CD2 3.94Å; M32-R42 HydrophobicContact SD-CB 3.58Å; M32-R42 VanDerWaalsContact SD-CB 3.58Å; M32-R42 WeakPolarHBondContact SD-CD 3.45Å; M32-R42 HydrophobicContact SD-CG 4Å; M32-R42 PolarHBondContact SD-NE 3.03Å |
| 33 | R | 92 | Very high | 92.3 | Very high | 185 Ų | 185 | 75.5 Ų | 75.5 | 70% | 0.698 | 34% | 0.341 | S | S | * | . | H | α-helix | trans | -108.5 | -42.1 | -172.1 | -65.9 | -174.5 | 177 | -104.4 | 0.3 | 113.9 | I29 F30 | I29-R33 HydrophobicContact CG2-CG 4.26Å; I29-R33 PolarHBondContact O-N 3.33Å; F30-R33 PolarHBondContact O-N 2.92Å |
| 34 | E | 94.6 | Very high | 92.7 | Very high | 132 Ų | 132 | 76.6 Ų | 76.6 | 62% | 0.617 | 34% | 0.341 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -102.3 | -29.1 | -167.3 | -53 | -54.2 | 141.7 | 0 | 0 | 113 | F30 K36 | F30-E34 HydrophobicContact CD2-CB 3.59Å; F30-E34 HydrophobicContact CD2-CG 3.55Å; F30-E34 HydrophobicContact CE2-CB 3.48Å; F30-E34 VanDerWaalsContact CE2-CB 3.48Å; F30-E34 HydrophobicContact CE2-CG 3.82Å; F30-E34 HydrophobicContact CG-CB 4.29Å; F30-E34 HydrophobicContact CG-CG 4.4Å; F30-E34 HydrophobicContact CZ-CB 4.11Å; F30-E34 WeakPolarHBondContact O-CB 3.42Å; F30-E34 PolarHBondContact O-N 3.07Å; E34-K36 PolarHBondContact O-N 3.44Å |
| 35 | V | 94.5 | Very high | 93.1 | Very high | 18 Ų | 18 | 77.9 Ų | 77.9 | 11% | 0.109 | 35% | 0.345 | C | S | . | . | S | Bend | trans | -78.8 | 126.2 | 179.9 | 179 | 0 | 0 | 0 | 0 | 109.9 | Y16 F30 Y37 G38 | Y16-V35 HydrophobicContact CD1-CG1 4.37Å; Y16-V35 HydrophobicContact CD1-CG2 3.58Å; Y16-V35 HydrophobicContact CD2-CG1 4.16Å; Y16-V35 HydrophobicContact CD2-CG2 4.37Å; Y16-V35 HydrophobicContact CE1-CG1 3.96Å; Y16-V35 HydrophobicContact CE1-CG2 3.82Å; Y16-V35 HydrophobicContact CE2-CG1 3.74Å; Y16-V35 HydrophobicContact CG-CG1 4.45Å; Y16-V35 HydrophobicContact CG-CG2 3.87Å; F30-V35 HydrophobicContact CD1-CG2 3.98Å; F30-V35 HydrophobicContact CE1-CG2 3.62Å; F30-V35 HydrophobicContact CZ-CG2 4.33Å; F30-V35 PolarHBondContact O-N 3.33Å; V35-Y37 PolarHBondContact O-N 2.99Å; V35-G38 PolarHBondContact O-N 3.4Å |
| 36 | K | 93.6 | Very high | 93.4 | Very high | 170 Ų | 170 | 76.4 Ų | 76.4 | 74% | 0.739 | 34% | 0.343 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -55.9 | 123 | 176.2 | -167 | -175 | -176.9 | -179.5 | 0 | 110.5 | E34 G38 | E34-K36 PolarHBondContact O-N 3.44Å; K36-G38 PolarHBondContact O-N 3.49Å; K36-G38 VanDerWaalsContact O-N 3.14Å |
| 37 | Y | 92.3 | Very high | 93.4 | Very high | 159 Ų | 159 | 73.2 Ų | 73.2 | 62% | 0.624 | 33% | 0.326 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 59.4 | 10 | -172.5 | -50.4 | -69.1 | 0 | 0 | 0 | 115.6 | V35 F39 F40 L41 | V35-Y37 PolarHBondContact O-N 2.99Å; Y37-F39 VanDerWaalsContact C-N 3.28Å; Y37-F39 PolarHBondContact O-N 3.43Å; Y37-F40 PolarHBondContact O-N 3.23Å; Y37-F40 VanDerWaalsContact O-N 3.14Å; Y37-L41 WeakPolarHBondContact O-CB 3.09Å; Y37-L41 PolarHBondContact O-N 3.19Å |
| 38 | G | 93.3 | Very high | 93.4 | Very high | 2 Ų | 2 | 67.6 Ų | 67.6 | 2% | 0.021 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -62.7 | -34.5 | -177.6 | 0 | 0 | 0 | 0 | 0 | 113 | I31 V35 K36 L41 R42 | I31-G38 CarbonylContact O-C 3.39Å; I31-G38 VanDerWaalsContact O-CA 3.26Å; I31-G38 WeakPolarHBondContact O-CA 3.49Å; V35-G38 PolarHBondContact O-N 3.4Å; K36-G38 PolarHBondContact O-N 3.49Å; K36-G38 VanDerWaalsContact O-N 3.14Å; G38-L41 PolarHBondContact O-N 2.63Å; G38-R42 PolarHBondContact O-N 2.89Å |
| 39 | F | 91.5 | Very high | 93.5 | Very high | 59 Ų | 59 | 67.4 Ų | 67.4 | 26% | 0.259 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -55.5 | -54.5 | 169.6 | 179.6 | -114.4 | 0 | 0 | 0 | 113 | M32 Y37 L41 R42 L43 L188 | M32-F39 HydrophobicContact CE-CD2 3.27Å; M32-F39 HydrophobicContact CE-CE2 3.59Å; M32-F39 HydrophobicContact CE-CG 4.43Å; M32-F39 HydrophobicContact SD-CD2 3.94Å; Y37-F39 VanDerWaalsContact C-N 3.28Å; Y37-F39 PolarHBondContact O-N 3.43Å; F39-L41 VanDerWaalsContact C-N 3.3Å; F39-L41 PolarHBondContact O-N 3.14Å; F39-R42 PolarHBondContact O-N 2.99Å; F39-L43 HydrophobicContact CD1-CD1 3.82Å; F39-L43 HydrophobicContact CD2-CD1 4.42Å; F39-L43 HydrophobicContact CE1-CD1 3.42Å; F39-L43 VanDerWaalsContact CE1-CD1 3.42Å; F39-L43 HydrophobicContact CE2-CD1 4Å; F39-L43 HydrophobicContact CE2-CG 4.49Å; F39-L43 HydrophobicContact CG-CD1 4.32Å; F39-L43 HydrophobicContact CZ-CD1 3.48Å; F39-L43 VanDerWaalsContact CZ-CD1 3.48Å; F39-L43 HydrophobicContact CZ-CG 4.38Å; F39-L43 PolarHBondContact O-N 2.94Å; F39-L188 HydrophobicContact CD1-CD2 3.92Å; F39-L188 HydrophobicContact CE1-CD2 3.29Å; F39-L188 HydrophobicContact CZ-CD2 4.2Å |
| 40 | F | 91.8 | Very high | 93.5 | Very high | 100 Ų | 100 | 67.6 Ų | 67.6 | 44% | 0.439 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -60.8 | -41.7 | 178 | -78.7 | -90.7 | 0 | 0 | 0 | 111.6 | Y37 L43 I44 L188 | Y37-F40 PolarHBondContact O-N 3.23Å; Y37-F40 VanDerWaalsContact O-N 3.14Å; F40-L43 WeakPolarHBondContact O-CB 3.39Å; F40-L43 PolarHBondContact O-N 2.8Å; F40-I44 WeakPolarHBondContact O-CG1 3.23Å; F40-I44 PolarHBondContact O-N 2.93Å; F40-L188 HydrophobicContact CD1-CD1 4.01Å; F40-L188 HydrophobicContact CD1-CD2 4.17Å; F40-L188 HydrophobicContact CE1-CD1 3.27Å; F40-L188 HydrophobicContact CE1-CD2 3.77Å; F40-L188 HydrophobicContact CE1-CG 4.18Å; F40-L188 HydrophobicContact CZ-CD1 3.97Å; F40-L188 HydrophobicContact CZ-CD2 3.98Å |
| 41 | L | 94.4 | Very high | 93.5 | Very high | 40 Ų | 40 | 65 Ų | 65 | 21% | 0.209 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -65.2 | -41.9 | -178.2 | -163.6 | 146.1 | 0 | 0 | 0 | 111.5 | S9 L12 L13 Y37 G38 F39 I44 H45 | S9-L41 WeakPolarHBondContact O-CD2 3.48Å; L12-L41 HydrophobicContact CB-CD1 3.63Å; L12-L41 HydrophobicContact CB-CD2 4.09Å; L12-L41 HydrophobicContact CB-CG 4.44Å; L12-L41 HydrophobicContact CD1-CD1 3.69Å; L12-L41 HydrophobicContact CG-CD1 4.3Å; L13-L41 HydrophobicContact CB-CD2 4.38Å; L13-L41 HydrophobicContact CD1-CD2 4.17Å; L13-L41 HydrophobicContact CD2-CD2 3.38Å; L13-L41 HydrophobicContact CG-CD2 3.31Å; Y37-L41 WeakPolarHBondContact O-CB 3.09Å; Y37-L41 PolarHBondContact O-N 3.19Å; G38-L41 PolarHBondContact O-N 2.63Å; F39-L41 VanDerWaalsContact C-N 3.3Å; F39-L41 PolarHBondContact O-N 3.14Å; L41-I44 PolarHBondContact O-N 3Å; L41-H45 PolarHBondContact O-N 3.31Å; L41-H45 VanDerWaalsContact O-N 3.08Å |
| 42 | R | 93.1 | Very high | 93.5 | Very high | 62 Ų | 62 | 65.9 Ų | 65.9 | 23% | 0.234 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -64.3 | -43.6 | 171.5 | -172.3 | -166.7 | -78.3 | -102.9 | -24.9 | 111.6 | L13 M32 G38 F39 I44 H45 L46 | L13-R42 HydrophobicContact CD2-CB 4.45Å; M32-R42 HydrophobicContact SD-CB 3.58Å; M32-R42 VanDerWaalsContact SD-CB 3.58Å; M32-R42 WeakPolarHBondContact SD-CD 3.45Å; M32-R42 HydrophobicContact SD-CG 4Å; M32-R42 PolarHBondContact SD-NE 3.03Å; G38-R42 PolarHBondContact O-N 2.89Å; F39-R42 PolarHBondContact O-N 2.99Å; R42-I44 VanDerWaalsContact C-N 3.31Å; R42-I44 PolarHBondContact O-N 3.35Å; R42-H45 PolarHBondContact O-N 3.14Å; R42-L46 WeakPolarHBondContact O-CB 3.18Å; R42-L46 PolarHBondContact O-N 2.75Å |
| 43 | L | 93.4 | Very high | 93.6 | Very high | 17 Ų | 17 | 64.9 Ų | 64.9 | 9% | 0.089 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -58.9 | -43 | 179 | -87 | 167.4 | 0 | 0 | 0 | 112 | F39 F40 N47 L184 I187 L188 | F39-L43 HydrophobicContact CD1-CD1 3.82Å; F39-L43 HydrophobicContact CD2-CD1 4.42Å; F39-L43 HydrophobicContact CE1-CD1 3.42Å; F39-L43 VanDerWaalsContact CE1-CD1 3.42Å; F39-L43 HydrophobicContact CE2-CD1 4Å; F39-L43 HydrophobicContact CE2-CG 4.49Å; F39-L43 HydrophobicContact CG-CD1 4.32Å; F39-L43 HydrophobicContact CZ-CD1 3.48Å; F39-L43 VanDerWaalsContact CZ-CD1 3.48Å; F39-L43 HydrophobicContact CZ-CG 4.38Å; F39-L43 PolarHBondContact O-N 2.94Å; F40-L43 WeakPolarHBondContact O-CB 3.39Å; F40-L43 PolarHBondContact O-N 2.8Å; L43-N47 VanDerWaalsContact O-CB 3.3Å; L43-N47 WeakPolarHBondContact O-CB 3.45Å; L43-N47 PolarHBondContact O-N 2.92Å; L43-N47 PolarHBondContact O-ND2 3.41Å; L43-L184 HydrophobicContact CB-CD2 4.12Å; L43-I187 HydrophobicContact CD2-CG2 3.61Å; L43-L188 HydrophobicContact CD1-CD2 3.45Å; L43-L188 VanDerWaalsContact CD1-CD2 3.45Å; L43-L188 HydrophobicContact CD1-CG 4.24Å |
| 44 | I | 94.1 | Very high | 93.7 | Very high | 48 Ų | 48 | 60.4 Ų | 60.4 | 25% | 0.246 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -62.5 | -45.3 | 175.2 | -69.2 | 166.1 | 0 | 0 | 0 | 110.5 | Q6 F40 L41 R42 G48 L184 | Q6-I44 PolarHBondContact NE2-O 2.91Å; F40-I44 WeakPolarHBondContact O-CG1 3.23Å; F40-I44 PolarHBondContact O-N 2.93Å; L41-I44 PolarHBondContact O-N 3Å; R42-I44 VanDerWaalsContact C-N 3.31Å; R42-I44 PolarHBondContact O-N 3.35Å; I44-G48 WeakPolarHBondContact O-CA 3.4Å; I44-G48 PolarHBondContact O-N 3.21Å; I44-L184 HydrophobicContact CG1-CD1 3.99Å |
| 45 | H | 95 | Very high | 93.8 | Very high | 38 Ų | 38 | 56.1 Ų | 56.1 | 18% | 0.176 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -61.7 | -53.2 | 179.7 | -160.6 | 70.6 | 0 | 0 | 0 | 111.1 | Q6 S9 G10 L13 L41 R42 A49 | Q6-H45 PolarHBondContact NE2-O 2.95Å; Q6-H45 PolarHBondContact O-CE1 3.45Å; Q6-H45 PolarHBondContact O-ND1 3.26Å; Q6-H45 PolarHBondContact OE1-CE1 3.01Å; Q6-H45 VanDerWaalsContact OE1-CE1 3.22Å; Q6-H45 PolarHBondContact OE1-ND1 3.34Å; Q6-H45 PolarHBondContact OE1-O 3.31Å; Q6-H45 VanDerWaalsContact OE1-O 3.04Å; S9-H45 PolarHBondContact OG-ND1 3.48Å; G10-H45 WeakPolarHBondContact CA-CE1 3.35Å; G10-H45 PolarHBondContact N-CE1 3.41Å; G10-H45 PolarHBondContact N-ND1 3.01Å; L13-H45 HydrophobicContact CD1-CB 3.72Å; L41-H45 PolarHBondContact O-N 3.31Å; L41-H45 VanDerWaalsContact O-N 3.08Å; R42-H45 PolarHBondContact O-N 3.14Å; H45-A49 PolarHBondContact O-N 2.96Å; H45-A49 VanDerWaalsContact O-N 3.08Å |
| 46 | L | 93.2 | Very high | 93.9 | Very high | 112 Ų | 112 | 56.8 Ų | 56.8 | 59% | 0.586 | 28% | 0.277 | S | S | * | . | H | α-helix | trans | -61.5 | -52.9 | -178.9 | -176.6 | 68.4 | 0 | 0 | 0 | 112.4 | R42 A49 S50 | R42-L46 WeakPolarHBondContact O-CB 3.18Å; R42-L46 PolarHBondContact O-N 2.75Å; L46-A49 WeakPolarHBondContact O-CB 3.47Å; L46-A49 PolarHBondContact O-N 3.38Å; L46-S50 PolarHBondContact O-N 3.32Å |
| 47 | N | 93.4 | Very high | 94 | Very high | 31 Ų | 31 | 54.9 Ų | 54.9 | 17% | 0.166 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -73.6 | -33.2 | -176.1 | -70.2 | -73.9 | 0 | 0 | 0 | 112.2 | L43 A49 S50 L51 F180 L184 I187 | L43-N47 VanDerWaalsContact O-CB 3.3Å; L43-N47 WeakPolarHBondContact O-CB 3.45Å; L43-N47 PolarHBondContact O-N 2.92Å; L43-N47 PolarHBondContact O-ND2 3.41Å; N47-A49 VanDerWaalsContact C-N 3.27Å; N47-A49 PolarHBondContact O-N 3.46Å; N47-S50 WeakPolarHBondContact O-CB 3.47Å; N47-S50 PolarHBondContact O-N 2.66Å; N47-L51 PolarHBondContact O-N 2.89Å; N47-F180 HydrophobicContact CB-CE2 3.87Å; N47-F180 HydrophobicContact CB-CZ 4.35Å; N47-L184 HydrophobicContact CB-CD2 4.01Å; N47-I187 VanDerWaalsContact OD1-CD1 3.27Å; N47-I187 WeakPolarHBondContact OD1-CD1 3.4Å |
| 48 | G | 94.6 | Very high | 94.2 | Very high | 0 Ų | 0 | 52.3 Ų | 52.3 | 0% | 0 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -70.2 | -26.4 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112 | I44 L51 I52 | I44-G48 WeakPolarHBondContact O-CA 3.4Å; I44-G48 PolarHBondContact O-N 3.21Å; G48-L51 PolarHBondContact O-N 3.42Å; G48-I52 WeakPolarHBondContact O-CG1 3.29Å; G48-I52 PolarHBondContact O-N 3.22Å |
| 49 | A | 94 | Very high | 94.2 | Very high | 36 Ų | 36 | 57.2 Ų | 57.2 | 30% | 0.298 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -61.8 | -46.9 | 169.6 | 0 | 0 | 0 | 0 | 0 | 110.8 | Q6 H45 L46 N47 L51 I52 F53 | Q6-A49 VanDerWaalsContact NE2-N 3.15Å; H45-A49 PolarHBondContact O-N 2.96Å; H45-A49 VanDerWaalsContact O-N 3.08Å; L46-A49 WeakPolarHBondContact O-CB 3.47Å; L46-A49 PolarHBondContact O-N 3.38Å; N47-A49 VanDerWaalsContact C-N 3.27Å; N47-A49 PolarHBondContact O-N 3.46Å; A49-L51 VanDerWaalsContact C-N 3.3Å; A49-L51 PolarHBondContact O-N 3.48Å; A49-I52 WeakPolarHBondContact O-CB 3.49Å; A49-I52 PolarHBondContact O-N 2.89Å; A49-F53 WeakPolarHBondContact O-CD2 3.3Å; A49-F53 PolarHBondContact O-N 2.84Å |
| 50 | S | 93.2 | Very high | 94.4 | Very high | 66 Ų | 66 | 55.8 Ų | 55.8 | 46% | 0.462 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -58.2 | -42 | 173.7 | -56.8 | 0 | 0 | 0 | 0 | 112.2 | L46 N47 I52 F53 I54 | L46-S50 PolarHBondContact O-N 3.32Å; N47-S50 WeakPolarHBondContact O-CB 3.47Å; N47-S50 PolarHBondContact O-N 2.66Å; S50-I52 VanDerWaalsContact C-N 3.34Å; S50-I52 PolarHBondContact O-N 3.37Å; S50-F53 PolarHBondContact O-N 2.92Å; S50-I54 WeakPolarHBondContact O-CG1 3.33Å; S50-I54 PolarHBondContact O-N 3.5Å; S50-I54 VanDerWaalsContact O-N 3.1Å |
| 51 | L | 93.4 | Very high | 94.6 | Very high | 29 Ų | 29 | 53.3 Ų | 53.3 | 15% | 0.152 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -67.5 | -32.3 | 179.1 | -173.5 | 54 | 0 | 0 | 0 | 112.9 | I2 N47 G48 A49 F53 I54 L55 F180 | I2-L51 HydrophobicContact CD1-CB 4.45Å; I2-L51 HydrophobicContact CD1-CD2 3.21Å; I2-L51 HydrophobicContact CD1-CG 3.56Å; N47-L51 PolarHBondContact O-N 2.89Å; G48-L51 PolarHBondContact O-N 3.42Å; A49-L51 VanDerWaalsContact C-N 3.3Å; A49-L51 PolarHBondContact O-N 3.48Å; L51-F53 VanDerWaalsContact C-N 3.34Å; L51-I54 HydrophobicContact CD1-CB 4.42Å; L51-I54 PolarHBondContact O-N 2.97Å; L51-L55 HydrophobicContact CD1-CG 4.28Å; L51-L55 HydrophobicContact CG-CD1 4.36Å; L51-L55 HydrophobicContact CG-CG 4.48Å; L51-L55 WeakPolarHBondContact O-CB 3.49Å; L51-L55 VanDerWaalsContact O-CG 3.29Å; L51-L55 WeakPolarHBondContact O-CG 3.32Å; L51-L55 PolarHBondContact O-N 3.23Å; L51-F180 HydrophobicContact CB-CD2 4.38Å; L51-F180 HydrophobicContact CD2-CB 3.72Å; L51-F180 HydrophobicContact CD2-CD2 3.36Å; L51-F180 HydrophobicContact CD2-CE2 4.14Å; L51-F180 HydrophobicContact CD2-CG 3.7Å |
| 52 | I | 95.1 | Very high | 94.5 | Very high | 21 Ų | 21 | 56 Ų | 56 | 11% | 0.108 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -59 | -46.3 | 171.1 | -73.7 | 176.3 | 0 | 0 | 0 | 110.5 | I2 F3 Q6 G48 A49 S50 L55 I56 T85 | I2-I52 HydrophobicContact CB-CG1 4.43Å; I2-I52 HydrophobicContact CG2-CD1 4.32Å; I2-I52 HydrophobicContact CG2-CG1 3.71Å; F3-I52 HydrophobicContact CD2-CD1 4.13Å; Q6-I52 HydrophobicContact CB-CD1 4.19Å; Q6-I52 HydrophobicContact CG-CD1 3.46Å; Q6-I52 VanDerWaalsContact CG-CD1 3.46Å; Q6-I52 HydrophobicContact CG-CG1 4.49Å; G48-I52 WeakPolarHBondContact O-CG1 3.29Å; G48-I52 PolarHBondContact O-N 3.22Å; A49-I52 WeakPolarHBondContact O-CB 3.49Å; A49-I52 PolarHBondContact O-N 2.89Å; S50-I52 VanDerWaalsContact C-N 3.34Å; S50-I52 PolarHBondContact O-N 3.37Å; I52-L55 PolarHBondContact O-N 3.35Å; I52-I56 HydrophobicContact CG2-CD1 3.59Å; I52-I56 HydrophobicContact CG2-CG1 4.24Å; I52-I56 WeakPolarHBondContact O-CB 3.38Å; I52-I56 VanDerWaalsContact O-CG1 3.32Å; I52-I56 WeakPolarHBondContact O-CG1 3.35Å; I52-I56 PolarHBondContact O-N 2.96Å; I52-T85 HydrophobicContact CG2-CG2 3.82Å |
| 53 | F | 95.2 | Very high | 94.4 | Very high | 38 Ų | 38 | 53.6 Ų | 53.6 | 17% | 0.167 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -61.8 | -45.7 | 177.8 | -80.3 | -77.1 | 0 | 0 | 0 | 112.5 | A49 S50 L51 L55 I56 Y57 T85 I86 A89 | A49-F53 WeakPolarHBondContact O-CD2 3.3Å; A49-F53 PolarHBondContact O-N 2.84Å; S50-F53 PolarHBondContact O-N 2.92Å; L51-F53 VanDerWaalsContact C-N 3.34Å; F53-L55 VanDerWaalsContact C-N 3.29Å; F53-L55 PolarHBondContact O-N 3.22Å; F53-I56 PolarHBondContact O-N 3.49Å; F53-Y57 HydrophobicContact CB-CD2 4.48Å; F53-Y57 HydrophobicContact CB-CE2 4Å; F53-Y57 HydrophobicContact CD1-CE1 4.45Å; F53-Y57 HydrophobicContact CD1-CE2 4.36Å; F53-Y57 AromaticContact CD1-CZ 3.9Å; F53-Y57 WeakPolarHBondContact O-CD2 3.27Å; F53-Y57 PolarHBondContact O-N 3.08Å; F53-T85 HydrophobicContact CE1-CG2 4.43Å; F53-T85 HydrophobicContact CZ-CG2 4.14Å; F53-I86 HydrophobicContact CE1-CG1 3.77Å; F53-I86 HydrophobicContact CZ-CG1 4.41Å; F53-A89 HydrophobicContact CE2-CB 3.45Å; F53-A89 VanDerWaalsContact CE2-CB 3.45Å; F53-A89 HydrophobicContact CZ-CB 3.48Å; F53-A89 VanDerWaalsContact CZ-CB 3.48Å |
| 54 | I | 94.8 | Very high | 94.3 | Very high | 91 Ų | 91 | 57.1 Ų | 57.1 | 47% | 0.467 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -56.3 | -46.7 | 176.4 | -65.9 | 168.4 | 0 | 0 | 0 | 110.5 | S50 L51 Y57 I58 | S50-I54 WeakPolarHBondContact O-CG1 3.33Å; S50-I54 PolarHBondContact O-N 3.5Å; S50-I54 VanDerWaalsContact O-N 3.1Å; L51-I54 HydrophobicContact CD1-CB 4.42Å; L51-I54 PolarHBondContact O-N 2.97Å; I54-Y57 PolarHBondContact O-N 3.32Å; I54-I58 HydrophobicContact CG2-CD1 3.9Å; I54-I58 VanDerWaalsContact O-CG1 3.32Å; I54-I58 WeakPolarHBondContact O-CG1 3.49Å; I54-I58 PolarHBondContact O-N 3.05Å |
| 55 | L | 95.3 | Very high | 94.2 | Very high | 42 Ų | 42 | 61.7 Ų | 61.7 | 22% | 0.22 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -67.5 | -38.4 | -179.9 | -70.1 | 178.6 | 0 | 0 | 0 | 113 | I2 L51 I52 F53 H59 K176 | I2-L55 HydrophobicContact CD1-CD1 3.69Å; I2-L55 HydrophobicContact CG1-CD1 4.34Å; L51-L55 HydrophobicContact CD1-CG 4.28Å; L51-L55 HydrophobicContact CG-CD1 4.36Å; L51-L55 HydrophobicContact CG-CG 4.48Å; L51-L55 WeakPolarHBondContact O-CB 3.49Å; L51-L55 VanDerWaalsContact O-CG 3.29Å; L51-L55 WeakPolarHBondContact O-CG 3.32Å; L51-L55 PolarHBondContact O-N 3.23Å; I52-L55 PolarHBondContact O-N 3.35Å; F53-L55 VanDerWaalsContact C-N 3.29Å; F53-L55 PolarHBondContact O-N 3.22Å; L55-H59 VanDerWaalsContact O-CB 3.32Å; L55-H59 WeakPolarHBondContact O-CB 3.47Å; L55-H59 PolarHBondContact O-N 2.92Å; L55-K176 HydrophobicContact CD1-CD 4.48Å; L55-K176 HydrophobicContact CD2-CD 3.9Å; L55-K176 HydrophobicContact CD2-CG 4.49Å |
| 56 | I | 96.5 | Very high | 93.9 | Very high | 31 Ų | 31 | 60.9 Ų | 60.9 | 16% | 0.159 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -65.2 | -43.1 | 175.1 | -70.6 | 173.4 | 0 | 0 | 0 | 109.9 | I52 F53 I58 H59 M60 L82 T85 | I52-I56 HydrophobicContact CG2-CD1 3.59Å; I52-I56 HydrophobicContact CG2-CG1 4.24Å; I52-I56 WeakPolarHBondContact O-CB 3.38Å; I52-I56 VanDerWaalsContact O-CG1 3.32Å; I52-I56 WeakPolarHBondContact O-CG1 3.35Å; I52-I56 PolarHBondContact O-N 2.96Å; F53-I56 PolarHBondContact O-N 3.49Å; I56-I58 PolarHBondContact O-N 2.92Å; I56-H59 CarbonylContact O-C 3.6Å; I56-H59 WeakPolarHBondContact O-CA 2.99Å; I56-H59 WeakPolarHBondContact O-CB 3.18Å; I56-H59 PolarHBondContact O-N 3.38Å; I56-H59 VanDerWaalsContact O-N 3.13Å; I56-M60 HydrophobicContact CG2-CG 4.25Å; I56-M60 VanDerWaalsContact O-CG 3.32Å; I56-M60 WeakPolarHBondContact O-CG 3.43Å; I56-M60 PolarHBondContact O-N 3.45Å; I56-L82 HydrophobicContact CG2-CB 4.48Å; I56-L82 HydrophobicContact CG2-CD1 3.59Å; I56-T85 HydrophobicContact CD1-CG2 3.75Å |
| 57 | Y | 96.5 | Very high | 93.7 | Very high | 130 Ų | 130 | 57.4 Ų | 57.4 | 51% | 0.51 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -64.1 | -42.8 | 177.8 | -62.9 | -33.2 | 0 | 0 | 0 | 112.6 | F53 I54 H59 M60 A61 L82 | F53-Y57 HydrophobicContact CB-CD2 4.48Å; F53-Y57 HydrophobicContact CB-CE2 4Å; F53-Y57 HydrophobicContact CD1-CE1 4.45Å; F53-Y57 HydrophobicContact CD1-CE2 4.36Å; F53-Y57 AromaticContact CD1-CZ 3.9Å; F53-Y57 WeakPolarHBondContact O-CD2 3.27Å; F53-Y57 PolarHBondContact O-N 3.08Å; I54-Y57 PolarHBondContact O-N 3.32Å; Y57-H59 VanDerWaalsContact C-N 3.27Å; Y57-H59 PolarHBondContact O-N 2.83Å; Y57-M60 PolarHBondContact O-N 3.11Å; Y57-A61 WeakPolarHBondContact O-CB 3.44Å; Y57-A61 PolarHBondContact O-N 3.18Å; Y57-L82 HydrophobicContact CE1-CD1 4.37Å |
| 58 | I | 95.5 | Very high | 93.4 | Very high | 105 Ų | 105 | 56.9 Ų | 56.9 | 54% | 0.538 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -60.8 | -39.9 | 172.7 | -67.2 | 167.5 | 0 | 0 | 0 | 110.6 | I54 I56 K62 | I54-I58 HydrophobicContact CG2-CD1 3.9Å; I54-I58 VanDerWaalsContact O-CG1 3.32Å; I54-I58 WeakPolarHBondContact O-CG1 3.49Å; I54-I58 PolarHBondContact O-N 3.05Å; I56-I58 PolarHBondContact O-N 2.92Å; I58-K62 WeakPolarHBondContact O-CB 3.48Å; I58-K62 PolarHBondContact O-N 2.89Å |
| 59 | H | 94.5 | Very high | 93.2 | Very high | 105 Ų | 105 | 61.5 Ų | 61.5 | 49% | 0.486 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -63.4 | -45.2 | 176.9 | -173.2 | 88 | 0 | 0 | 0 | 111.9 | L55 I56 Y57 K62 A63 | L55-H59 VanDerWaalsContact O-CB 3.32Å; L55-H59 WeakPolarHBondContact O-CB 3.47Å; L55-H59 PolarHBondContact O-N 2.92Å; I56-H59 CarbonylContact O-C 3.6Å; I56-H59 WeakPolarHBondContact O-CA 2.99Å; I56-H59 WeakPolarHBondContact O-CB 3.18Å; I56-H59 PolarHBondContact O-N 3.38Å; I56-H59 VanDerWaalsContact O-N 3.13Å; Y57-H59 VanDerWaalsContact C-N 3.27Å; Y57-H59 PolarHBondContact O-N 2.83Å; H59-K62 PolarHBondContact O-N 3.09Å; H59-A63 WeakPolarHBondContact O-CB 3.49Å; H59-A63 PolarHBondContact O-N 3.08Å |
| 60 | M | 95.6 | Very high | 92.8 | Very high | 30 Ų | 30 | 68.3 Ų | 68.3 | 15% | 0.148 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -64 | -45.5 | 177 | -68.8 | -59.1 | -74.2 | 0 | 0 | 111.6 | I56 Y57 K62 A63 L64 W75 N79 L82 | I56-M60 HydrophobicContact CG2-CG 4.25Å; I56-M60 VanDerWaalsContact O-CG 3.32Å; I56-M60 WeakPolarHBondContact O-CG 3.43Å; I56-M60 PolarHBondContact O-N 3.45Å; Y57-M60 PolarHBondContact O-N 3.11Å; M60-K62 PolarHBondContact O-N 2.78Å; M60-A63 PolarHBondContact O-N 3.44Å; M60-A63 VanDerWaalsContact O-N 3.14Å; M60-L64 WeakPolarHBondContact O-CG 3.1Å; M60-L64 PolarHBondContact O-N 2.93Å; M60-W75 HydrophobicContact CE-CH2 3.3Å; M60-W75 HydrophobicContact CE-CZ2 3.83Å; M60-W75 HydrophobicContact CE-CZ3 3.77Å; M60-W75 HydrophobicContact SD-CH2 4.29Å; M60-W75 HydrophobicContact SD-CZ3 4.21Å; M60-N79 VanDerWaalsContact CE-OD1 3.28Å; M60-N79 WeakPolarHBondContact CE-OD1 3.43Å; M60-L82 HydrophobicContact CE-CD2 4.26Å |
| 61 | A | 95.1 | Very high | 92.7 | Very high | 48 Ų | 48 | 67 Ų | 67 | 40% | 0.397 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -58.1 | -47.7 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.4 | Y57 A63 L64 L65 | Y57-A61 WeakPolarHBondContact O-CB 3.44Å; Y57-A61 PolarHBondContact O-N 3.18Å; A61-A63 VanDerWaalsContact C-N 3.32Å; A61-A63 PolarHBondContact O-N 3.35Å; A61-L64 PolarHBondContact O-N 3.07Å; A61-L65 VanDerWaalsContact O-CG 3.29Å; A61-L65 WeakPolarHBondContact O-CG 3.24Å; A61-L65 PolarHBondContact O-N 2.66Å |
| 62 | K | 92 | Very high | 92.6 | Very high | 96 Ų | 96 | 71 Ų | 71 | 42% | 0.417 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -60.5 | -40.9 | 175.4 | 179.2 | -176.3 | 171.7 | -172.3 | 0 | 112.4 | I58 H59 M60 L64 L65 N66 | I58-K62 WeakPolarHBondContact O-CB 3.48Å; I58-K62 PolarHBondContact O-N 2.89Å; H59-K62 PolarHBondContact O-N 3.09Å; M60-K62 PolarHBondContact O-N 2.78Å; K62-L64 VanDerWaalsContact C-N 3.34Å; K62-L65 PolarHBondContact O-N 3.2Å; K62-N66 WeakPolarHBondContact O-CB 3.39Å; K62-N66 PolarHBondContact O-N 3.43Å |
| 63 | A | 91.8 | Very high | 92.4 | Very high | 12 Ų | 12 | 73 Ų | 73 | 10% | 0.099 | 36% | 0.361 | C | S | . | . | H | α-helix | trans | -65.3 | -38.6 | 179.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | H59 M60 A61 C67 S68 W75 | H59-A63 WeakPolarHBondContact O-CB 3.49Å; H59-A63 PolarHBondContact O-N 3.08Å; M60-A63 PolarHBondContact O-N 3.44Å; M60-A63 VanDerWaalsContact O-N 3.14Å; A61-A63 VanDerWaalsContact C-N 3.32Å; A61-A63 PolarHBondContact O-N 3.35Å; A63-C67 PolarHBondContact O-N 2.87Å; A63-S68 VanDerWaalsContact O-CB 3.31Å; A63-S68 WeakPolarHBondContact O-CB 3.37Å; A63-S68 PolarHBondContact O-N 3.16Å; A63-S68 PolarHBondContact O-OG 2.77Å; A63-W75 HydrophobicContact CB-CE3 4.47Å; A63-W75 HydrophobicContact CB-CZ3 3.77Å |
| 64 | L | 92.2 | Very high | 92.3 | Very high | 91 Ų | 91 | 72 Ų | 72 | 48% | 0.476 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -65.9 | -48.9 | 173.7 | -69.1 | 171.8 | 0 | 0 | 0 | 111.8 | M60 A61 K62 N66 C67 Y69 W75 | M60-L64 WeakPolarHBondContact O-CG 3.1Å; M60-L64 PolarHBondContact O-N 2.93Å; A61-L64 PolarHBondContact O-N 3.07Å; K62-L64 VanDerWaalsContact C-N 3.34Å; L64-N66 VanDerWaalsContact C-N 3.27Å; L64-N66 PolarHBondContact O-N 3.41Å; L64-C67 PolarHBondContact O-N 3.14Å; L64-Y69 HydrophobicContact CD2-CD1 4.08Å; L64-W75 HydrophobicContact CD2-CH2 3.62Å; L64-W75 HydrophobicContact CD2-CZ2 4Å; L64-W75 HydrophobicContact CD2-CZ3 4.49Å; L64-W75 HydrophobicContact CG-CH2 3.98Å |
| 65 | L | 92.3 | Very high | 92.2 | Very high | 143 Ų | 143 | 70.6 Ų | 70.6 | 75% | 0.749 | 35% | 0.345 | S | S | * | . | H | α-helix | trans | -58.7 | -38.1 | 179 | -70.4 | 171.6 | 0 | 0 | 0 | 112.3 | A61 K62 C67 | A61-L65 VanDerWaalsContact O-CG 3.29Å; A61-L65 WeakPolarHBondContact O-CG 3.24Å; A61-L65 PolarHBondContact O-N 2.66Å; K62-L65 PolarHBondContact O-N 3.2Å; L65-C67 VanDerWaalsContact C-N 3.27Å; L65-C67 PolarHBondContact O-N 2.69Å |
| 66 | N | 88.6 | Confident | 92.2 | Very high | 22 Ų | 22 | 73.1 Ų | 73.1 | 12% | 0.118 | 36% | 0.358 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -87.7 | 13.6 | 178.9 | -64.4 | -11.5 | 0 | 0 | 0 | 113.5 | K62 L64 S68 | K62-N66 WeakPolarHBondContact O-CB 3.39Å; K62-N66 PolarHBondContact O-N 3.43Å; L64-N66 VanDerWaalsContact C-N 3.27Å; L64-N66 PolarHBondContact O-N 3.41Å; N66-S68 PolarHBondContact O-N 3.42Å |
| 67 | C | 88.9 | Confident | 92.3 | Very high | 38 Ų | 38 | 72.2 Ų | 72.2 | 26% | 0.257 | 35% | 0.354 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 49.4 | 32.3 | -175.4 | -67.7 | 0 | 0 | 0 | 0 | 114.3 | A63 L64 L65 Y69 R70 | A63-C67 PolarHBondContact O-N 2.87Å; L64-C67 PolarHBondContact O-N 3.14Å; L65-C67 VanDerWaalsContact C-N 3.27Å; L65-C67 PolarHBondContact O-N 2.69Å; C67-Y69 HydrophobicContact CB-CE1 4.18Å; C67-Y69 PolarHBondContact O-N 2.88Å; C67-R70 WeakPolarHBondContact O-CG 3.36Å; C67-R70 PolarHBondContact O-N 3.41Å |
| 68 | S | 87.1 | Confident | 92.3 | Very high | 20 Ų | 20 | 66.7 Ų | 66.7 | 14% | 0.14 | 34% | 0.336 | C | S | . | . | G | 310 helix | trans | -71.7 | -15.7 | -173 | -58.4 | 0 | 0 | 0 | 0 | 112.9 | A63 N66 R70 L71 S147 | A63-S68 VanDerWaalsContact O-CB 3.31Å; A63-S68 WeakPolarHBondContact O-CB 3.37Å; A63-S68 PolarHBondContact O-N 3.16Å; A63-S68 PolarHBondContact O-OG 2.77Å; N66-S68 PolarHBondContact O-N 3.42Å; S68-R70 PolarHBondContact O-N 3.17Å; S68-L71 PolarHBondContact O-N 2.98Å; S68-S147 PolarHBondContact OG-OG 3.18Å |
| 69 | Y | 88.6 | Confident | 92.4 | Very high | 98 Ų | 98 | 63.6 Ų | 63.6 | 38% | 0.384 | 32% | 0.321 | S | S | . | . | G | 310 helix | trans | -62 | -18.4 | 173.9 | 59.5 | -99.7 | 0 | 0 | 0 | 113.6 | L64 C67 L71 | L64-Y69 HydrophobicContact CD2-CD1 4.08Å; C67-Y69 HydrophobicContact CB-CE1 4.18Å; C67-Y69 PolarHBondContact O-N 2.88Å; Y69-L71 PolarHBondContact O-N 3.4Å |
| 70 | R | 87.4 | Confident | 92.5 | Very high | 178 Ų | 178 | 62.3 Ų | 62.3 | 67% | 0.672 | 32% | 0.317 | S | S | * | . | G | 310 helix | trans | -59.5 | -26.6 | 174.9 | -68.4 | -179.9 | 179.2 | -152.6 | 0.6 | 112.8 | C67 S68 I72 | C67-R70 WeakPolarHBondContact O-CG 3.36Å; C67-R70 PolarHBondContact O-N 3.41Å; S68-R70 PolarHBondContact O-N 3.17Å; R70-I72 PolarHBondContact O-N 3.48Å |
| 71 | L | 89.4 | Confident | 92.6 | Very high | 38 Ų | 38 | 62.2 Ų | 62.2 | 20% | 0.199 | 32% | 0.316 | C | S | . | . | S | Bend | trans | -91.7 | 85.6 | 172 | -78.2 | 166 | 0 | 0 | 0 | 109.8 | S68 Y69 T73 R74 W75 N144 H153 | S68-L71 PolarHBondContact O-N 2.98Å; Y69-L71 PolarHBondContact O-N 3.4Å; L71-T73 VanDerWaalsContact C-N 3.32Å; L71-T73 PolarHBondContact O-N 2.9Å; L71-R74 HydrophobicContact CB-CB 4.45Å; L71-R74 HydrophobicContact CB-CG 4.49Å; L71-R74 WeakPolarHBondContact O-CB 3.42Å; L71-R74 PolarHBondContact O-N 3.3Å; L71-R74 VanDerWaalsContact O-N 3.08Å; L71-W75 PolarHBondContact O-N 3.49Å; L71-N144 HydrophobicContact CD1-CB 3.77Å; L71-N144 HydrophobicContact CD2-CB 4.12Å; L71-H153 WeakPolarHBondContact CD1-CE1 3.29Å; L71-H153 WeakPolarHBondContact CD1-NE2 3.27Å |
| 72 | I | 91.4 | Very high | 92.7 | Very high | 114 Ų | 114 | 61.3 Ų | 61.3 | 59% | 0.585 | 31% | 0.305 | S | S | * | . | H | α-helix | trans | -53.3 | -44.3 | -169.2 | -64.2 | 166.3 | 0 | 0 | 0 | 112.1 | R70 R74 W75 L76 | R70-I72 PolarHBondContact O-N 3.48Å; I72-R74 PolarHBondContact O-N 3.43Å; I72-W75 PolarHBondContact O-N 2.95Å; I72-L76 HydrophobicContact CG2-CD1 3.6Å; I72-L76 HydrophobicContact CG2-CG 4.02Å; I72-L76 WeakPolarHBondContact O-CB 3.47Å; I72-L76 VanDerWaalsContact O-CG 3.27Å; I72-L76 WeakPolarHBondContact O-CG 3.27Å; I72-L76 PolarHBondContact O-N 3.19Å |
| 73 | T | 92.2 | Very high | 93 | Very high | 64 Ų | 64 | 62.2 Ų | 62.2 | 39% | 0.393 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -63.4 | -39.5 | -179.3 | 53.2 | 0 | 0 | 0 | 0 | 113 | L71 T77 | L71-T73 VanDerWaalsContact C-N 3.32Å; L71-T73 PolarHBondContact O-N 2.9Å; T73-T77 WeakPolarHBondContact O-CG2 3.38Å; T73-T77 PolarHBondContact O-N 3.07Å; T73-T77 PolarHBondContact O-OG1 3.16Å |
| 74 | R | 91.5 | Very high | 93.2 | Very high | 17 Ų | 17 | 63.3 Ų | 63.3 | 6% | 0.064 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -68.9 | -43.1 | 174.2 | -65.2 | -169.1 | -53.9 | 170.1 | 2.9 | 111.4 | L71 I72 T77 G78 H137 F140 G145 | L71-R74 HydrophobicContact CB-CB 4.45Å; L71-R74 HydrophobicContact CB-CG 4.49Å; L71-R74 WeakPolarHBondContact O-CB 3.42Å; L71-R74 PolarHBondContact O-N 3.3Å; L71-R74 VanDerWaalsContact O-N 3.08Å; I72-R74 PolarHBondContact O-N 3.43Å; R74-T77 PolarHBondContact O-OG1 2.96Å; R74-G78 PolarHBondContact O-N 3.45Å; R74-H137 PolarHBondContact O-CE1 3.31Å; R74-H137 PolarHBondContact O-ND1 2.98Å; R74-H137 VanDerWaalsContact O-ND1 3.1Å; R74-F140 WeakPolarHBondContact CD-O 3.5Å; R74-F140 HydrophobicContact CG-CB 3.54Å; R74-G145 PolarHBondContact NH1-O 3.16Å |
| 75 | W | 93.8 | Very high | 93.4 | Very high | 60 Ų | 60 | 59.5 Ų | 59.5 | 23% | 0.227 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -63.8 | -46.1 | 179.8 | -175 | -114.5 | 0 | 0 | 0 | 112 | M60 A63 L64 L71 I72 G78 N79 | M60-W75 HydrophobicContact CE-CH2 3.3Å; M60-W75 HydrophobicContact CE-CZ2 3.83Å; M60-W75 HydrophobicContact CE-CZ3 3.77Å; M60-W75 HydrophobicContact SD-CH2 4.29Å; M60-W75 HydrophobicContact SD-CZ3 4.21Å; A63-W75 HydrophobicContact CB-CE3 4.47Å; A63-W75 HydrophobicContact CB-CZ3 3.77Å; L64-W75 HydrophobicContact CD2-CH2 3.62Å; L64-W75 HydrophobicContact CD2-CZ2 4Å; L64-W75 HydrophobicContact CD2-CZ3 4.49Å; L64-W75 HydrophobicContact CG-CH2 3.98Å; L71-W75 PolarHBondContact O-N 3.49Å; I72-W75 PolarHBondContact O-N 2.95Å; W75-G78 PolarHBondContact O-N 3.12Å; W75-N79 VanDerWaalsContact CD1-ND2 3.26Å; W75-N79 PolarHBondContact NE1-ND2 2.86Å; W75-N79 PolarHBondContact O-N 2.96Å; W75-N79 PolarHBondContact O-ND2 3.41Å |
| 76 | L | 96.2 | Very high | 93.5 | Very high | 95 Ų | 95 | 56 Ų | 56 | 50% | 0.497 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -60.6 | -47.8 | 178.2 | -74.6 | 173.6 | 0 | 0 | 0 | 111.8 | I72 G78 N79 I80 | I72-L76 HydrophobicContact CG2-CD1 3.6Å; I72-L76 HydrophobicContact CG2-CG 4.02Å; I72-L76 WeakPolarHBondContact O-CB 3.47Å; I72-L76 VanDerWaalsContact O-CG 3.27Å; I72-L76 WeakPolarHBondContact O-CG 3.27Å; I72-L76 PolarHBondContact O-N 3.19Å; L76-G78 VanDerWaalsContact C-N 3.29Å; L76-G78 PolarHBondContact O-N 2.95Å; L76-N79 PolarHBondContact O-N 3.18Å; L76-I80 VanDerWaalsContact O-CG1 3.3Å; L76-I80 WeakPolarHBondContact O-CG1 3.25Å; L76-I80 PolarHBondContact O-N 2.95Å |
| 77 | T | 97.1 | Very high | 93.7 | Very high | 13 Ų | 13 | 57.9 Ų | 57.9 | 8% | 0.08 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -61.8 | -37.4 | 176.3 | 46.9 | 0 | 0 | 0 | 0 | 112.3 | T73 R74 I80 I81 I136 H137 F140 | T73-T77 WeakPolarHBondContact O-CG2 3.38Å; T73-T77 PolarHBondContact O-N 3.07Å; T73-T77 PolarHBondContact O-OG1 3.16Å; R74-T77 PolarHBondContact O-OG1 2.96Å; T77-I80 PolarHBondContact O-N 3.37Å; T77-I81 WeakPolarHBondContact O-CG1 3.38Å; T77-I81 PolarHBondContact O-N 2.87Å; T77-I81 VanDerWaalsContact O-N 3.07Å; T77-I136 HydrophobicContact CG2-CG2 4.12Å; T77-H137 PolarHBondContact OG1-ND1 2.85Å; T77-F140 HydrophobicContact CG2-CD2 3.79Å; T77-F140 HydrophobicContact CG2-CE2 3.65Å |
| 78 | G | 96.5 | Very high | 93.9 | Very high | 13 Ų | 13 | 57 Ų | 57 | 13% | 0.134 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -63 | -43.7 | 173.5 | 0 | 0 | 0 | 0 | 0 | 113 | R74 W75 L76 I80 I81 L82 H137 | R74-G78 PolarHBondContact O-N 3.45Å; W75-G78 PolarHBondContact O-N 3.12Å; L76-G78 VanDerWaalsContact C-N 3.29Å; L76-G78 PolarHBondContact O-N 2.95Å; G78-I80 PolarHBondContact O-N 3.25Å; G78-I81 PolarHBondContact O-N 3.17Å; G78-L82 PolarHBondContact O-N 2.87Å; G78-H137 PolarHBondContact N-ND1 3.23Å |
| 79 | N | 97.2 | Very high | 94 | Very high | 40 Ų | 40 | 57.6 Ų | 57.6 | 21% | 0.214 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -64.6 | -38.7 | 175.8 | -71.1 | -39.2 | 0 | 0 | 0 | 112.2 | M60 W75 L76 I81 L82 L83 | M60-N79 VanDerWaalsContact CE-OD1 3.28Å; M60-N79 WeakPolarHBondContact CE-OD1 3.43Å; W75-N79 VanDerWaalsContact CD1-ND2 3.26Å; W75-N79 PolarHBondContact NE1-ND2 2.86Å; W75-N79 PolarHBondContact O-N 2.96Å; W75-N79 PolarHBondContact O-ND2 3.41Å; L76-N79 PolarHBondContact O-N 3.18Å; N79-I81 VanDerWaalsContact C-N 3.33Å; N79-I81 PolarHBondContact O-N 2.85Å; N79-L82 WeakPolarHBondContact O-CB 3.22Å; N79-L82 PolarHBondContact O-N 3.32Å; N79-L83 WeakPolarHBondContact O-CG 3.34Å; N79-L83 PolarHBondContact O-N 3.27Å |
| 80 | I | 98 | Very high | 93.8 | Very high | 78 Ų | 78 | 54.6 Ų | 54.6 | 40% | 0.4 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -62.3 | -42.7 | 175.3 | -66.1 | 164.1 | 0 | 0 | 0 | 110.4 | L76 T77 G78 L82 L83 L84 I133 | L76-I80 VanDerWaalsContact O-CG1 3.3Å; L76-I80 WeakPolarHBondContact O-CG1 3.25Å; L76-I80 PolarHBondContact O-N 2.95Å; T77-I80 PolarHBondContact O-N 3.37Å; G78-I80 PolarHBondContact O-N 3.25Å; I80-L82 PolarHBondContact O-N 3Å; I80-L83 PolarHBondContact O-N 3.18Å; I80-L84 HydrophobicContact CG2-CD1 4.14Å; I80-L84 HydrophobicContact CG2-CG 4.37Å; I80-L84 WeakPolarHBondContact O-CB 3.5Å; I80-L84 WeakPolarHBondContact O-CG 3.39Å; I80-L84 PolarHBondContact O-N 3.41Å; I80-I133 HydrophobicContact CG2-CD1 3.53Å; I80-I133 HydrophobicContact CG2-CG2 4.27Å |
| 81 | I | 98 | Very high | 93.7 | Very high | 28 Ų | 28 | 47.1 Ų | 47.1 | 14% | 0.144 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -60.4 | -45.1 | 174.9 | -67.9 | 164.3 | 0 | 0 | 0 | 111 | T77 G78 N79 L84 T85 I130 I133 A134 H137 | T77-I81 WeakPolarHBondContact O-CG1 3.38Å; T77-I81 PolarHBondContact O-N 2.87Å; T77-I81 VanDerWaalsContact O-N 3.07Å; G78-I81 PolarHBondContact O-N 3.17Å; N79-I81 VanDerWaalsContact C-N 3.33Å; N79-I81 PolarHBondContact O-N 2.85Å; I81-L84 PolarHBondContact O-N 3Å; I81-T85 WeakPolarHBondContact O-CB 3.33Å; I81-T85 PolarHBondContact O-N 3.44Å; I81-T85 PolarHBondContact O-OG1 3.41Å; I81-I130 HydrophobicContact CG2-CG2 4.16Å; I81-I133 HydrophobicContact CD1-CG2 4.16Å; I81-I133 HydrophobicContact CG1-CB 4.19Å; I81-I133 HydrophobicContact CG1-CG2 3.68Å; I81-A134 HydrophobicContact CD1-CB 4.25Å; I81-H137 HydrophobicContact CD1-CB 3.78Å |
| 82 | L | 97.1 | Very high | 93.2 | Very high | 30 Ų | 30 | 48.6 Ų | 48.6 | 16% | 0.157 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -58.4 | -50.1 | 176.3 | 170.9 | 64.6 | 0 | 0 | 0 | 111.2 | I56 Y57 M60 G78 N79 I80 L84 T85 I86 | I56-L82 HydrophobicContact CG2-CB 4.48Å; I56-L82 HydrophobicContact CG2-CD1 3.59Å; Y57-L82 HydrophobicContact CE1-CD1 4.37Å; M60-L82 HydrophobicContact CE-CD2 4.26Å; G78-L82 PolarHBondContact O-N 2.87Å; N79-L82 WeakPolarHBondContact O-CB 3.22Å; N79-L82 PolarHBondContact O-N 3.32Å; I80-L82 PolarHBondContact O-N 3Å; L82-L84 PolarHBondContact O-N 3.34Å; L82-T85 PolarHBondContact O-N 3.23Å; L82-I86 HydrophobicContact CD1-CD1 3.88Å; L82-I86 HydrophobicContact CD1-CG1 4.23Å; L82-I86 HydrophobicContact CG-CD1 3.96Å; L82-I86 WeakPolarHBondContact O-CG1 3.45Å; L82-I86 PolarHBondContact O-N 3.1Å |
| 83 | L | 97.1 | Very high | 92.2 | Very high | 115 Ų | 115 | 45 Ų | 45 | 60% | 0.602 | 26% | 0.256 | S | S | * | . | H | α-helix | trans | -62.5 | -43.5 | -179 | -71.5 | 172 | 0 | 0 | 0 | 112.2 | N79 I80 T85 I86 L87 | N79-L83 WeakPolarHBondContact O-CG 3.34Å; N79-L83 PolarHBondContact O-N 3.27Å; I80-L83 PolarHBondContact O-N 3.18Å; L83-T85 VanDerWaalsContact C-N 3.32Å; L83-T85 PolarHBondContact O-N 3.04Å; L83-I86 PolarHBondContact O-N 3.02Å; L83-L87 WeakPolarHBondContact O-CB 3.4Å; L83-L87 PolarHBondContact O-N 3.07Å |
| 84 | L | 97.3 | Very high | 90.8 | Very high | 34 Ų | 34 | 47.1 Ų | 47.1 | 18% | 0.178 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -65 | -37.3 | 175.2 | -71.2 | 179.5 | 0 | 0 | 0 | 112.1 | I80 I81 L82 L87 V88 I126 V129 I130 I133 | I80-L84 HydrophobicContact CG2-CD1 4.14Å; I80-L84 HydrophobicContact CG2-CG 4.37Å; I80-L84 WeakPolarHBondContact O-CB 3.5Å; I80-L84 WeakPolarHBondContact O-CG 3.39Å; I80-L84 PolarHBondContact O-N 3.41Å; I81-L84 PolarHBondContact O-N 3Å; L82-L84 PolarHBondContact O-N 3.34Å; L84-L87 HydrophobicContact CD2-CD2 4.47Å; L84-L87 WeakPolarHBondContact O-CB 3.28Å; L84-L87 PolarHBondContact O-N 3.41Å; L84-V88 WeakPolarHBondContact O-CG2 3.48Å; L84-V88 PolarHBondContact O-N 2.8Å; L84-I126 HydrophobicContact CB-CG2 4.1Å; L84-I126 HydrophobicContact CD2-CG2 4.09Å; L84-V129 HydrophobicContact CD1-CG1 4.11Å; L84-I130 HydrophobicContact CB-CD1 3.93Å; L84-I130 HydrophobicContact CB-CG1 3.66Å; L84-I130 HydrophobicContact CD1-CG1 4.06Å; L84-I133 HydrophobicContact CD1-CD1 3.5Å |
| 85 | T | 96.4 | Very high | 89.1 | Confident | 12 Ų | 12 | 51.4 Ų | 51.4 | 7% | 0.074 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -66.8 | -40.3 | 177.3 | -53.7 | 0 | 0 | 0 | 0 | 111.3 | I52 F53 I56 I81 L82 L83 V88 A89 | I52-T85 HydrophobicContact CG2-CG2 3.82Å; F53-T85 HydrophobicContact CE1-CG2 4.43Å; F53-T85 HydrophobicContact CZ-CG2 4.14Å; I56-T85 HydrophobicContact CD1-CG2 3.75Å; I81-T85 WeakPolarHBondContact O-CB 3.33Å; I81-T85 PolarHBondContact O-N 3.44Å; I81-T85 PolarHBondContact O-OG1 3.41Å; L82-T85 PolarHBondContact O-N 3.23Å; L83-T85 VanDerWaalsContact C-N 3.32Å; L83-T85 PolarHBondContact O-N 3.04Å; T85-V88 PolarHBondContact O-N 3.08Å; T85-A89 PolarHBondContact O-N 2.83Å; T85-A89 VanDerWaalsContact O-N 3.13Å |
| 86 | I | 94.2 | Very high | 87.5 | Confident | 70 Ų | 70 | 52.1 Ų | 52.1 | 36% | 0.359 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -60.1 | -46.3 | 170.8 | -67.3 | 164.8 | 0 | 0 | 0 | 110.2 | F53 L82 L83 V88 A89 F90 | F53-I86 HydrophobicContact CE1-CG1 3.77Å; F53-I86 HydrophobicContact CZ-CG1 4.41Å; L82-I86 HydrophobicContact CD1-CD1 3.88Å; L82-I86 HydrophobicContact CD1-CG1 4.23Å; L82-I86 HydrophobicContact CG-CD1 3.96Å; L82-I86 WeakPolarHBondContact O-CG1 3.45Å; L82-I86 PolarHBondContact O-N 3.1Å; L83-I86 PolarHBondContact O-N 3.02Å; I86-V88 PolarHBondContact O-N 3.25Å; I86-A89 PolarHBondContact O-N 3.43Å; I86-F90 WeakPolarHBondContact O-CB 3.3Å; I86-F90 PolarHBondContact O-N 2.95Å |
| 87 | L | 91.9 | Very high | 85.8 | Confident | 60 Ų | 60 | 48.1 Ų | 48.1 | 31% | 0.314 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -60.3 | -42.7 | -179.8 | -177.2 | 61.4 | 0 | 0 | 0 | 112.4 | L83 L84 F90 M91 I126 | L83-L87 WeakPolarHBondContact O-CB 3.4Å; L83-L87 PolarHBondContact O-N 3.07Å; L84-L87 HydrophobicContact CD2-CD2 4.47Å; L84-L87 WeakPolarHBondContact O-CB 3.28Å; L84-L87 PolarHBondContact O-N 3.41Å; L87-F90 WeakPolarHBondContact O-CB 3.41Å; L87-F90 PolarHBondContact O-N 3.25Å; L87-M91 HydrophobicContact CD1-CE 3.85Å; L87-M91 HydrophobicContact CD2-CE 4.28Å; L87-M91 HydrophobicContact CG-CE 3.87Å; L87-M91 WeakPolarHBondContact O-CG 3.5Å; L87-M91 PolarHBondContact O-N 2.91Å; L87-M91 VanDerWaalsContact O-N 3.07Å; L87-I126 HydrophobicContact CD2-CD1 3.79Å; L87-I126 HydrophobicContact CG-CD1 4.07Å |
| 88 | V | 93.6 | Very high | 84.3 | Confident | 20 Ų | 20 | 50.1 Ų | 50.1 | 12% | 0.121 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -60.8 | -48.8 | 175.4 | 171.4 | 0 | 0 | 0 | 0 | 111 | L84 T85 I86 F90 M91 H123 I126 P127 I130 | L84-V88 WeakPolarHBondContact O-CG2 3.48Å; L84-V88 PolarHBondContact O-N 2.8Å; T85-V88 PolarHBondContact O-N 3.08Å; I86-V88 PolarHBondContact O-N 3.25Å; V88-F90 VanDerWaalsContact C-N 3.31Å; V88-F90 PolarHBondContact O-N 3.32Å; V88-M91 PolarHBondContact O-N 3.47Å; V88-H123 WeakPolarHBondContact CG1-ND1 3.38Å; V88-H123 PolarHBondContact O-CE1 3.07Å; V88-H123 PolarHBondContact O-ND1 2.81Å; V88-I126 HydrophobicContact CG2-CB 3.58Å; V88-I126 HydrophobicContact CG2-CD1 4.5Å; V88-I126 HydrophobicContact CG2-CG2 3.34Å; V88-P127 HydrophobicContact CG1-CG 4.19Å; V88-P127 HydrophobicContact CG2-CG 4.21Å; V88-I130 HydrophobicContact CG2-CD1 4.13Å |
| 89 | A | 89.8 | Confident | 82.9 | Confident | 33 Ų | 33 | 56.8 Ų | 56.8 | 27% | 0.273 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -65.5 | -37.7 | -179.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | F53 T85 I86 M91 A92 A93 | F53-A89 HydrophobicContact CE2-CB 3.45Å; F53-A89 VanDerWaalsContact CE2-CB 3.45Å; F53-A89 HydrophobicContact CZ-CB 3.48Å; F53-A89 VanDerWaalsContact CZ-CB 3.48Å; T85-A89 PolarHBondContact O-N 2.83Å; T85-A89 VanDerWaalsContact O-N 3.13Å; I86-A89 PolarHBondContact O-N 3.43Å; A89-M91 VanDerWaalsContact C-N 3.34Å; A89-M91 PolarHBondContact O-N 3.48Å; A89-A92 WeakPolarHBondContact O-CB 3.5Å; A89-A92 PolarHBondContact O-N 2.97Å; A89-A92 VanDerWaalsContact O-N 3.08Å; A89-A93 PolarHBondContact O-N 3.45Å |
| 90 | F | 84.4 | Confident | 81.4 | Confident | 35 Ų | 35 | 57 Ų | 57 | 15% | 0.154 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -58.6 | -44.9 | 175.6 | 176.5 | -77.1 | 0 | 0 | 0 | 111.7 | I86 L87 V88 A92 A93 I96 T97 L100 | I86-F90 WeakPolarHBondContact O-CB 3.3Å; I86-F90 PolarHBondContact O-N 2.95Å; L87-F90 WeakPolarHBondContact O-CB 3.41Å; L87-F90 PolarHBondContact O-N 3.25Å; V88-F90 VanDerWaalsContact C-N 3.31Å; V88-F90 PolarHBondContact O-N 3.32Å; F90-A92 PolarHBondContact O-N 2.92Å; F90-A92 VanDerWaalsContact O-N 3.09Å; F90-A93 PolarHBondContact O-N 3.01Å; F90-I96 HydrophobicContact CD2-CB 3.82Å; F90-I96 HydrophobicContact CD2-CD1 4.29Å; F90-I96 HydrophobicContact CD2-CG2 3.75Å; F90-I96 HydrophobicContact CE2-CB 3.41Å; F90-I96 VanDerWaalsContact CE2-CB 3.41Å; F90-I96 HydrophobicContact CE2-CG2 2.99Å; F90-I96 VanDerWaalsContact CZ-C 3.45Å; F90-I96 HydrophobicContact CZ-CB 3.76Å; F90-I96 HydrophobicContact CZ-CG2 3.55Å; F90-I96 WeakPolarHBondContact CZ-O 3.46Å; F90-T97 WeakPolarHBondContact O-CG2 3.42Å; F90-L100 HydrophobicContact CD1-CD2 4.42Å; F90-L100 HydrophobicContact CE1-CB 3.79Å; F90-L100 HydrophobicContact CE1-CD1 3.52Å; F90-L100 HydrophobicContact CE1-CD2 3.77Å; F90-L100 HydrophobicContact CE1-CG 3.86Å; F90-L100 HydrophobicContact CE2-CD1 4.09Å; F90-L100 HydrophobicContact CZ-CB 3.99Å; F90-L100 HydrophobicContact CZ-CD1 3.25Å; F90-L100 HydrophobicContact CZ-CD2 4.39Å; F90-L100 HydrophobicContact CZ-CG 4.03Å |
| 91 | M | 85.5 | Confident | 79.7 | Confident | 20 Ų | 20 | 53.3 Ų | 53.3 | 10% | 0.099 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -62.1 | -17.3 | 178.2 | -72.7 | 175.2 | 180 | 0 | 0 | 113.2 | L87 V88 A89 F119 F122 H123 I126 | L87-M91 HydrophobicContact CD1-CE 3.85Å; L87-M91 HydrophobicContact CD2-CE 4.28Å; L87-M91 HydrophobicContact CG-CE 3.87Å; L87-M91 WeakPolarHBondContact O-CG 3.5Å; L87-M91 PolarHBondContact O-N 2.91Å; L87-M91 VanDerWaalsContact O-N 3.07Å; V88-M91 PolarHBondContact O-N 3.47Å; A89-M91 VanDerWaalsContact C-N 3.34Å; A89-M91 PolarHBondContact O-N 3.48Å; M91-F119 HydrophobicContact CB-CB 4.19Å; M91-F119 HydrophobicContact CG-CB 4.37Å; M91-F119 HydrophobicContact CG-CD1 4.07Å; M91-F119 HydrophobicContact CG-CG 4.34Å; M91-F122 HydrophobicContact CE-CB 3.64Å; M91-F122 HydrophobicContact CE-CG 4.35Å; M91-F122 HydrophobicContact SD-CB 3.49Å; M91-F122 WeakPolarHBondContact SD-CB 3.42Å; M91-H123 HydrophobicContact CB-CB 4.25Å; M91-I126 HydrophobicContact CE-CD1 3.76Å; M91-I126 HydrophobicContact SD-CD1 3.93Å |
| 92 | A | 79 | Confident | 78.3 | Confident | 70 Ų | 70 | 54.1 Ų | 54.1 | 58% | 0.579 | 32% | 0.317 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -92.6 | -9.3 | 176.2 | 0 | 0 | 0 | 0 | 0 | 114.1 | A89 F90 | A89-A92 WeakPolarHBondContact O-CB 3.5Å; A89-A92 PolarHBondContact O-N 2.97Å; A89-A92 VanDerWaalsContact O-N 3.08Å; F90-A92 PolarHBondContact O-N 2.92Å; F90-A92 VanDerWaalsContact O-N 3.09Å |
| 93 | A | 70.5 | Confident | 77.1 | Confident | 37 Ų | 37 | 56.2 Ų | 56.2 | 31% | 0.306 | 33% | 0.327 | S | S | . | . | trans | -101.8 | 112.8 | -174.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | A89 F90 V95 I96 T97 | A89-A93 PolarHBondContact O-N 3.45Å; F90-A93 PolarHBondContact O-N 3.01Å; A93-V95 PolarHBondContact O-N 3.33Å; A93-I96 HydrophobicContact CB-CG1 4.37Å; A93-I96 PolarHBondContact O-N 3.28Å; A93-T97 VanDerWaalsContact O-CG2 3.27Å; A93-T97 WeakPolarHBondContact O-CG2 3.45Å; A93-T97 PolarHBondContact O-N 3Å; A93-T97 PolarHBondContact O-OG1 2.88Å | ||
| 94 | T | 62.9 | Low | 75.7 | Confident | 110 Ų | 110 | 55.8 Ų | 55.8 | 68% | 0.675 | 33% | 0.332 | S | S | * | . | H | α-helix | trans | -55 | -44.4 | -174.3 | 48.5 | 0 | 0 | 0 | 0 | 114 | I96 T97 S98 | T94-I96 PolarHBondContact O-N 3.22Å; T94-T97 WeakPolarHBondContact CA-OG1 3.38Å; T94-T97 PolarHBondContact O-OG1 2.85Å; T94-S98 PolarHBondContact O-N 3.37Å |
| 95 | V | 55.6 | Low | 74.4 | Confident | 107 Ų | 107 | 59.7 Ų | 59.7 | 65% | 0.648 | 35% | 0.351 | S | S | * | . | H | α-helix | trans | -62.4 | -43.6 | -178.6 | 177.7 | 0 | 0 | 0 | 0 | 111.5 | A93 S98 | A93-V95 PolarHBondContact O-N 3.33Å; V95-S98 WeakPolarHBondContact O-CB 3.38Å; V95-S98 PolarHBondContact O-OG 2.59Å |
| 96 | I | 59.4 | Low | 73.1 | Confident | 74 Ų | 74 | 60.6 Ų | 60.6 | 38% | 0.379 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -87 | -28.2 | -173.7 | -24.6 | 179.7 | 0 | 0 | 0 | 112.3 | F90 A93 T94 S98 F99 L100 | F90-I96 HydrophobicContact CD2-CB 3.82Å; F90-I96 HydrophobicContact CD2-CD1 4.29Å; F90-I96 HydrophobicContact CD2-CG2 3.75Å; F90-I96 HydrophobicContact CE2-CB 3.41Å; F90-I96 VanDerWaalsContact CE2-CB 3.41Å; F90-I96 HydrophobicContact CE2-CG2 2.99Å; F90-I96 VanDerWaalsContact CZ-C 3.45Å; F90-I96 HydrophobicContact CZ-CB 3.76Å; F90-I96 HydrophobicContact CZ-CG2 3.55Å; F90-I96 WeakPolarHBondContact CZ-O 3.46Å; A93-I96 HydrophobicContact CB-CG1 4.37Å; A93-I96 PolarHBondContact O-N 3.28Å; T94-I96 PolarHBondContact O-N 3.22Å; I96-S98 PolarHBondContact O-N 3.22Å; I96-S98 VanDerWaalsContact O-N 3.11Å; I96-F99 HydrophobicContact CG2-CD2 3.96Å; I96-F99 WeakPolarHBondContact O-CB 3.49Å; I96-F99 PolarHBondContact O-N 3.3Å; I96-L100 PolarHBondContact O-N 3.34Å |
| 97 | T | 60.8 | Low | 71.4 | Confident | 11 Ų | 11 | 57.9 Ų | 57.9 | 7% | 0.067 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -55.5 | -28.1 | 168.3 | 56.7 | 0 | 0 | 0 | 0 | 112.8 | F90 A93 T94 L100 S101 F119 | F90-T97 WeakPolarHBondContact O-CG2 3.42Å; A93-T97 VanDerWaalsContact O-CG2 3.27Å; A93-T97 WeakPolarHBondContact O-CG2 3.45Å; A93-T97 PolarHBondContact O-N 3Å; A93-T97 PolarHBondContact O-OG1 2.88Å; T94-T97 WeakPolarHBondContact CA-OG1 3.38Å; T94-T97 PolarHBondContact O-OG1 2.85Å; T97-L100 PolarHBondContact O-N 3.48Å; T97-S101 WeakPolarHBondContact O-CB 3.21Å; T97-S101 PolarHBondContact O-N 3.28Å; T97-F119 HydrophobicContact CG2-CD2 3.56Å; T97-F119 HydrophobicContact CG2-CE2 3.68Å; T97-F119 HydrophobicContact CG2-CG 4.49Å |
| 98 | S | 64.5 | Low | 70 | Confident | 55 Ų | 55 | 56 Ų | 56 | 39% | 0.385 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -63.6 | -37.7 | 172.9 | 80.3 | 0 | 0 | 0 | 0 | 113 | T94 V95 I96 S101 | T94-S98 PolarHBondContact O-N 3.37Å; V95-S98 WeakPolarHBondContact O-CB 3.38Å; V95-S98 PolarHBondContact O-OG 2.59Å; I96-S98 PolarHBondContact O-N 3.22Å; I96-S98 VanDerWaalsContact O-N 3.11Å; S98-S101 WeakPolarHBondContact CA-OG 3.49Å; S98-S101 PolarHBondContact O-N 2.98Å; S98-S101 PolarHBondContact O-OG 3.23Å |
| 99 | F | 67.9 | Low | 68.7 | Low | 153 Ų | 153 | 63.8 Ų | 63.8 | 67% | 0.671 | 37% | 0.371 | S | S | * | . | H | α-helix | trans | -65.8 | -45.9 | 174.9 | -80.1 | -72.6 | 0 | 0 | 0 | 111.7 | I96 S101 A102 | I96-F99 HydrophobicContact CG2-CD2 3.96Å; I96-F99 WeakPolarHBondContact O-CB 3.49Å; I96-F99 PolarHBondContact O-N 3.3Å; F99-S101 VanDerWaalsContact C-N 3.29Å; F99-S101 PolarHBondContact O-N 3.43Å; F99-A102 WeakPolarHBondContact O-CB 3.48Å; F99-A102 PolarHBondContact O-N 3Å |
| 100 | L | 65.8 | Low | 67.6 | Low | 44 Ų | 44 | 71.5 Ų | 71.5 | 23% | 0.23 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -66.1 | -35.6 | 177.5 | -115.2 | 76.7 | 0 | 0 | 0 | 111 | F90 I96 T97 A102 I103 F106 F119 | F90-L100 HydrophobicContact CD1-CD2 4.42Å; F90-L100 HydrophobicContact CE1-CB 3.79Å; F90-L100 HydrophobicContact CE1-CD1 3.52Å; F90-L100 HydrophobicContact CE1-CD2 3.77Å; F90-L100 HydrophobicContact CE1-CG 3.86Å; F90-L100 HydrophobicContact CE2-CD1 4.09Å; F90-L100 HydrophobicContact CZ-CB 3.99Å; F90-L100 HydrophobicContact CZ-CD1 3.25Å; F90-L100 HydrophobicContact CZ-CD2 4.39Å; F90-L100 HydrophobicContact CZ-CG 4.03Å; I96-L100 PolarHBondContact O-N 3.34Å; T97-L100 PolarHBondContact O-N 3.48Å; L100-A102 PolarHBondContact O-N 3.49Å; L100-A102 VanDerWaalsContact O-N 3.07Å; L100-I103 HydrophobicContact CG-CD1 4.46Å; L100-I103 WeakPolarHBondContact O-CB 3.44Å; L100-I103 PolarHBondContact O-N 3.5Å; L100-F106 HydrophobicContact CB-CD2 4.42Å; L100-F106 HydrophobicContact CD2-CD2 4.47Å; L100-F106 HydrophobicContact CD2-CE2 3.9Å; L100-F106 HydrophobicContact CD2-CZ 4.33Å; L100-F106 HydrophobicContact CG-CD2 4.47Å; L100-F106 HydrophobicContact CG-CE2 4.08Å; L100-F106 VanDerWaalsContact O-CD2 3.27Å; L100-F106 WeakPolarHBondContact O-CD2 3.08Å; L100-F119 HydrophobicContact CB-CZ 3.88Å; L100-F119 HydrophobicContact CD2-CE1 4.16Å; L100-F119 HydrophobicContact CD2-CZ 4.35Å |
| 101 | S | 62.3 | Low | 66.8 | Low | 2 Ų | 2 | 72.9 Ų | 72.9 | 1% | 0.014 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -58.2 | -24.3 | 178.8 | 75 | 0 | 0 | 0 | 0 | 113.5 | T97 S98 F99 I103 G108 | T97-S101 WeakPolarHBondContact O-CB 3.21Å; T97-S101 PolarHBondContact O-N 3.28Å; S98-S101 WeakPolarHBondContact CA-OG 3.49Å; S98-S101 PolarHBondContact O-N 2.98Å; S98-S101 PolarHBondContact O-OG 3.23Å; F99-S101 VanDerWaalsContact C-N 3.29Å; F99-S101 PolarHBondContact O-N 3.43Å; S101-I103 PolarHBondContact O-N 2.9Å; S101-I103 VanDerWaalsContact O-N 3.14Å; S101-G108 CarbonylContact C-O 3.54Å; S101-G108 CarbonylContact O-C 3.14Å |
| 102 | A | 69.3 | Low | 66.3 | Low | 44 Ų | 44 | 79.2 Ų | 79.2 | 36% | 0.364 | 42% | 0.424 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -60.7 | -21.5 | 173.7 | 0 | 0 | 0 | 0 | 0 | 113.5 | F99 L100 F109 | F99-A102 WeakPolarHBondContact O-CB 3.48Å; F99-A102 PolarHBondContact O-N 3Å; L100-A102 PolarHBondContact O-N 3.49Å; L100-A102 VanDerWaalsContact O-N 3.07Å; A102-F109 HydrophobicContact CB-CD1 4.41Å |
| 103 | I | 71.1 | Confident | 66.4 | Low | 75 Ų | 75 | 82.1 Ų | 82.1 | 39% | 0.385 | 42% | 0.421 | S | S | . | . | S | Bend | trans | -76.9 | 124.2 | 175.7 | -59 | 167.1 | 0 | 0 | 0 | 108.9 | L100 S101 I105 F106 | L100-I103 HydrophobicContact CG-CD1 4.46Å; L100-I103 WeakPolarHBondContact O-CB 3.44Å; L100-I103 PolarHBondContact O-N 3.5Å; S101-I103 PolarHBondContact O-N 2.9Å; S101-I103 VanDerWaalsContact O-N 3.14Å; I103-I105 HydrophobicContact CG2-CB 4.24Å; I103-I105 HydrophobicContact CG2-CD1 4.29Å; I103-I105 HydrophobicContact CG2-CG1 4.24Å; I103-I105 PolarHBondContact O-N 2.87Å; I103-F106 HydrophobicContact CB-CD2 3.82Å; I103-F106 HydrophobicContact CB-CE2 3.98Å; I103-F106 HydrophobicContact CD1-CD2 4.48Å; I103-F106 HydrophobicContact CD1-CE2 3.94Å; I103-F106 HydrophobicContact CG2-CD2 4.26Å; I103-F106 HydrophobicContact CG2-CE2 4.16Å; I103-F106 PolarHBondContact O-N 3.49Å |
| 104 | P | 67.6 | Low | 66.9 | Low | 106 Ų | 106 | 88.2 Ų | 88.2 | 69% | 0.688 | 44% | 0.436 | S | S | * | . | G | 310 helix | trans | -54 | -32.5 | -171.8 | -27.1 | 32.6 | 0 | 0 | 0 | 114.6 | F106 G107 | P104-F106 PolarHBondContact O-N 3.4Å; P104-F106 VanDerWaalsContact O-N 3.14Å; P104-G107 PolarHBondContact O-N 3.44Å |
| 105 | I | 69.7 | Low | 67.8 | Low | 115 Ų | 115 | 83 Ų | 83 | 59% | 0.59 | 40% | 0.403 | S | S | * | . | G | 310 helix | trans | -55.3 | -32.8 | -179.6 | -58.9 | 172.8 | 0 | 0 | 0 | 111.6 | I103 | I103-I105 HydrophobicContact CG2-CB 4.24Å; I103-I105 HydrophobicContact CG2-CD1 4.29Å; I103-I105 HydrophobicContact CG2-CG1 4.24Å; I103-I105 PolarHBondContact O-N 2.87Å |
| 106 | F | 69 | Low | 69.1 | Low | 31 Ų | 31 | 79.9 Ų | 79.9 | 14% | 0.136 | 38% | 0.383 | C | S | . | . | G | 310 helix | trans | -93.8 | 3.5 | -174 | -53.6 | -51.9 | 0 | 0 | 0 | 114.5 | L100 I103 P104 T115 F118 F119 | L100-F106 HydrophobicContact CB-CD2 4.42Å; L100-F106 HydrophobicContact CD2-CD2 4.47Å; L100-F106 HydrophobicContact CD2-CE2 3.9Å; L100-F106 HydrophobicContact CD2-CZ 4.33Å; L100-F106 HydrophobicContact CG-CD2 4.47Å; L100-F106 HydrophobicContact CG-CE2 4.08Å; L100-F106 VanDerWaalsContact O-CD2 3.27Å; L100-F106 WeakPolarHBondContact O-CD2 3.08Å; I103-F106 HydrophobicContact CB-CD2 3.82Å; I103-F106 HydrophobicContact CB-CE2 3.98Å; I103-F106 HydrophobicContact CD1-CD2 4.48Å; I103-F106 HydrophobicContact CD1-CE2 3.94Å; I103-F106 HydrophobicContact CG2-CD2 4.26Å; I103-F106 HydrophobicContact CG2-CE2 4.16Å; I103-F106 PolarHBondContact O-N 3.49Å; P104-F106 PolarHBondContact O-N 3.4Å; P104-F106 VanDerWaalsContact O-N 3.14Å; F106-T115 HydrophobicContact CB-CG2 4.37Å; F106-T115 WeakPolarHBondContact O-CA 3.34Å; F106-T115 WeakPolarHBondContact O-CB 3.15Å; F106-T115 PolarHBondContact O-N 2.88Å; F106-T115 PolarHBondContact O-OG1 2.95Å; F106-F118 AromaticContact CD1-CD1 3.56Å; F106-F118 HydrophobicContact CD1-CD1 3.56Å; F106-F118 HydrophobicContact CD1-CD2 4.41Å; F106-F118 AromaticContact CD1-CE1 3.33Å; F106-F118 HydrophobicContact CD1-CE1 3.33Å; F106-F118 HydrophobicContact CD1-CE2 4.19Å; F106-F118 HydrophobicContact CD1-CG 4.13Å; F106-F118 AromaticContact CD1-CZ 3.68Å; F106-F118 HydrophobicContact CD1-CZ 3.68Å; F106-F118 AromaticContact CE1-CD1 3.92Å; F106-F118 HydrophobicContact CE1-CD1 3.92Å; F106-F118 AromaticContact CE1-CE1 3.18Å; F106-F118 HydrophobicContact CE1-CE1 3.18Å; F106-F118 HydrophobicContact CE1-CE2 4.19Å; F106-F118 AromaticContact CE1-CZ 3.35Å; F106-F118 HydrophobicContact CE1-CZ 3.35Å; F106-F118 HydrophobicContact CZ-CE1 4.29Å; F106-F119 HydrophobicContact CB-CZ 4.41Å; F106-F119 HydrophobicContact CD1-CE1 4.3Å; F106-F119 HydrophobicContact CG-CE1 4.2Å; F106-F119 HydrophobicContact CG-CZ 4.42Å |
| 107 | G | 58.5 | Low | 70.3 | Confident | 14 Ų | 14 | 79.9 Ų | 79.9 | 14% | 0.144 | 38% | 0.381 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 117.8 | 8.1 | 175.1 | 0 | 0 | 0 | 0 | 0 | 116.1 | P104 | P104-G107 PolarHBondContact O-N 3.44Š|
| 108 | G | 63.1 | Low | 71.6 | Confident | 20 Ų | 20 | 82.1 Ų | 82.1 | 21% | 0.206 | 39% | 0.39 | C | S | . | . | S | Bend | trans | 86.9 | 178.3 | 174.8 | 0 | 0 | 0 | 0 | 0 | 114 | S101 R110 | S101-G108 CarbonylContact C-O 3.54Å; S101-G108 CarbonylContact O-C 3.14Å; G108-R110 PolarHBondContact O-N 2.94Å; G108-R110 VanDerWaalsContact O-O 3.13Å |
| 109 | F | 66.7 | Low | 72.7 | Confident | 183 Ų | 183 | 79.8 Ų | 79.8 | 80% | 0.803 | 37% | 0.373 | S | S | * | . | S | Bend | trans | -55.3 | -0.8 | -168.3 | -61 | -78 | 0 | 0 | 0 | 118.3 | A102 | A102-F109 HydrophobicContact CB-CD1 4.41Š|
| 110 | R | 66.7 | Low | 73.8 | Confident | 196 Ų | 196 | 74.9 Ų | 74.9 | 74% | 0.74 | 35% | 0.352 | S | S | * | . | S | Bend | trans | -131.2 | 143 | 174.7 | -64.3 | -173.7 | -179.5 | -171.4 | -0 | 109.1 | G108 R112 | G108-R110 PolarHBondContact O-N 2.94Å; G108-R110 VanDerWaalsContact O-O 3.13Å; R110-R112 PolarHBondContact O-N 3.35Å |
| 111 | I | 67.6 | Low | 75 | Confident | 64 Ų | 64 | 76.1 Ų | 76.1 | 33% | 0.328 | 36% | 0.361 | S | S | . | . | trans | -63.1 | 102.2 | 174.3 | -58.6 | 173.2 | 0 | 0 | 0 | 107.9 | T115 | I111-T115 HydrophobicContact CG2-CG2 4.47Š| ||
| 112 | R | 74.9 | Confident | 76.4 | Confident | 152 Ų | 152 | 79.6 Ų | 79.6 | 57% | 0.574 | 38% | 0.376 | S | S | * | . | trans | -102.1 | 169.7 | 176.7 | -73.9 | 179.5 | 174 | -179 | -1.4 | 110.1 | E21 R110 R114 T115 L116 | E21-R112 WeakPolarHBondContact OE2-CA 3.31Å; R110-R112 PolarHBondContact O-N 3.35Å; R112-R114 PolarHBondContact O-N 3.24Å; R112-R114 VanDerWaalsContact O-N 3.08Å; R112-T115 PolarHBondContact N-OG1 3.48Å; R112-T115 WeakPolarHBondContact O-CB 3.42Å; R112-T115 PolarHBondContact O-N 3.29Å; R112-L116 PolarHBondContact O-N 2.99Å; R112-L116 VanDerWaalsContact O-N 3.12Å | ||
| 113 | R | 79.8 | Confident | 77.6 | Confident | 132 Ų | 132 | 79.7 Ų | 79.7 | 50% | 0.498 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -43.5 | -43.7 | 170.2 | -178.9 | 179.6 | 176 | -177.4 | -0.3 | 113.5 | E21 T115 L116 Q117 | E21-R113 HydrophobicContact CB-CB 4.45Å; E21-R113 PolarHBondContact OE2-N 3.25Å; R113-T115 PolarHBondContact O-N 2.95Å; R113-L116 PolarHBondContact O-N 2.88Å; R113-Q117 HydrophobicContact CG-CG 4.32Å; R113-Q117 WeakPolarHBondContact O-CB 3.02Å; R113-Q117 WeakPolarHBondContact O-CG 2.84Å; R113-Q117 PolarHBondContact O-N 3.21Å |
| 114 | R | 81 | Confident | 78.6 | Confident | 165 Ų | 165 | 80.2 Ų | 80.2 | 62% | 0.623 | 37% | 0.367 | S | S | * | . | H | α-helix | trans | -60.1 | -44.3 | 178.9 | -175.5 | 177.8 | -179.5 | 172.3 | 1.2 | 112 | R112 F118 | R112-R114 PolarHBondContact O-N 3.24Å; R112-R114 VanDerWaalsContact O-N 3.08Å; R114-F118 VanDerWaalsContact O-CB 3.25Å; R114-F118 WeakPolarHBondContact O-CB 3.42Å; R114-F118 PolarHBondContact O-N 3.36Å |
| 115 | T | 82.5 | Confident | 80 | Confident | 0 Ų | 0 | 79.2 Ų | 79.2 | 0% | 0 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -61.8 | -47.2 | 178.2 | -43.3 | 0 | 0 | 0 | 0 | 111.1 | F106 I111 R112 R113 F118 F119 | F106-T115 HydrophobicContact CB-CG2 4.37Å; F106-T115 WeakPolarHBondContact O-CA 3.34Å; F106-T115 WeakPolarHBondContact O-CB 3.15Å; F106-T115 PolarHBondContact O-N 2.88Å; F106-T115 PolarHBondContact O-OG1 2.95Å; I111-T115 HydrophobicContact CG2-CG2 4.47Å; R112-T115 PolarHBondContact N-OG1 3.48Å; R112-T115 WeakPolarHBondContact O-CB 3.42Å; R112-T115 PolarHBondContact O-N 3.29Å; R113-T115 PolarHBondContact O-N 2.95Å; T115-F118 PolarHBondContact O-N 3.19Å; T115-F119 HydrophobicContact CG2-CD2 3.96Å; T115-F119 HydrophobicContact CG2-CE2 3.4Å; T115-F119 HydrophobicContact CG2-CZ 3.78Å; T115-F119 PolarHBondContact O-N 3.44Å |
| 116 | L | 82.5 | Confident | 81.3 | Confident | 41 Ų | 41 | 74.4 Ų | 74.4 | 22% | 0.215 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -67.5 | -42 | -177.8 | -169.4 | 67.5 | 0 | 0 | 0 | 112.1 | P19 R20 A24 R112 R113 F120 | P19-L116 HydrophobicContact CB-CD2 4.29Å; P19-L116 HydrophobicContact CB-CG 4.06Å; R20-L116 WeakPolarHBondContact O-CD2 3.32Å; A24-L116 HydrophobicContact CB-CD2 3.97Å; R112-L116 PolarHBondContact O-N 2.99Å; R112-L116 VanDerWaalsContact O-N 3.12Å; R113-L116 PolarHBondContact O-N 2.88Å; L116-F120 VanDerWaalsContact O-CB 3.23Å; L116-F120 WeakPolarHBondContact O-CB 3.45Å; L116-F120 PolarHBondContact O-N 3.32Å |
| 117 | Q | 86.1 | Confident | 82.6 | Confident | 75 Ų | 75 | 73.8 Ų | 73.8 | 35% | 0.35 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -62.4 | -44.4 | 174.3 | -73.8 | -178.9 | -34.7 | 0 | 0 | 111.1 | P19 R113 F120 T121 | P19-Q117 HydrophobicContact CB-CG 4.38Å; P19-Q117 HydrophobicContact CG-CG 4.18Å; P19-Q117 WeakPolarHBondContact O-CG 3.39Å; R113-Q117 HydrophobicContact CG-CG 4.32Å; R113-Q117 WeakPolarHBondContact O-CB 3.02Å; R113-Q117 WeakPolarHBondContact O-CG 2.84Å; R113-Q117 PolarHBondContact O-N 3.21Å; Q117-F120 PolarHBondContact O-N 3.24Å; Q117-T121 WeakPolarHBondContact O-CB 3.34Å; Q117-T121 PolarHBondContact O-N 3.44Å; Q117-T121 PolarHBondContact O-OG1 3.31Å |
| 118 | F | 86.7 | Confident | 84.4 | Confident | 57 Ų | 57 | 78 Ų | 78 | 25% | 0.25 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -59.5 | -53.2 | 177.7 | -176.3 | -83.6 | 0 | 0 | 0 | 111.6 | F106 R114 T115 F120 T121 F122 | F106-F118 AromaticContact CD1-CD1 3.56Å; F106-F118 HydrophobicContact CD1-CD1 3.56Å; F106-F118 HydrophobicContact CD1-CD2 4.41Å; F106-F118 AromaticContact CD1-CE1 3.33Å; F106-F118 HydrophobicContact CD1-CE1 3.33Å; F106-F118 HydrophobicContact CD1-CE2 4.19Å; F106-F118 HydrophobicContact CD1-CG 4.13Å; F106-F118 AromaticContact CD1-CZ 3.68Å; F106-F118 HydrophobicContact CD1-CZ 3.68Å; F106-F118 AromaticContact CE1-CD1 3.92Å; F106-F118 HydrophobicContact CE1-CD1 3.92Å; F106-F118 AromaticContact CE1-CE1 3.18Å; F106-F118 HydrophobicContact CE1-CE1 3.18Å; F106-F118 HydrophobicContact CE1-CE2 4.19Å; F106-F118 AromaticContact CE1-CZ 3.35Å; F106-F118 HydrophobicContact CE1-CZ 3.35Å; F106-F118 HydrophobicContact CZ-CE1 4.29Å; R114-F118 VanDerWaalsContact O-CB 3.25Å; R114-F118 WeakPolarHBondContact O-CB 3.42Å; R114-F118 PolarHBondContact O-N 3.36Å; T115-F118 PolarHBondContact O-N 3.19Å; F118-F120 VanDerWaalsContact C-N 3.33Å; F118-F120 PolarHBondContact O-N 2.97Å; F118-T121 PolarHBondContact O-N 3.49Å; F118-F122 AromaticContact CD1-CD2 3.81Å; F118-F122 HydrophobicContact CD1-CD2 3.81Å; F118-F122 HydrophobicContact CD1-CE2 4.28Å; F118-F122 HydrophobicContact CD2-CD2 4.08Å; F118-F122 AromaticContact CD2-CE2 3.82Å; F118-F122 HydrophobicContact CD2-CE2 3.82Å; F118-F122 AromaticContact CE1-CD2 3.39Å; F118-F122 HydrophobicContact CE1-CD2 3.39Å; F118-F122 AromaticContact CE1-CE2 3.68Å; F118-F122 HydrophobicContact CE1-CE2 3.68Å; F118-F122 HydrophobicContact CE1-CG 4.2Å; F118-F122 AromaticContact CE2-CD2 3.74Å; F118-F122 HydrophobicContact CE2-CD2 3.74Å; F118-F122 AromaticContact CE2-CE2 3.19Å; F118-F122 HydrophobicContact CE2-CE2 3.19Å; F118-F122 HydrophobicContact CE2-CZ 4.11Å; F118-F122 HydrophobicContact CG-CD2 4.11Å; F118-F122 HydrophobicContact CG-CE2 4.32Å; F118-F122 AromaticContact CZ-CD2 3.35Å; F118-F122 HydrophobicContact CZ-CD2 3.35Å; F118-F122 AromaticContact CZ-CE2 3.08Å; F118-F122 HydrophobicContact CZ-CE2 3.08Å; F118-F122 HydrophobicContact CZ-CG 4.33Å; F118-F122 AromaticContact CZ-CZ 3.86Å; F118-F122 HydrophobicContact CZ-CZ 3.86Å; F118-F122 WeakPolarHBondContact O-CD2 3.36Å; F118-F122 PolarHBondContact O-N 3.44Å |
| 119 | F | 88.3 | Confident | 86.1 | Confident | 6 Ų | 6 | 80.6 Ų | 80.6 | 3% | 0.026 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -63.2 | -38.9 | 179.3 | -67.7 | -22.7 | 0 | 0 | 0 | 112.5 | M91 T97 L100 F106 T115 F122 H123 | M91-F119 HydrophobicContact CB-CB 4.19Å; M91-F119 HydrophobicContact CG-CB 4.37Å; M91-F119 HydrophobicContact CG-CD1 4.07Å; M91-F119 HydrophobicContact CG-CG 4.34Å; T97-F119 HydrophobicContact CG2-CD2 3.56Å; T97-F119 HydrophobicContact CG2-CE2 3.68Å; T97-F119 HydrophobicContact CG2-CG 4.49Å; L100-F119 HydrophobicContact CB-CZ 3.88Å; L100-F119 HydrophobicContact CD2-CE1 4.16Å; L100-F119 HydrophobicContact CD2-CZ 4.35Å; F106-F119 HydrophobicContact CB-CZ 4.41Å; F106-F119 HydrophobicContact CD1-CE1 4.3Å; F106-F119 HydrophobicContact CG-CE1 4.2Å; F106-F119 HydrophobicContact CG-CZ 4.42Å; T115-F119 HydrophobicContact CG2-CD2 3.96Å; T115-F119 HydrophobicContact CG2-CE2 3.4Å; T115-F119 HydrophobicContact CG2-CZ 3.78Å; T115-F119 PolarHBondContact O-N 3.44Å; F119-F122 PolarHBondContact O-N 3.37Å; F119-H123 WeakPolarHBondContact O-CB 3.38Å; F119-H123 PolarHBondContact O-N 3.37Å |
| 120 | F | 90.1 | Very high | 87.5 | Confident | 51 Ų | 51 | 72.3 Ų | 72.3 | 22% | 0.224 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -61.7 | -45.4 | 174.9 | 178.5 | -104 | 0 | 0 | 0 | 112.2 | V14 Y17 P19 L116 Q117 F118 F122 H123 Y124 | V14-F120 HydrophobicContact CB-CZ 4.28Å; V14-F120 HydrophobicContact CG1-CZ 3.96Å; V14-F120 HydrophobicContact CG2-CE2 3.96Å; V14-F120 HydrophobicContact CG2-CZ 3.7Å; Y17-F120 AromaticContact CD1-CD2 3.78Å; Y17-F120 HydrophobicContact CD1-CD2 3.78Å; Y17-F120 AromaticContact CD1-CE2 3.42Å; Y17-F120 HydrophobicContact CD1-CE2 3.42Å; Y17-F120 VanDerWaalsContact CD1-CE2 3.42Å; Y17-F120 HydrophobicContact CD1-CZ 4.02Å; Y17-F120 AromaticContact CE1-CD2 3.72Å; Y17-F120 HydrophobicContact CE1-CD2 3.72Å; Y17-F120 AromaticContact CE1-CE2 3.89Å; Y17-F120 HydrophobicContact CE1-CE2 3.89Å; Y17-F120 HydrophobicContact CE1-CG 4.42Å; P19-F120 HydrophobicContact CB-CB 3.85Å; P19-F120 HydrophobicContact CB-CD1 4.22Å; P19-F120 HydrophobicContact CB-CG 3.99Å; P19-F120 HydrophobicContact CG-CB 4.17Å; P19-F120 HydrophobicContact CG-CD1 3.65Å; P19-F120 HydrophobicContact CG-CE1 4.16Å; P19-F120 HydrophobicContact CG-CG 3.95Å; L116-F120 VanDerWaalsContact O-CB 3.23Å; L116-F120 WeakPolarHBondContact O-CB 3.45Å; L116-F120 PolarHBondContact O-N 3.32Å; Q117-F120 PolarHBondContact O-N 3.24Å; F118-F120 VanDerWaalsContact C-N 3.33Å; F118-F120 PolarHBondContact O-N 2.97Å; F120-F122 PolarHBondContact O-N 3.02Å; F120-H123 PolarHBondContact O-N 3.26Å; F120-Y124 PolarHBondContact O-N 3.38Å |
| 121 | T | 91.7 | Very high | 89 | Confident | 69 Ų | 69 | 66 Ų | 66 | 42% | 0.423 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -60.5 | -46.7 | 177.3 | -63.7 | 0 | 0 | 0 | 0 | 111.6 | Q117 F118 Y124 L125 | Q117-T121 WeakPolarHBondContact O-CB 3.34Å; Q117-T121 PolarHBondContact O-N 3.44Å; Q117-T121 PolarHBondContact O-OG1 3.31Å; F118-T121 PolarHBondContact O-N 3.49Å; T121-Y124 PolarHBondContact O-N 2.7Å; T121-L125 HydrophobicContact CG2-CD1 3.76Å; T121-L125 HydrophobicContact CG2-CG 4.47Å; T121-L125 WeakPolarHBondContact O-CB 3.39Å; T121-L125 WeakPolarHBondContact O-CG 3.27Å; T121-L125 PolarHBondContact O-N 3.49Å |
| 122 | F | 92.2 | Very high | 90.4 | Very high | 76 Ų | 76 | 64.6 Ų | 64.6 | 33% | 0.333 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -73.2 | -34.7 | 179.7 | -83 | -82.2 | 0 | 0 | 0 | 113.3 | M91 F118 F119 F120 Y124 L125 I126 | M91-F122 HydrophobicContact CE-CB 3.64Å; M91-F122 HydrophobicContact CE-CG 4.35Å; M91-F122 HydrophobicContact SD-CB 3.49Å; M91-F122 WeakPolarHBondContact SD-CB 3.42Å; F118-F122 AromaticContact CD1-CD2 3.81Å; F118-F122 HydrophobicContact CD1-CD2 3.81Å; F118-F122 HydrophobicContact CD1-CE2 4.28Å; F118-F122 HydrophobicContact CD2-CD2 4.08Å; F118-F122 AromaticContact CD2-CE2 3.82Å; F118-F122 HydrophobicContact CD2-CE2 3.82Å; F118-F122 AromaticContact CE1-CD2 3.39Å; F118-F122 HydrophobicContact CE1-CD2 3.39Å; F118-F122 AromaticContact CE1-CE2 3.68Å; F118-F122 HydrophobicContact CE1-CE2 3.68Å; F118-F122 HydrophobicContact CE1-CG 4.2Å; F118-F122 AromaticContact CE2-CD2 3.74Å; F118-F122 HydrophobicContact CE2-CD2 3.74Å; F118-F122 AromaticContact CE2-CE2 3.19Å; F118-F122 HydrophobicContact CE2-CE2 3.19Å; F118-F122 HydrophobicContact CE2-CZ 4.11Å; F118-F122 HydrophobicContact CG-CD2 4.11Å; F118-F122 HydrophobicContact CG-CE2 4.32Å; F118-F122 AromaticContact CZ-CD2 3.35Å; F118-F122 HydrophobicContact CZ-CD2 3.35Å; F118-F122 AromaticContact CZ-CE2 3.08Å; F118-F122 HydrophobicContact CZ-CE2 3.08Å; F118-F122 HydrophobicContact CZ-CG 4.33Å; F118-F122 AromaticContact CZ-CZ 3.86Å; F118-F122 HydrophobicContact CZ-CZ 3.86Å; F118-F122 WeakPolarHBondContact O-CD2 3.36Å; F118-F122 PolarHBondContact O-N 3.44Å; F119-F122 PolarHBondContact O-N 3.37Å; F120-F122 PolarHBondContact O-N 3.02Å; F122-Y124 PolarHBondContact O-N 2.93Å; F122-L125 PolarHBondContact O-N 3.47Å; F122-I126 HydrophobicContact CB-CD1 4.01Å; F122-I126 HydrophobicContact CB-CG1 4.49Å; F122-I126 HydrophobicContact CD1-CD1 4.23Å; F122-I126 HydrophobicContact CD1-CG1 4.26Å; F122-I126 WeakPolarHBondContact O-CB 3.29Å; F122-I126 VanDerWaalsContact O-CG1 3.24Å; F122-I126 WeakPolarHBondContact O-CG1 3.49Å; F122-I126 PolarHBondContact O-N 3.13Å |
| 123 | H | 92.9 | Very high | 91.5 | Very high | 45 Ų | 45 | 58.8 Ų | 58.8 | 21% | 0.208 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -60.3 | -34.6 | 172.4 | -175 | 88 | 0 | 0 | 0 | 111.3 | V88 M91 F119 F120 P127 | V88-H123 WeakPolarHBondContact CG1-ND1 3.38Å; V88-H123 PolarHBondContact O-CE1 3.07Å; V88-H123 PolarHBondContact O-ND1 2.81Å; M91-H123 HydrophobicContact CB-CB 4.25Å; F119-H123 WeakPolarHBondContact O-CB 3.38Å; F119-H123 PolarHBondContact O-N 3.37Å; F120-H123 PolarHBondContact O-N 3.26Å; H123-P127 WeakPolarHBondContact O-CD 3.36Å; H123-P127 WeakPolarHBondContact O-CG 3.47Å |
| 124 | Y | 93.8 | Very high | 92.3 | Very high | 87 Ų | 87 | 53.9 Ų | 53.9 | 34% | 0.341 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -75.2 | -40 | 173.5 | -175.4 | -99.3 | 0 | 0 | 0 | 113.1 | L11 V14 F120 T121 F122 F128 | L11-Y124 HydrophobicContact CD1-CE2 4.11Å; L11-Y124 WeakPolarHBondContact CD1-OH 3.34Å; V14-Y124 HydrophobicContact CG2-CD2 4.06Å; V14-Y124 HydrophobicContact CG2-CE2 4.39Å; F120-Y124 PolarHBondContact O-N 3.38Å; T121-Y124 PolarHBondContact O-N 2.7Å; F122-Y124 PolarHBondContact O-N 2.93Å; Y124-F128 HydrophobicContact CD1-CE2 4.28Å; Y124-F128 AromaticContact CE1-CE2 3.91Å; Y124-F128 HydrophobicContact CE1-CE2 3.91Å; Y124-F128 HydrophobicContact CE2-CE2 4.43Å; Y124-F128 AromaticContact CZ-CE2 3.99Å; Y124-F128 VanDerWaalsContact O-CD2 3.24Å; Y124-F128 WeakPolarHBondContact O-CD2 3.38Å; Y124-F128 VanDerWaalsContact O-CE2 3.25Å; Y124-F128 WeakPolarHBondContact O-CE2 3.5Å |
| 125 | L | 96.1 | Very high | 93.1 | Very high | 85 Ų | 85 | 51.3 Ų | 51.3 | 45% | 0.445 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -79.8 | -43.1 | -174.1 | -72.4 | 172.3 | 0 | 0 | 0 | 114.4 | T121 F122 P127 F128 | T121-L125 HydrophobicContact CG2-CD1 3.76Å; T121-L125 HydrophobicContact CG2-CG 4.47Å; T121-L125 WeakPolarHBondContact O-CB 3.39Å; T121-L125 WeakPolarHBondContact O-CG 3.27Å; T121-L125 PolarHBondContact O-N 3.49Å; F122-L125 PolarHBondContact O-N 3.47Å; L125-P127 VanDerWaalsContact C-CD 3.47Å; L125-F128 WeakPolarHBondContact O-CB 3.44Å; L125-F128 PolarHBondContact O-N 3.48Å |
| 126 | I | 96.5 | Very high | 93.8 | Very high | 13 Ų | 13 | 55.2 Ų | 55.2 | 7% | 0.067 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -59.8 | -36.8 | -174 | -65.5 | 164.9 | 0 | 0 | 0 | 112.9 | L84 L87 V88 M91 F122 F128 V129 I130 | L84-I126 HydrophobicContact CB-CG2 4.1Å; L84-I126 HydrophobicContact CD2-CG2 4.09Å; L87-I126 HydrophobicContact CD2-CD1 3.79Å; L87-I126 HydrophobicContact CG-CD1 4.07Å; V88-I126 HydrophobicContact CG2-CB 3.58Å; V88-I126 HydrophobicContact CG2-CD1 4.5Å; V88-I126 HydrophobicContact CG2-CG2 3.34Å; M91-I126 HydrophobicContact CE-CD1 3.76Å; M91-I126 HydrophobicContact SD-CD1 3.93Å; F122-I126 HydrophobicContact CB-CD1 4.01Å; F122-I126 HydrophobicContact CB-CG1 4.49Å; F122-I126 HydrophobicContact CD1-CD1 4.23Å; F122-I126 HydrophobicContact CD1-CG1 4.26Å; F122-I126 WeakPolarHBondContact O-CB 3.29Å; F122-I126 VanDerWaalsContact O-CG1 3.24Å; F122-I126 WeakPolarHBondContact O-CG1 3.49Å; F122-I126 PolarHBondContact O-N 3.13Å; I126-F128 PolarHBondContact O-N 3.48Å; I126-V129 WeakPolarHBondContact O-CA 3.35Å; I126-V129 WeakPolarHBondContact O-CB 3.36Å; I126-V129 PolarHBondContact O-N 3.35Å; I126-I130 HydrophobicContact CG2-CD1 4.13Å; I126-I130 HydrophobicContact CG2-CG1 4.23Å; I126-I130 WeakPolarHBondContact O-CG1 3.41Å; I126-I130 PolarHBondContact O-N 3.48Å |
| 127 | P | 96.3 | Very high | 94.5 | Very high | 19 Ų | 19 | 54.7 Ų | 54.7 | 12% | 0.123 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -53 | -35.4 | 173.3 | -30.3 | 37.2 | 0 | 0 | 0 | 114.1 | F3 L7 V88 H123 L125 I130 I131 | F3-P127 HydrophobicContact CZ-CB 4.06Å; F3-P127 WeakPolarHBondContact CZ-O 3.27Å; L7-P127 HydrophobicContact CD2-CB 3.56Å; V88-P127 HydrophobicContact CG1-CG 4.19Å; V88-P127 HydrophobicContact CG2-CG 4.21Å; H123-P127 WeakPolarHBondContact O-CD 3.36Å; H123-P127 WeakPolarHBondContact O-CG 3.47Å; L125-P127 VanDerWaalsContact C-CD 3.47Å; P127-I130 WeakPolarHBondContact O-CB 3.24Å; P127-I130 PolarHBondContact O-N 2.93Å; P127-I131 WeakPolarHBondContact O-CG1 3.43Å; P127-I131 PolarHBondContact O-N 3.19Å |
| 128 | F | 96.7 | Very high | 94.9 | Very high | 101 Ų | 101 | 55.4 Ų | 55.4 | 44% | 0.443 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -70.9 | -35.7 | 175.3 | -61.9 | -80.5 | 0 | 0 | 0 | 112.3 | Y124 L125 I126 I130 I131 G132 | Y124-F128 HydrophobicContact CD1-CE2 4.28Å; Y124-F128 AromaticContact CE1-CE2 3.91Å; Y124-F128 HydrophobicContact CE1-CE2 3.91Å; Y124-F128 HydrophobicContact CE2-CE2 4.43Å; Y124-F128 AromaticContact CZ-CE2 3.99Å; Y124-F128 VanDerWaalsContact O-CD2 3.24Å; Y124-F128 WeakPolarHBondContact O-CD2 3.38Å; Y124-F128 VanDerWaalsContact O-CE2 3.25Å; Y124-F128 WeakPolarHBondContact O-CE2 3.5Å; L125-F128 WeakPolarHBondContact O-CB 3.44Å; L125-F128 PolarHBondContact O-N 3.48Å; I126-F128 PolarHBondContact O-N 3.48Å; F128-I130 VanDerWaalsContact C-N 3.32Å; F128-I130 PolarHBondContact O-N 2.93Å; F128-I131 HydrophobicContact CD1-CD1 4.26Å; F128-I131 WeakPolarHBondContact O-CB 3.47Å; F128-I131 PolarHBondContact O-N 2.9Å; F128-G132 PolarHBondContact O-N 3.36Å |
| 129 | V | 97.9 | Very high | 95.3 | Very high | 76 Ų | 76 | 57.3 Ų | 57.3 | 46% | 0.461 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -62.9 | -40.8 | 172.2 | -178.2 | 0 | 0 | 0 | 0 | 110.7 | L84 I126 I131 G132 I133 | L84-V129 HydrophobicContact CD1-CG1 4.11Å; I126-V129 WeakPolarHBondContact O-CA 3.35Å; I126-V129 WeakPolarHBondContact O-CB 3.36Å; I126-V129 PolarHBondContact O-N 3.35Å; V129-I131 VanDerWaalsContact C-N 3.27Å; V129-I131 PolarHBondContact O-N 2.91Å; V129-G132 PolarHBondContact O-N 3.47Å; V129-G132 VanDerWaalsContact O-N 3.1Å; V129-I133 HydrophobicContact CG1-CD1 4.15Å; V129-I133 HydrophobicContact CG1-CG1 4.47Å; V129-I133 WeakPolarHBondContact O-CG1 3.35Å; V129-I133 PolarHBondContact O-N 3.29Å |
| 130 | I | 98 | Very high | 95.6 | Very high | 8 Ų | 8 | 59.7 Ų | 59.7 | 4% | 0.041 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -58.9 | -38.8 | 175.9 | -67.3 | 169.5 | 0 | 0 | 0 | 111 | F3 I81 L84 V88 I126 P127 F128 I133 A134 | F3-I130 HydrophobicContact CE2-CB 4.29Å; F3-I130 HydrophobicContact CE2-CD1 4.37Å; F3-I130 HydrophobicContact CE2-CG2 3.78Å; F3-I130 HydrophobicContact CZ-CB 3.9Å; F3-I130 HydrophobicContact CZ-CG2 3.74Å; I81-I130 HydrophobicContact CG2-CG2 4.16Å; L84-I130 HydrophobicContact CB-CD1 3.93Å; L84-I130 HydrophobicContact CB-CG1 3.66Å; L84-I130 HydrophobicContact CD1-CG1 4.06Å; V88-I130 HydrophobicContact CG2-CD1 4.13Å; I126-I130 HydrophobicContact CG2-CD1 4.13Å; I126-I130 HydrophobicContact CG2-CG1 4.23Å; I126-I130 WeakPolarHBondContact O-CG1 3.41Å; I126-I130 PolarHBondContact O-N 3.48Å; P127-I130 WeakPolarHBondContact O-CB 3.24Å; P127-I130 PolarHBondContact O-N 2.93Å; F128-I130 VanDerWaalsContact C-N 3.32Å; F128-I130 PolarHBondContact O-N 2.93Å; I130-I133 PolarHBondContact O-N 3.45Å; I130-A134 VanDerWaalsContact O-CB 3.24Å; I130-A134 WeakPolarHBondContact O-CB 3.49Å; I130-A134 PolarHBondContact O-N 2.99Å |
| 131 | I | 97.3 | Very high | 95.6 | Very high | 64 Ų | 64 | 60.5 Ų | 60.5 | 33% | 0.328 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -59.9 | -48.1 | 174.4 | -59 | 169.5 | 0 | 0 | 0 | 110.5 | F3 L7 P127 F128 V129 I133 A134 I135 | F3-I131 HydrophobicContact CD1-CG1 4.35Å; F3-I131 HydrophobicContact CE1-CD1 4.22Å; F3-I131 HydrophobicContact CE1-CG1 3.58Å; F3-I131 HydrophobicContact CZ-CG1 4.42Å; L7-I131 HydrophobicContact CD1-CD1 3.64Å; L7-I131 HydrophobicContact CD1-CG1 4.42Å; P127-I131 WeakPolarHBondContact O-CG1 3.43Å; P127-I131 PolarHBondContact O-N 3.19Å; F128-I131 HydrophobicContact CD1-CD1 4.26Å; F128-I131 WeakPolarHBondContact O-CB 3.47Å; F128-I131 PolarHBondContact O-N 2.9Å; V129-I131 VanDerWaalsContact C-N 3.27Å; V129-I131 PolarHBondContact O-N 2.91Å; I131-I133 VanDerWaalsContact C-N 3.34Å; I131-I133 PolarHBondContact O-N 3.48Å; I131-A134 WeakPolarHBondContact O-CB 3.3Å; I131-A134 PolarHBondContact O-N 3.25Å; I131-I135 HydrophobicContact CG2-CD1 4.2Å; I131-I135 WeakPolarHBondContact O-CG1 3.34Å; I131-I135 PolarHBondContact O-N 2.92Å |
| 132 | G | 97.6 | Very high | 95.4 | Very high | 34 Ų | 34 | 64 Ų | 64 | 35% | 0.351 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -57.6 | -46.2 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | F128 V129 I135 I136 | F128-G132 PolarHBondContact O-N 3.36Å; V129-G132 PolarHBondContact O-N 3.47Å; V129-G132 VanDerWaalsContact O-N 3.1Å; G132-I135 PolarHBondContact O-N 3.48Å; G132-I136 WeakPolarHBondContact O-CG1 3.38Å; G132-I136 PolarHBondContact O-N 3Å |
| 133 | I | 97.9 | Very high | 95.3 | Very high | 30 Ų | 30 | 66.1 Ų | 66.1 | 15% | 0.154 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -70.4 | -33.8 | 178.3 | -57.3 | -178.1 | 0 | 0 | 0 | 111.5 | I80 I81 L84 V129 I130 I131 I135 I136 H137 | I80-I133 HydrophobicContact CG2-CD1 3.53Å; I80-I133 HydrophobicContact CG2-CG2 4.27Å; I81-I133 HydrophobicContact CD1-CG2 4.16Å; I81-I133 HydrophobicContact CG1-CB 4.19Å; I81-I133 HydrophobicContact CG1-CG2 3.68Å; L84-I133 HydrophobicContact CD1-CD1 3.5Å; V129-I133 HydrophobicContact CG1-CD1 4.15Å; V129-I133 HydrophobicContact CG1-CG1 4.47Å; V129-I133 WeakPolarHBondContact O-CG1 3.35Å; V129-I133 PolarHBondContact O-N 3.29Å; I130-I133 PolarHBondContact O-N 3.45Å; I131-I133 VanDerWaalsContact C-N 3.34Å; I131-I133 PolarHBondContact O-N 3.48Å; I133-I135 VanDerWaalsContact C-N 3.31Å; I133-I135 PolarHBondContact O-N 3.45Å; I133-I136 PolarHBondContact O-N 3.31Å; I133-H137 WeakPolarHBondContact O-CB 3.47Å; I133-H137 PolarHBondContact O-N 3.37Å |
| 134 | A | 97 | Very high | 94.8 | Very high | 30 Ų | 30 | 67 Ų | 67 | 25% | 0.248 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -62.5 | -37.4 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | I81 I130 I131 H137 I138 | I81-A134 HydrophobicContact CD1-CB 4.25Å; I130-A134 VanDerWaalsContact O-CB 3.24Å; I130-A134 WeakPolarHBondContact O-CB 3.49Å; I130-A134 PolarHBondContact O-N 2.99Å; I131-A134 WeakPolarHBondContact O-CB 3.3Å; I131-A134 PolarHBondContact O-N 3.25Å; A134-H137 PolarHBondContact O-N 3.22Å; A134-I138 VanDerWaalsContact O-CG1 3.27Å; A134-I138 WeakPolarHBondContact O-CG1 3.16Å; A134-I138 PolarHBondContact O-N 3.37Å |
| 135 | I | 97.5 | Very high | 94.1 | Very high | 111 Ų | 111 | 64.2 Ų | 64.2 | 57% | 0.569 | 35% | 0.347 | S | S | * | . | H | α-helix | trans | -62.8 | -46.3 | 173.2 | -66 | 165.7 | 0 | 0 | 0 | 110.3 | I131 G132 I133 H137 I138 L139 | I131-I135 HydrophobicContact CG2-CD1 4.2Å; I131-I135 WeakPolarHBondContact O-CG1 3.34Å; I131-I135 PolarHBondContact O-N 2.92Å; G132-I135 PolarHBondContact O-N 3.48Å; I133-I135 VanDerWaalsContact C-N 3.31Å; I133-I135 PolarHBondContact O-N 3.45Å; I135-H137 VanDerWaalsContact C-N 3.33Å; I135-H137 PolarHBondContact O-N 2.86Å; I135-I138 PolarHBondContact O-N 2.92Å; I135-L139 WeakPolarHBondContact O-CB 3.46Å; I135-L139 PolarHBondContact O-N 3.41Å |
| 136 | I | 97.5 | Very high | 93.2 | Very high | 81 Ų | 81 | 66.1 Ų | 66.1 | 42% | 0.415 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -61.9 | -41.5 | 176.5 | -62.3 | 169.3 | 0 | 0 | 0 | 111 | T77 G132 I133 I138 L139 F140 | T77-I136 HydrophobicContact CG2-CG2 4.12Å; G132-I136 WeakPolarHBondContact O-CG1 3.38Å; G132-I136 PolarHBondContact O-N 3Å; I133-I136 PolarHBondContact O-N 3.31Å; I136-I138 PolarHBondContact O-N 3.37Å; I136-L139 WeakPolarHBondContact O-CB 3.34Å; I136-L139 PolarHBondContact O-N 3.08Å; I136-F140 HydrophobicContact CG2-CD2 4.04Å; I136-F140 HydrophobicContact CG2-CE2 3.6Å; I136-F140 HydrophobicContact CG2-CZ 4.16Å; I136-F140 WeakPolarHBondContact O-CD2 3.46Å; I136-F140 PolarHBondContact O-N 3.16Å |
| 137 | H | 95.6 | Very high | 92.4 | Very high | 31 Ų | 31 | 66.1 Ų | 66.1 | 14% | 0.144 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -61.3 | -44 | 177.2 | -175.9 | 74.1 | 0 | 0 | 0 | 111.8 | R74 T77 G78 I81 I133 A134 I135 F140 L141 | R74-H137 PolarHBondContact O-CE1 3.31Å; R74-H137 PolarHBondContact O-ND1 2.98Å; R74-H137 VanDerWaalsContact O-ND1 3.1Å; T77-H137 PolarHBondContact OG1-ND1 2.85Å; G78-H137 PolarHBondContact N-ND1 3.23Å; I81-H137 HydrophobicContact CD1-CB 3.78Å; I133-H137 WeakPolarHBondContact O-CB 3.47Å; I133-H137 PolarHBondContact O-N 3.37Å; A134-H137 PolarHBondContact O-N 3.22Å; I135-H137 VanDerWaalsContact C-N 3.33Å; I135-H137 PolarHBondContact O-N 2.86Å; H137-F140 PolarHBondContact O-N 3Å; H137-L141 PolarHBondContact O-N 3.04Å; H137-L141 VanDerWaalsContact O-N 3.16Å |
| 138 | I | 95.2 | Very high | 91.6 | Very high | 90 Ų | 90 | 66.7 Ų | 66.7 | 46% | 0.462 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -65.5 | -40.1 | 175.1 | -69 | 165.2 | 0 | 0 | 0 | 110.8 | A134 I135 I136 F140 L141 H142 | A134-I138 VanDerWaalsContact O-CG1 3.27Å; A134-I138 WeakPolarHBondContact O-CG1 3.16Å; A134-I138 PolarHBondContact O-N 3.37Å; I135-I138 PolarHBondContact O-N 2.92Å; I136-I138 PolarHBondContact O-N 3.37Å; I138-F140 PolarHBondContact O-N 3.46Å; I138-L141 WeakPolarHBondContact O-CA 3.36Å; I138-L141 VanDerWaalsContact O-CB 3.28Å; I138-L141 WeakPolarHBondContact O-CB 3.45Å; I138-L141 PolarHBondContact O-N 3.42Å; I138-H142 PolarHBondContact O-CD2 3.1Å; I138-H142 VanDerWaalsContact O-CD2 3.26Å; I138-H142 PolarHBondContact O-N 3.26Å |
| 139 | L | 96.1 | Very high | 90.7 | Very high | 97 Ų | 97 | 67 Ų | 67 | 51% | 0.508 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -57.8 | -47.7 | 176.1 | -179.4 | 66.4 | 0 | 0 | 0 | 111.4 | I135 I136 L141 H142 L143 | I135-L139 WeakPolarHBondContact O-CB 3.46Å; I135-L139 PolarHBondContact O-N 3.41Å; I136-L139 WeakPolarHBondContact O-CB 3.34Å; I136-L139 PolarHBondContact O-N 3.08Å; L139-L141 PolarHBondContact O-N 3.39Å; L139-H142 PolarHBondContact O-N 3.01Å; L139-H142 VanDerWaalsContact O-N 3.1Å; L139-L143 HydrophobicContact CG-CD1 4.36Å; L139-L143 WeakPolarHBondContact O-CG 3.25Å; L139-L143 PolarHBondContact O-N 2.96Å |
| 140 | F | 93 | Very high | 89.6 | Confident | 55 Ų | 55 | 70.6 Ų | 70.6 | 24% | 0.241 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -64.1 | -27.7 | 175.6 | -68.8 | -43.7 | 0 | 0 | 0 | 113 | R74 T77 I136 H137 I138 L143 N144 | R74-F140 WeakPolarHBondContact CD-O 3.5Å; R74-F140 HydrophobicContact CG-CB 3.54Å; T77-F140 HydrophobicContact CG2-CD2 3.79Å; T77-F140 HydrophobicContact CG2-CE2 3.65Å; I136-F140 HydrophobicContact CG2-CD2 4.04Å; I136-F140 HydrophobicContact CG2-CE2 3.6Å; I136-F140 HydrophobicContact CG2-CZ 4.16Å; I136-F140 WeakPolarHBondContact O-CD2 3.46Å; I136-F140 PolarHBondContact O-N 3.16Å; H137-F140 PolarHBondContact O-N 3Å; I138-F140 PolarHBondContact O-N 3.46Å; F140-L143 HydrophobicContact CD1-CD1 4.15Å; F140-N144 PolarHBondContact O-N 3.03Å; F140-N144 PolarHBondContact O-ND2 3.38Å |
| 141 | L | 89.9 | Confident | 88.1 | Confident | 68 Ų | 68 | 71.6 Ų | 71.6 | 36% | 0.356 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -68.9 | -38.6 | 172.7 | -168.9 | 149.3 | 0 | 0 | 0 | 111.9 | H137 I138 L139 G145 | H137-L141 PolarHBondContact O-N 3.04Å; H137-L141 VanDerWaalsContact O-N 3.16Å; I138-L141 WeakPolarHBondContact O-CA 3.36Å; I138-L141 VanDerWaalsContact O-CB 3.28Å; I138-L141 WeakPolarHBondContact O-CB 3.45Å; I138-L141 PolarHBondContact O-N 3.42Å; L139-L141 PolarHBondContact O-N 3.39Å; L141-G145 CarbonylContact O-C 3.57Å; L141-G145 VanDerWaalsContact O-CA 3.31Å; L141-G145 WeakPolarHBondContact O-CA 3.49Å; L141-G145 PolarHBondContact O-N 3.02Å |
| 142 | H | 89.6 | Confident | 86.4 | Confident | 143 Ų | 143 | 71 Ų | 71 | 66% | 0.662 | 39% | 0.392 | S | S | * | . | H | α-helix | trans | -66.9 | -42 | 174 | -79.6 | -76.4 | 0 | 0 | 0 | 112.4 | I138 L139 | I138-H142 PolarHBondContact O-CD2 3.1Å; I138-H142 VanDerWaalsContact O-CD2 3.26Å; I138-H142 PolarHBondContact O-N 3.26Å; L139-H142 PolarHBondContact O-N 3.01Å; L139-H142 VanDerWaalsContact O-N 3.1Å |
| 143 | L | 89 | Confident | 84.8 | Confident | 120 Ų | 120 | 73.6 Ų | 73.6 | 63% | 0.628 | 40% | 0.396 | S | S | * | . | H | α-helix | trans | -64.8 | -44.8 | -179.2 | -68.1 | 173 | 0 | 0 | 0 | 112.5 | L139 F140 | L139-L143 HydrophobicContact CG-CD1 4.36Å; L139-L143 WeakPolarHBondContact O-CG 3.25Å; L139-L143 PolarHBondContact O-N 2.96Å; F140-L143 HydrophobicContact CD1-CD1 4.15Å |
| 144 | N | 81.8 | Confident | 83 | Confident | 65 Ų | 65 | 74.4 Ų | 74.4 | 35% | 0.348 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -96.3 | -6.1 | -174.3 | -62.1 | -45.2 | 0 | 0 | 0 | 114.2 | L71 F140 H153 | L71-N144 HydrophobicContact CD1-CB 3.77Å; L71-N144 HydrophobicContact CD2-CB 4.12Å; F140-N144 PolarHBondContact O-N 3.03Å; F140-N144 PolarHBondContact O-ND2 3.38Å; N144-H153 PolarHBondContact O-ND1 3.28Å |
| 145 | G | 79.8 | Confident | 81.5 | Confident | 28 Ų | 28 | 77.5 Ų | 77.5 | 29% | 0.289 | 42% | 0.421 | S | S | . | . | trans | 67.3 | 167.5 | -173.4 | 0 | 0 | 0 | 0 | 0 | 113.9 | R74 L141 | R74-G145 PolarHBondContact NH1-O 3.16Å; L141-G145 CarbonylContact O-C 3.57Å; L141-G145 VanDerWaalsContact O-CA 3.31Å; L141-G145 WeakPolarHBondContact O-CA 3.49Å; L141-G145 PolarHBondContact O-N 3.02Å | ||
| 146 | R | 76.7 | Confident | 80 | Confident | 124 Ų | 124 | 79.9 Ų | 79.9 | 47% | 0.468 | 44% | 0.435 | S | S | . | . | P | Polyproline II helix | trans | -80.4 | 143.9 | -178.2 | -170.4 | -175.6 | 162.5 | 179.3 | -6.1 | 111.6 | ||
| 147 | S | 79.6 | Confident | 78.8 | Confident | 14 Ų | 14 | 82.8 Ų | 82.8 | 10% | 0.098 | 45% | 0.449 | C | S | . | . | P | Polyproline II helix | trans | -77.5 | 140.2 | 166.4 | 41.2 | 0 | 0 | 0 | 0 | 111.3 | S68 | S68-S147 PolarHBondContact OG-OG 3.18Š|
| 148 | N | 79.1 | Confident | 78.1 | Confident | 30 Ų | 30 | 89.5 Ų | 89.5 | 16% | 0.16 | 48% | 0.478 | C | S | . | . | P | Polyproline II helix | trans | -91.9 | 169 | 173.3 | 69.4 | 14.7 | 0 | 0 | 0 | 110.9 | L150 G151 S152 S154 | N148-L150 PolarHBondContact O-N 3.02Å; N148-L150 WeakPolarHBondContact OD1-CA 3.14Å; N148-L150 WeakPolarHBondContact OD1-CB 3.35Å; N148-L150 PolarHBondContact OD1-N 3.45Å; N148-L150 VanDerWaalsContact OD1-N 3.08Å; N148-G151 PolarHBondContact O-N 2.87Å; N148-G151 PolarHBondContact OD1-N 3.23Å; N148-G151 VanDerWaalsContact OD1-N 3.11Å; N148-S152 PolarHBondContact ND2-O 3.27Å; N148-S152 VanDerWaalsContact ND2-O 3.17Å; N148-S152 PolarHBondContact ND2-OG 3.44Å; N148-S152 PolarHBondContact OD1-N 3.28Å; N148-S152 PolarHBondContact OD1-O 2.99Å; N148-S152 PolarHBondContact OD1-OG 3.19Å; N148-S154 PolarHBondContact ND2-OG 3.1Å |
| 149 | P | 79.2 | Confident | 77.7 | Confident | 107 Ų | 107 | 89.8 Ų | 89.8 | 70% | 0.695 | 48% | 0.48 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.8 | -21.6 | 176.3 | -23.8 | 34.8 | 0 | 0 | 0 | 114.3 | G151 | P149-G151 PolarHBondContact O-N 2.94Š|
| 150 | L | 74.5 | Confident | 77.3 | Confident | 153 Ų | 153 | 93.4 Ų | 93.4 | 80% | 0.801 | 49% | 0.491 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -79.4 | 2.6 | 175.5 | -60.5 | 171 | 0 | 0 | 0 | 112.6 | N148 S152 | N148-L150 PolarHBondContact O-N 3.02Å; N148-L150 WeakPolarHBondContact OD1-CA 3.14Å; N148-L150 WeakPolarHBondContact OD1-CB 3.35Å; N148-L150 PolarHBondContact OD1-N 3.45Å; N148-L150 VanDerWaalsContact OD1-N 3.08Å; L150-S152 PolarHBondContact O-N 3.35Å; L150-S152 VanDerWaalsContact O-N 3.11Å |
| 151 | G | 66.2 | Low | 77.2 | Confident | 28 Ų | 28 | 96.6 Ų | 96.6 | 29% | 0.289 | 51% | 0.505 | S | S | . | . | S | Bend | trans | 67.4 | 7.3 | -177.9 | 0 | 0 | 0 | 0 | 0 | 114.2 | N148 P149 | N148-G151 PolarHBondContact O-N 2.87Å; N148-G151 PolarHBondContact OD1-N 3.23Å; N148-G151 VanDerWaalsContact OD1-N 3.11Å; P149-G151 PolarHBondContact O-N 2.94Å |
| 152 | S | 62.8 | Low | 77.3 | Confident | 51 Ų | 51 | 101.4 Ų | 101.4 | 36% | 0.357 | 52% | 0.52 | S | S | . | . | trans | -99.6 | 139.1 | -179.6 | 70.1 | 0 | 0 | 0 | 0 | 111.5 | N148 L150 S154 | N148-S152 PolarHBondContact ND2-O 3.27Å; N148-S152 VanDerWaalsContact ND2-O 3.17Å; N148-S152 PolarHBondContact ND2-OG 3.44Å; N148-S152 PolarHBondContact OD1-N 3.28Å; N148-S152 PolarHBondContact OD1-O 2.99Å; N148-S152 PolarHBondContact OD1-OG 3.19Å; L150-S152 PolarHBondContact O-N 3.35Å; L150-S152 VanDerWaalsContact O-N 3.11Å; S152-S154 PolarHBondContact O-N 3.41Å | ||
| 153 | H | 63.6 | Low | 77.5 | Confident | 90 Ų | 90 | 97.3 Ų | 97.3 | 42% | 0.417 | 51% | 0.506 | S | S | . | . | trans | -76.1 | 99.4 | 160.9 | -71.2 | -83.5 | 0 | 0 | 0 | 106.2 | L71 N144 P155 | L71-H153 WeakPolarHBondContact CD1-CE1 3.29Å; L71-H153 WeakPolarHBondContact CD1-NE2 3.27Å; N144-H153 PolarHBondContact O-ND1 3.28Å; H153-P155 WeakPolarHBondContact O-CD 3.43Å | ||
| 154 | S | 60.4 | Low | 77.7 | Confident | 47 Ų | 47 | 97.6 Ų | 97.6 | 33% | 0.329 | 50% | 0.502 | S | S | . | . | trans | -95 | 96.9 | 179.6 | 34.8 | 0 | 0 | 0 | 0 | 109.5 | N148 S152 L156 | N148-S154 PolarHBondContact ND2-OG 3.1Å; S152-S154 PolarHBondContact O-N 3.41Å; S154-L156 PolarHBondContact O-N 2.9Å | ||
| 155 | P | 65.3 | Low | 78.2 | Confident | 95 Ų | 95 | 97 Ų | 97 | 62% | 0.617 | 50% | 0.497 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -67.5 | -20.5 | 170.1 | 27.7 | -34.2 | 0 | 0 | 0 | 112.2 | H153 I157 | H153-P155 WeakPolarHBondContact O-CD 3.43Å; P155-I157 PolarHBondContact O-N 3.1Å |
| 156 | L | 65.4 | Low | 78.8 | Confident | 161 Ų | 161 | 97.6 Ų | 97.6 | 84% | 0.843 | 50% | 0.495 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.4 | -27.2 | -169.4 | -61.6 | 172 | 0 | 0 | 0 | 114.2 | S154 | S154-L156 PolarHBondContact O-N 2.9Š|
| 157 | I | 72.4 | Confident | 79.7 | Confident | 142 Ų | 142 | 95 Ų | 95 | 73% | 0.728 | 50% | 0.496 | S | S | * | . | trans | -135.9 | 92.1 | -178.2 | -53.2 | 176.5 | 0 | 0 | 0 | 109.2 | P155 | P155-I157 PolarHBondContact O-N 3.1Š| ||
| 158 | K | 80.3 | Confident | 80.4 | Confident | 172 Ų | 172 | 100 Ų | 100 | 75% | 0.748 | 52% | 0.516 | S | S | * | . | trans | -110.3 | 125.6 | 171.4 | -67.7 | -177.5 | -177.8 | 176.4 | 0 | 109.4 | ||||
| 159 | I | 86.1 | Confident | 81.1 | Confident | 96 Ų | 96 | 102.5 Ų | 102.5 | 49% | 0.492 | 53% | 0.529 | S | S | . | . | trans | -100.6 | 149.3 | 169.2 | 57 | 174.9 | 0 | 0 | 0 | 109.6 | F164 F165 | I159-F164 HydrophobicContact CB-CD2 4.4Å; I159-F164 HydrophobicContact CD1-CB 4.14Å; I159-F164 HydrophobicContact CD1-CD2 4.35Å; I159-F164 HydrophobicContact CD1-CG 4.27Å; I159-F165 HydrophobicContact CD1-CD2 4.46Å; I159-F165 HydrophobicContact CD1-CE2 3.75Å; I159-F165 HydrophobicContact CD1-CZ 4.13Å; I159-F165 HydrophobicContact CG1-CD2 4.48Å; I159-F165 HydrophobicContact CG1-CE2 3.68Å; I159-F165 HydrophobicContact CG1-CZ 4.36Å | ||
| 160 | K | 89.4 | Confident | 81.8 | Confident | 172 Ų | 172 | 101.9 Ų | 101.9 | 75% | 0.748 | 52% | 0.519 | S | S | * | . | trans | -60.2 | 145.8 | 175.5 | -69.3 | -176.3 | 179.7 | 179.2 | 0 | 110.4 | Y162 | K160-Y162 WeakPolarHBondContact CB-O 3.35Š| ||
| 161 | F | 89.3 | Confident | 82.8 | Confident | 123 Ų | 123 | 99.5 Ų | 99.5 | 54% | 0.539 | 51% | 0.507 | S | S | . | . | S | Bend | trans | -62 | -51 | 179.1 | -173.6 | -88.9 | 0 | 0 | 0 | 111.5 | P163 F164 F165 T166 | F161-P163 CarbonylContact O-C 3.58Å; F161-F164 PolarHBondContact O-N 3.06Å; F161-F165 HydrophobicContact CD1-CB 4.4Å; F161-F165 HydrophobicContact CD2-CB 3.58Å; F161-F165 HydrophobicContact CD2-CD2 4.26Å; F161-F165 HydrophobicContact CD2-CG 4.17Å; F161-F165 HydrophobicContact CE1-CB 4.32Å; F161-F165 HydrophobicContact CE2-CB 3.48Å; F161-F165 VanDerWaalsContact CE2-CB 3.48Å; F161-F165 HydrophobicContact CE2-CG 4.3Å; F161-F165 HydrophobicContact CG-CB 4.05Å; F161-F165 HydrophobicContact CZ-CB 3.88Å; F161-F165 WeakPolarHBondContact O-CB 3.41Å; F161-F165 PolarHBondContact O-N 3.03Å; F161-T166 WeakPolarHBondContact CD1-OG1 3.32Å; F161-T166 WeakPolarHBondContact CE1-OG1 3.47Å; F161-T166 PolarHBondContact O-N 3.08Å |
| 162 | Y | 92.4 | Very high | 84.1 | Confident | 169 Ų | 169 | 100.9 Ų | 100.9 | 66% | 0.663 | 51% | 0.508 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -88.4 | 135.9 | 170.2 | -176.2 | -93.2 | 0 | 0 | 0 | 109.9 | K160 T166 | K160-Y162 WeakPolarHBondContact CB-O 3.35Å; Y162-T166 HydrophobicContact CD2-CG2 4.17Å |
| 163 | P | 94.5 | Very high | 85.4 | Confident | 56 Ų | 56 | 101.1 Ų | 101.1 | 36% | 0.364 | 50% | 0.504 | S | S | . | . | T | Hydrogen-bonded Turn | cis | -89.2 | -14.7 | 0.8 | 34.1 | -34.6 | 0 | 0 | 0 | 114.1 | F161 T166 S167 | F161-P163 CarbonylContact O-C 3.58Å; P163-T166 PolarHBondContact O-N 3.3Å; P163-S167 PolarHBondContact O-N 2.95Å; P163-S167 PolarHBondContact O-OG 2.89Å; P163-S167 VanDerWaalsContact O-OG 3.1Å |
| 164 | F | 93.2 | Very high | 86.8 | Confident | 126 Ų | 126 | 101.6 Ų | 101.6 | 55% | 0.553 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -61 | -54.4 | -163.3 | -61.3 | -74.3 | 0 | 0 | 0 | 114.6 | I159 F161 K168 | I159-F164 HydrophobicContact CB-CD2 4.4Å; I159-F164 HydrophobicContact CD1-CB 4.14Å; I159-F164 HydrophobicContact CD1-CD2 4.35Å; I159-F164 HydrophobicContact CD1-CG 4.27Å; F161-F164 PolarHBondContact O-N 3.06Å; F164-K168 WeakPolarHBondContact O-CB 3.49Å; F164-K168 PolarHBondContact O-N 3Å |
| 165 | F | 91.1 | Very high | 88.4 | Confident | 54 Ų | 54 | 103.4 Ų | 103.4 | 24% | 0.237 | 52% | 0.516 | C | S | . | . | H | α-helix | trans | -75.8 | -31.4 | -179.2 | -70.6 | -74.9 | 0 | 0 | 0 | 111.6 | I159 F161 K168 D169 | I159-F165 HydrophobicContact CD1-CD2 4.46Å; I159-F165 HydrophobicContact CD1-CE2 3.75Å; I159-F165 HydrophobicContact CD1-CZ 4.13Å; I159-F165 HydrophobicContact CG1-CD2 4.48Å; I159-F165 HydrophobicContact CG1-CE2 3.68Å; I159-F165 HydrophobicContact CG1-CZ 4.36Å; F161-F165 HydrophobicContact CD1-CB 4.4Å; F161-F165 HydrophobicContact CD2-CB 3.58Å; F161-F165 HydrophobicContact CD2-CD2 4.26Å; F161-F165 HydrophobicContact CD2-CG 4.17Å; F161-F165 HydrophobicContact CE1-CB 4.32Å; F161-F165 HydrophobicContact CE2-CB 3.48Å; F161-F165 VanDerWaalsContact CE2-CB 3.48Å; F161-F165 HydrophobicContact CE2-CG 4.3Å; F161-F165 HydrophobicContact CG-CB 4.05Å; F161-F165 HydrophobicContact CZ-CB 3.88Å; F161-F165 WeakPolarHBondContact O-CB 3.41Å; F161-F165 PolarHBondContact O-N 3.03Å; F165-K168 PolarHBondContact O-N 3.38Å; F165-D169 VanDerWaalsContact O-CB 3.31Å; F165-D169 WeakPolarHBondContact O-CB 3.28Å; F165-D169 VanDerWaalsContact O-CG 3.24Å; F165-D169 PolarHBondContact O-N 2.87Å |
| 166 | T | 93.9 | Very high | 89.6 | Confident | 40 Ų | 40 | 103.4 Ų | 103.4 | 25% | 0.245 | 51% | 0.506 | C | S | . | . | H | α-helix | trans | -59.5 | -51.4 | 173.6 | -52.2 | 0 | 0 | 0 | 0 | 111.8 | F161 Y162 P163 K168 D169 L170 | F161-T166 WeakPolarHBondContact CD1-OG1 3.32Å; F161-T166 WeakPolarHBondContact CE1-OG1 3.47Å; F161-T166 PolarHBondContact O-N 3.08Å; Y162-T166 HydrophobicContact CD2-CG2 4.17Å; P163-T166 PolarHBondContact O-N 3.3Å; T166-K168 VanDerWaalsContact C-N 3.33Å; T166-K168 PolarHBondContact O-N 3.4Å; T166-D169 PolarHBondContact O-N 3.28Å; T166-L170 HydrophobicContact CG2-CD1 4.32Å; T166-L170 WeakPolarHBondContact O-CG 3.32Å; T166-L170 PolarHBondContact O-N 3.5Å |
| 167 | S | 95.3 | Very high | 90.8 | Very high | 70 Ų | 70 | 96.8 Ų | 96.8 | 49% | 0.49 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -64 | -39.7 | 179.1 | -58.1 | 0 | 0 | 0 | 0 | 111.8 | P163 L170 L171 | P163-S167 PolarHBondContact O-N 2.95Å; P163-S167 PolarHBondContact O-OG 2.89Å; P163-S167 VanDerWaalsContact O-OG 3.1Å; S167-L170 PolarHBondContact O-N 2.81Å; S167-L171 PolarHBondContact O-N 3.04Å |
| 168 | K | 94.4 | Very high | 91.8 | Very high | 119 Ų | 119 | 96.1 Ų | 96.1 | 52% | 0.517 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -63.2 | -42.3 | 175.6 | -179.6 | 170.3 | -178.1 | 160.8 | 0 | 112.3 | F164 F165 T166 L171 N172 | F164-K168 WeakPolarHBondContact O-CB 3.49Å; F164-K168 PolarHBondContact O-N 3Å; F165-K168 PolarHBondContact O-N 3.38Å; T166-K168 VanDerWaalsContact C-N 3.33Å; T166-K168 PolarHBondContact O-N 3.4Å; K168-L171 PolarHBondContact O-N 3.21Å; K168-N172 WeakPolarHBondContact O-CB 3.49Å; K168-N172 PolarHBondContact O-N 3.37Å; K168-N172 PolarHBondContact O-ND2 3.2Å |
| 169 | D | 93 | Very high | 92.3 | Very high | 81 Ų | 81 | 94 Ų | 94 | 43% | 0.433 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -70.7 | -36.8 | -179.4 | -73.8 | -13 | 0 | 0 | 0 | 111.6 | F165 T166 N172 L173 | F165-D169 VanDerWaalsContact O-CB 3.31Å; F165-D169 WeakPolarHBondContact O-CB 3.28Å; F165-D169 VanDerWaalsContact O-CG 3.24Å; F165-D169 PolarHBondContact O-N 2.87Å; T166-D169 PolarHBondContact O-N 3.28Å; D169-N172 PolarHBondContact O-N 3.25Å; D169-L173 WeakPolarHBondContact O-CB 3.5Å; D169-L173 PolarHBondContact O-N 3.21Å |
| 170 | L | 93.6 | Very high | 92.7 | Very high | 94 Ų | 94 | 90.1 Ų | 90.1 | 49% | 0.492 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -62 | -45.7 | 172 | -77.7 | 168.4 | 0 | 0 | 0 | 112.2 | T166 S167 L173 N174 | T166-L170 HydrophobicContact CG2-CD1 4.32Å; T166-L170 WeakPolarHBondContact O-CG 3.32Å; T166-L170 PolarHBondContact O-N 3.5Å; S167-L170 PolarHBondContact O-N 2.81Å; L170-L173 WeakPolarHBondContact O-CB 3.19Å; L170-L173 PolarHBondContact O-N 3.23Å; L170-N174 PolarHBondContact O-N 3.2Å; L170-N174 PolarHBondContact O-ND2 3.28Å |
| 171 | L | 95.4 | Very high | 92.8 | Very high | 103 Ų | 103 | 87.7 Ų | 87.7 | 54% | 0.539 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -62 | -46.5 | 177.1 | -174.6 | 144.3 | 0 | 0 | 0 | 111.3 | S167 K168 L173 N174 L175 | S167-L171 PolarHBondContact O-N 3.04Å; K168-L171 PolarHBondContact O-N 3.21Å; L171-L173 VanDerWaalsContact C-N 3.27Å; L171-L173 PolarHBondContact O-N 2.9Å; L171-N174 PolarHBondContact O-N 3.41Å; L171-L175 HydrophobicContact CD2-CD1 3.6Å; L171-L175 HydrophobicContact CD2-CG 4.36Å; L171-L175 WeakPolarHBondContact O-CG 3.28Å; L171-L175 PolarHBondContact O-N 2.85Å |
| 172 | N | 93 | Very high | 92.9 | Very high | 58 Ų | 58 | 85.8 Ų | 85.8 | 31% | 0.31 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -62.1 | -35.4 | 176.1 | -71.8 | -32.7 | 0 | 0 | 0 | 112.5 | K168 D169 K176 | K168-N172 WeakPolarHBondContact O-CB 3.49Å; K168-N172 PolarHBondContact O-N 3.37Å; K168-N172 PolarHBondContact O-ND2 3.2Å; D169-N172 PolarHBondContact O-N 3.25Å; N172-K176 WeakPolarHBondContact O-CB 3.35Å; N172-K176 VanDerWaalsContact O-CG 3.25Å; N172-K176 WeakPolarHBondContact O-CG 3.5Å; N172-K176 PolarHBondContact O-N 3.39Å; N172-K176 VanDerWaalsContact O-N 3.08Å |
| 173 | L | 91.9 | Very high | 92.9 | Very high | 55 Ų | 55 | 81.3 Ų | 81.3 | 29% | 0.288 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -67.4 | -45.9 | 177.7 | -178.7 | 146.2 | 0 | 0 | 0 | 111 | M1 D169 L170 L171 K176 N177 | M1-L173 HydrophobicContact CB-CD1 4.21Å; M1-L173 HydrophobicContact CE-CD1 3.86Å; M1-L173 HydrophobicContact CE-CD2 3.81Å; M1-L173 HydrophobicContact CE-CG 3.52Å; M1-L173 HydrophobicContact SD-CD1 3.63Å; M1-L173 HydrophobicContact SD-CD2 3.74Å; M1-L173 HydrophobicContact SD-CG 3.8Å; D169-L173 WeakPolarHBondContact O-CB 3.5Å; D169-L173 PolarHBondContact O-N 3.21Å; L170-L173 WeakPolarHBondContact O-CB 3.19Å; L170-L173 PolarHBondContact O-N 3.23Å; L171-L173 VanDerWaalsContact C-N 3.27Å; L171-L173 PolarHBondContact O-N 2.9Å; L173-K176 PolarHBondContact O-N 2.95Å; L173-N177 WeakPolarHBondContact O-CB 3.35Å; L173-N177 PolarHBondContact O-N 3.1Å |
| 174 | N | 92.3 | Very high | 92.8 | Very high | 100 Ų | 100 | 79.3 Ų | 79.3 | 54% | 0.535 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -62.6 | -43.1 | 177.1 | -70.9 | -19.5 | 0 | 0 | 0 | 111.7 | L170 L171 N177 F178 | L170-N174 PolarHBondContact O-N 3.2Å; L170-N174 PolarHBondContact O-ND2 3.28Å; L171-N174 PolarHBondContact O-N 3.41Å; N174-N177 PolarHBondContact O-N 2.83Å; N174-F178 WeakPolarHBondContact O-CB 3.45Å; N174-F178 PolarHBondContact O-N 3.01Å |
| 175 | L | 93.4 | Very high | 92.6 | Very high | 85 Ų | 85 | 78.7 Ų | 78.7 | 45% | 0.445 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -61.1 | -48.6 | 175.9 | -72.6 | 173.5 | 0 | 0 | 0 | 112 | L171 N177 F178 F179 | L171-L175 HydrophobicContact CD2-CD1 3.6Å; L171-L175 HydrophobicContact CD2-CG 4.36Å; L171-L175 WeakPolarHBondContact O-CG 3.28Å; L171-L175 PolarHBondContact O-N 2.85Å; L175-N177 VanDerWaalsContact C-N 3.3Å; L175-N177 PolarHBondContact O-N 3.22Å; L175-F178 WeakPolarHBondContact O-CB 3.41Å; L175-F178 PolarHBondContact O-N 3.48Å; L175-F179 WeakPolarHBondContact O-CD2 3.27Å; L175-F179 PolarHBondContact O-N 2.66Å |
| 176 | K | 91.3 | Very high | 92.6 | Very high | 95 Ų | 95 | 79.7 Ų | 79.7 | 41% | 0.413 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -60 | -41.4 | 178.3 | -73.5 | 169.9 | -175.4 | 179.3 | 0 | 112 | L55 N172 L173 F180 | L55-K176 HydrophobicContact CD1-CD 4.48Å; L55-K176 HydrophobicContact CD2-CD 3.9Å; L55-K176 HydrophobicContact CD2-CG 4.49Å; N172-K176 WeakPolarHBondContact O-CB 3.35Å; N172-K176 VanDerWaalsContact O-CG 3.25Å; N172-K176 WeakPolarHBondContact O-CG 3.5Å; N172-K176 PolarHBondContact O-N 3.39Å; N172-K176 VanDerWaalsContact O-N 3.08Å; L173-K176 PolarHBondContact O-N 2.95Å; K176-F180 WeakPolarHBondContact O-CB 3.36Å; K176-F180 PolarHBondContact O-N 3.44Å |
| 177 | N | 90.2 | Very high | 92.4 | Very high | 22 Ų | 22 | 80.2 Ų | 80.2 | 12% | 0.118 | 41% | 0.408 | C | S | . | . | H | α-helix | trans | -65.3 | -44.4 | 175.9 | -81.2 | -3.1 | 0 | 0 | 0 | 112.2 | M1 L173 N174 L175 F179 F180 Y181 | M1-N177 WeakPolarHBondContact CE-ND2 3.42Å; M1-N177 WeakPolarHBondContact CE-OD1 3.31Å; L173-N177 WeakPolarHBondContact O-CB 3.35Å; L173-N177 PolarHBondContact O-N 3.1Å; N174-N177 PolarHBondContact O-N 2.83Å; L175-N177 VanDerWaalsContact C-N 3.3Å; L175-N177 PolarHBondContact O-N 3.22Å; N177-F179 PolarHBondContact O-N 2.99Å; N177-F180 PolarHBondContact O-N 3.44Å; N177-F180 VanDerWaalsContact O-N 3.16Å; N177-Y181 HydrophobicContact CB-CD2 4.19Å; N177-Y181 HydrophobicContact CB-CE2 3.91Å; N177-Y181 WeakPolarHBondContact O-CD2 3.49Å; N177-Y181 PolarHBondContact O-N 3.13Å |
| 178 | F | 93.2 | Very high | 92.1 | Very high | 129 Ų | 129 | 78.5 Ų | 78.5 | 57% | 0.566 | 39% | 0.393 | S | S | * | . | H | α-helix | trans | -56.4 | -50.8 | 177.8 | 176.4 | -99.2 | 0 | 0 | 0 | 111.1 | N174 L175 F180 Y181 L182 | N174-F178 WeakPolarHBondContact O-CB 3.45Å; N174-F178 PolarHBondContact O-N 3.01Å; L175-F178 WeakPolarHBondContact O-CB 3.41Å; L175-F178 PolarHBondContact O-N 3.48Å; F178-F180 VanDerWaalsContact C-N 3.33Å; F178-F180 PolarHBondContact O-N 3.05Å; F178-Y181 PolarHBondContact O-N 3.07Å; F178-L182 WeakPolarHBondContact O-CB 3.31Å; F178-L182 PolarHBondContact O-N 3.36Å |
| 179 | F | 92.2 | Very high | 91.7 | Very high | 127 Ų | 127 | 78.9 Ų | 78.9 | 56% | 0.557 | 40% | 0.395 | S | S | * | . | H | α-helix | trans | -62 | -39.7 | 176.1 | -75 | -67.4 | 0 | 0 | 0 | 112.5 | L175 N177 L182 V183 | L175-F179 WeakPolarHBondContact O-CD2 3.27Å; L175-F179 PolarHBondContact O-N 2.66Å; N177-F179 PolarHBondContact O-N 2.99Å; F179-L182 PolarHBondContact O-N 3Å; F179-V183 WeakPolarHBondContact O-CG2 3.4Å; F179-V183 PolarHBondContact O-N 2.99Å |
| 180 | F | 92.8 | Very high | 91.4 | Very high | 14 Ų | 14 | 80.1 Ų | 80.1 | 6% | 0.061 | 40% | 0.401 | C | S | . | . | H | α-helix | trans | -63.1 | -46.4 | 177.8 | -177.7 | -116.1 | 0 | 0 | 0 | 112.5 | N47 L51 K176 N177 F178 V183 L184 | N47-F180 HydrophobicContact CB-CE2 3.87Å; N47-F180 HydrophobicContact CB-CZ 4.35Å; L51-F180 HydrophobicContact CB-CD2 4.38Å; L51-F180 HydrophobicContact CD2-CB 3.72Å; L51-F180 HydrophobicContact CD2-CD2 3.36Å; L51-F180 HydrophobicContact CD2-CE2 4.14Å; L51-F180 HydrophobicContact CD2-CG 3.7Å; K176-F180 WeakPolarHBondContact O-CB 3.36Å; K176-F180 PolarHBondContact O-N 3.44Å; N177-F180 PolarHBondContact O-N 3.44Å; N177-F180 VanDerWaalsContact O-N 3.16Å; F178-F180 VanDerWaalsContact C-N 3.33Å; F178-F180 PolarHBondContact O-N 3.05Å; F180-V183 PolarHBondContact O-N 2.95Å; F180-L184 HydrophobicContact CD1-CD1 3.91Å; F180-L184 HydrophobicContact CE1-CD1 3.47Å; F180-L184 VanDerWaalsContact CE1-CD1 3.47Å; F180-L184 HydrophobicContact CE1-CG 4.34Å; F180-L184 HydrophobicContact CE2-CD1 4.4Å; F180-L184 HydrophobicContact CE2-CG 4.45Å; F180-L184 HydrophobicContact CZ-CD1 3.76Å; F180-L184 HydrophobicContact CZ-CD2 4.49Å; F180-L184 HydrophobicContact CZ-CG 4.23Å; F180-L184 WeakPolarHBondContact O-CG 3.32Å; F180-L184 PolarHBondContact O-N 3.5Å |
| 181 | Y | 91.4 | Very high | 90.9 | Very high | 121 Ų | 121 | 76.8 Ų | 76.8 | 48% | 0.475 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -68.3 | -34.8 | 177.8 | -67 | -53.8 | 0 | 0 | 0 | 112.4 | N177 F178 L184 L185 | N177-Y181 HydrophobicContact CB-CD2 4.19Å; N177-Y181 HydrophobicContact CB-CE2 3.91Å; N177-Y181 WeakPolarHBondContact O-CD2 3.49Å; N177-Y181 PolarHBondContact O-N 3.13Å; F178-Y181 PolarHBondContact O-N 3.07Å; Y181-L184 HydrophobicContact CD1-CD1 4.17Å; Y181-L184 PolarHBondContact O-N 3.37Å; Y181-L185 WeakPolarHBondContact O-CB 3.22Å; Y181-L185 PolarHBondContact O-N 3.39Å |
| 182 | L | 92.7 | Very high | 90.1 | Very high | 83 Ų | 83 | 76 Ų | 76 | 44% | 0.435 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -59.8 | -48.1 | 173.2 | -175.5 | 69.8 | 0 | 0 | 0 | 111 | F178 F179 L184 L185 C186 | F178-L182 WeakPolarHBondContact O-CB 3.31Å; F178-L182 PolarHBondContact O-N 3.36Å; F179-L182 PolarHBondContact O-N 3Å; L182-L184 PolarHBondContact O-N 3.25Å; L182-L185 PolarHBondContact O-N 2.83Å; L182-C186 PolarHBondContact O-N 2.86Å; L182-C186 PolarHBondContact O-SG 3.2Å; L182-C186 VanDerWaalsContact O-SG 3.39Å |
| 183 | V | 91.8 | Very high | 89.3 | Confident | 76 Ų | 76 | 79.1 Ų | 79.1 | 46% | 0.461 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -61.6 | -44.1 | 176.8 | 171.9 | 0 | 0 | 0 | 0 | 111.2 | F179 F180 L185 C186 I187 | F179-V183 WeakPolarHBondContact O-CG2 3.4Å; F179-V183 PolarHBondContact O-N 2.99Å; F180-V183 PolarHBondContact O-N 2.95Å; V183-L185 VanDerWaalsContact C-N 3.32Å; V183-L185 PolarHBondContact O-N 3.27Å; V183-C186 PolarHBondContact O-N 3.29Å; V183-I187 HydrophobicContact CG1-CD1 3.92Å; V183-I187 WeakPolarHBondContact O-CG1 3.38Å; V183-I187 PolarHBondContact O-N 2.74Å |
| 184 | L | 91.8 | Very high | 88.3 | Confident | 13 Ų | 13 | 80.6 Ų | 80.6 | 7% | 0.068 | 40% | 0.403 | C | S | . | . | H | α-helix | trans | -59.5 | -43.2 | 175.8 | -75.2 | 174.6 | 0 | 0 | 0 | 111.7 | L43 I44 N47 F180 Y181 L182 C186 I187 L188 | L43-L184 HydrophobicContact CB-CD2 4.12Å; I44-L184 HydrophobicContact CG1-CD1 3.99Å; N47-L184 HydrophobicContact CB-CD2 4.01Å; F180-L184 HydrophobicContact CD1-CD1 3.91Å; F180-L184 HydrophobicContact CE1-CD1 3.47Å; F180-L184 VanDerWaalsContact CE1-CD1 3.47Å; F180-L184 HydrophobicContact CE1-CG 4.34Å; F180-L184 HydrophobicContact CE2-CD1 4.4Å; F180-L184 HydrophobicContact CE2-CG 4.45Å; F180-L184 HydrophobicContact CZ-CD1 3.76Å; F180-L184 HydrophobicContact CZ-CD2 4.49Å; F180-L184 HydrophobicContact CZ-CG 4.23Å; F180-L184 WeakPolarHBondContact O-CG 3.32Å; F180-L184 PolarHBondContact O-N 3.5Å; Y181-L184 HydrophobicContact CD1-CD1 4.17Å; Y181-L184 PolarHBondContact O-N 3.37Å; L182-L184 PolarHBondContact O-N 3.25Å; L184-C186 PolarHBondContact O-N 2.97Å; L184-I187 PolarHBondContact O-N 3.02Å; L184-L188 VanDerWaalsContact O-CG 3.22Å; L184-L188 WeakPolarHBondContact O-CG 3.17Å; L184-L188 PolarHBondContact O-N 3.21Å |
| 185 | L | 90.9 | Very high | 87.1 | Confident | 114 Ų | 114 | 80.9 Ų | 80.9 | 60% | 0.597 | 40% | 0.404 | S | S | * | . | H | α-helix | trans | -63.8 | -40.6 | 178.1 | -170.4 | 136.9 | 0 | 0 | 0 | 111.9 | Y181 L182 V183 I187 L188 F189 | Y181-L185 WeakPolarHBondContact O-CB 3.22Å; Y181-L185 PolarHBondContact O-N 3.39Å; L182-L185 PolarHBondContact O-N 2.83Å; V183-L185 VanDerWaalsContact C-N 3.32Å; V183-L185 PolarHBondContact O-N 3.27Å; L185-I187 PolarHBondContact O-N 3.47Å; L185-L188 PolarHBondContact O-N 3.43Å; L185-F189 WeakPolarHBondContact O-CB 3.4Å; L185-F189 PolarHBondContact O-N 3.27Å |
| 186 | C | 90.7 | Very high | 85.6 | Confident | 74 Ų | 74 | 79 Ų | 79 | 50% | 0.5 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -60.3 | -43.5 | 172.6 | -69 | 0 | 0 | 0 | 0 | 112.2 | L182 V183 L184 F189 L190 | L182-C186 PolarHBondContact O-N 2.86Å; L182-C186 PolarHBondContact O-SG 3.2Å; L182-C186 VanDerWaalsContact O-SG 3.39Å; V183-C186 PolarHBondContact O-N 3.29Å; L184-C186 PolarHBondContact O-N 2.97Å; C186-F189 PolarHBondContact O-N 3.26Å; C186-L190 WeakPolarHBondContact O-CB 3.32Å; C186-L190 PolarHBondContact O-N 2.93Å |
| 187 | I | 89.6 | Confident | 83.8 | Confident | 51 Ų | 51 | 84.2 Ų | 84.2 | 26% | 0.262 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -65.2 | -42 | 178.2 | -65.5 | 165.5 | 0 | 0 | 0 | 110.9 | L43 N47 V183 L184 L185 L190 S191 | L43-I187 HydrophobicContact CD2-CG2 3.61Å; N47-I187 VanDerWaalsContact OD1-CD1 3.27Å; N47-I187 WeakPolarHBondContact OD1-CD1 3.4Å; V183-I187 HydrophobicContact CG1-CD1 3.92Å; V183-I187 WeakPolarHBondContact O-CG1 3.38Å; V183-I187 PolarHBondContact O-N 2.74Å; L184-I187 PolarHBondContact O-N 3.02Å; L185-I187 PolarHBondContact O-N 3.47Å; I187-L190 PolarHBondContact O-N 3.39Å; I187-S191 WeakPolarHBondContact O-CB 3.38Å; I187-S191 PolarHBondContact O-N 3.4Å; I187-S191 PolarHBondContact O-OG 3.37Å |
| 188 | L | 88.2 | Confident | 82.1 | Confident | 35 Ų | 35 | 89.3 Ų | 89.3 | 18% | 0.183 | 45% | 0.448 | C | S | . | . | H | α-helix | trans | -60 | -50.1 | 176.7 | -70.6 | 168.1 | 0 | 0 | 0 | 110.9 | F39 F40 L43 L184 L185 L190 S191 T192 | F39-L188 HydrophobicContact CD1-CD2 3.92Å; F39-L188 HydrophobicContact CE1-CD2 3.29Å; F39-L188 HydrophobicContact CZ-CD2 4.2Å; F40-L188 HydrophobicContact CD1-CD1 4.01Å; F40-L188 HydrophobicContact CD1-CD2 4.17Å; F40-L188 HydrophobicContact CE1-CD1 3.27Å; F40-L188 HydrophobicContact CE1-CD2 3.77Å; F40-L188 HydrophobicContact CE1-CG 4.18Å; F40-L188 HydrophobicContact CZ-CD1 3.97Å; F40-L188 HydrophobicContact CZ-CD2 3.98Å; L43-L188 HydrophobicContact CD1-CD2 3.45Å; L43-L188 VanDerWaalsContact CD1-CD2 3.45Å; L43-L188 HydrophobicContact CD1-CG 4.24Å; L184-L188 VanDerWaalsContact O-CG 3.22Å; L184-L188 WeakPolarHBondContact O-CG 3.17Å; L184-L188 PolarHBondContact O-N 3.21Å; L185-L188 PolarHBondContact O-N 3.43Å; L188-L190 VanDerWaalsContact C-N 3.34Å; L188-L190 PolarHBondContact O-N 3.22Å; L188-S191 PolarHBondContact O-N 3.43Å; L188-S191 VanDerWaalsContact O-N 3.16Å; L188-S191 PolarHBondContact O-OG 3.38Å; L188-T192 PolarHBondContact O-N 3.02Å; L188-T192 PolarHBondContact O-OG1 2.8Å |
| 189 | F | 86.7 | Confident | 80.6 | Confident | 127 Ų | 127 | 87.5 Ų | 87.5 | 56% | 0.557 | 46% | 0.457 | S | S | * | . | H | α-helix | trans | -59.6 | -43.8 | 178.5 | -174.4 | -99.2 | 0 | 0 | 0 | 112.1 | L185 C186 S191 T192 F193 | L185-F189 WeakPolarHBondContact O-CB 3.4Å; L185-F189 PolarHBondContact O-N 3.27Å; C186-F189 PolarHBondContact O-N 3.26Å; F189-S191 PolarHBondContact O-N 3.14Å; F189-T192 WeakPolarHBondContact CA-OG1 3.37Å; F189-T192 PolarHBondContact O-N 2.87Å; F189-T192 PolarHBondContact O-OG1 3.19Å; F189-F193 HydrophobicContact CD1-CD2 4.08Å; F189-F193 HydrophobicContact CD1-CE2 4.49Å; F189-F193 AromaticContact CE1-CD2 3.58Å; F189-F193 HydrophobicContact CE1-CD2 3.58Å; F189-F193 AromaticContact CE1-CE2 3.59Å; F189-F193 HydrophobicContact CE1-CE2 3.59Å; F189-F193 HydrophobicContact CE2-CD2 4.11Å; F189-F193 AromaticContact CE2-CE2 3.85Å; F189-F193 HydrophobicContact CE2-CE2 3.85Å; F189-F193 AromaticContact CZ-CD2 3.63Å; F189-F193 HydrophobicContact CZ-CD2 3.63Å; F189-F193 AromaticContact CZ-CE2 3.23Å; F189-F193 HydrophobicContact CZ-CE2 3.23Å; F189-F193 HydrophobicContact CZ-CZ 4.27Å; F189-F193 PolarHBondContact O-N 3.42Å |
| 190 | L | 86.1 | Confident | 78.9 | Confident | 106 Ų | 106 | 88 Ų | 88 | 56% | 0.555 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -63.2 | -42.1 | 176.2 | -168.7 | 73.8 | 0 | 0 | 0 | 111.4 | C186 I187 L188 T192 F193 I194 | C186-L190 WeakPolarHBondContact O-CB 3.32Å; C186-L190 PolarHBondContact O-N 2.93Å; I187-L190 PolarHBondContact O-N 3.39Å; L188-L190 VanDerWaalsContact C-N 3.34Å; L188-L190 PolarHBondContact O-N 3.22Å; L190-T192 PolarHBondContact O-N 2.97Å; L190-F193 PolarHBondContact O-N 2.98Å; L190-I194 HydrophobicContact CD1-CD1 4.49Å; L190-I194 HydrophobicContact CD2-CD1 4.23Å; L190-I194 HydrophobicContact CG-CD1 3.84Å; L190-I194 HydrophobicContact CG-CG1 4.46Å; L190-I194 VanDerWaalsContact O-CG1 3.29Å; L190-I194 WeakPolarHBondContact O-CG1 3.39Å; L190-I194 PolarHBondContact O-N 2.93Å |
| 191 | S | 83.2 | Confident | 78.2 | Confident | 25 Ų | 25 | 91.8 Ų | 91.8 | 18% | 0.175 | 50% | 0.498 | C | S | . | . | H | α-helix | trans | -64.6 | -39.2 | 179.2 | 72.7 | 0 | 0 | 0 | 0 | 112.5 | I187 L188 F189 L195 | I187-S191 WeakPolarHBondContact O-CB 3.38Å; I187-S191 PolarHBondContact O-N 3.4Å; I187-S191 PolarHBondContact O-OG 3.37Å; L188-S191 PolarHBondContact O-N 3.43Å; L188-S191 VanDerWaalsContact O-N 3.16Å; L188-S191 PolarHBondContact O-OG 3.38Å; F189-S191 PolarHBondContact O-N 3.14Å; S191-L195 WeakPolarHBondContact O-CB 2.96Å; S191-L195 VanDerWaalsContact O-CG 3.25Å; S191-L195 WeakPolarHBondContact O-CG 3.31Å; S191-L195 PolarHBondContact O-N 2.93Å |
| 192 | T | 78 | Confident | 77.5 | Confident | 85 Ų | 85 | 90.2 Ų | 90.2 | 52% | 0.521 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -68.1 | -37.3 | 174.5 | 46.5 | 0 | 0 | 0 | 0 | 111.9 | L188 F189 L190 G196 | L188-T192 PolarHBondContact O-N 3.02Å; L188-T192 PolarHBondContact O-OG1 2.8Å; F189-T192 WeakPolarHBondContact CA-OG1 3.37Å; F189-T192 PolarHBondContact O-N 2.87Å; F189-T192 PolarHBondContact O-OG1 3.19Å; L190-T192 PolarHBondContact O-N 2.97Å; T192-G196 PolarHBondContact O-N 3.17Å |
| 193 | F | 76.3 | Confident | 76.6 | Confident | 124 Ų | 124 | 90.6 Ų | 90.6 | 54% | 0.544 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -64.4 | -48.2 | 175.2 | -110.6 | -90.1 | 0 | 0 | 0 | 111.5 | F189 L190 G196 W197 | F189-F193 HydrophobicContact CD1-CD2 4.08Å; F189-F193 HydrophobicContact CD1-CE2 4.49Å; F189-F193 AromaticContact CE1-CD2 3.58Å; F189-F193 HydrophobicContact CE1-CD2 3.58Å; F189-F193 AromaticContact CE1-CE2 3.59Å; F189-F193 HydrophobicContact CE1-CE2 3.59Å; F189-F193 HydrophobicContact CE2-CD2 4.11Å; F189-F193 AromaticContact CE2-CE2 3.85Å; F189-F193 HydrophobicContact CE2-CE2 3.85Å; F189-F193 AromaticContact CZ-CD2 3.63Å; F189-F193 HydrophobicContact CZ-CD2 3.63Å; F189-F193 AromaticContact CZ-CE2 3.23Å; F189-F193 HydrophobicContact CZ-CE2 3.23Å; F189-F193 HydrophobicContact CZ-CZ 4.27Å; F189-F193 PolarHBondContact O-N 3.42Å; L190-F193 PolarHBondContact O-N 2.98Å; F193-G196 PolarHBondContact O-N 2.99Å; F193-W197 WeakPolarHBondContact O-CB 3.29Å; F193-W197 PolarHBondContact O-N 3.18Å |
| 194 | I | 71.5 | Confident | 75.7 | Confident | 86 Ų | 86 | 91.5 Ų | 91.5 | 44% | 0.441 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -63.3 | -44.4 | 179.2 | -67.7 | 167 | 0 | 0 | 0 | 110.8 | L190 W197 I198 | L190-I194 HydrophobicContact CD1-CD1 4.49Å; L190-I194 HydrophobicContact CD2-CD1 4.23Å; L190-I194 HydrophobicContact CG-CD1 3.84Å; L190-I194 HydrophobicContact CG-CG1 4.46Å; L190-I194 VanDerWaalsContact O-CG1 3.29Å; L190-I194 WeakPolarHBondContact O-CG1 3.39Å; L190-I194 PolarHBondContact O-N 2.93Å; I194-W197 PolarHBondContact O-N 3.39Å; I194-I198 HydrophobicContact CG2-CD1 3.71Å; I194-I198 HydrophobicContact CG2-CG1 4.49Å; I194-I198 VanDerWaalsContact O-CG1 3.28Å; I194-I198 WeakPolarHBondContact O-CG1 3.42Å; I194-I198 PolarHBondContact O-N 3.02Å |
| 195 | L | 67.3 | Low | 74.7 | Confident | 106 Ų | 106 | 96.4 Ų | 96.4 | 56% | 0.555 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -66.2 | -37.4 | 177.4 | -72.6 | 169.8 | 0 | 0 | 0 | 112.2 | S191 W197 I198 A199 | S191-L195 WeakPolarHBondContact O-CB 2.96Å; S191-L195 VanDerWaalsContact O-CG 3.25Å; S191-L195 WeakPolarHBondContact O-CG 3.31Å; S191-L195 PolarHBondContact O-N 2.93Å; L195-W197 VanDerWaalsContact C-N 3.34Å; L195-I198 PolarHBondContact O-N 3.11Å; L195-A199 WeakPolarHBondContact O-CB 3.41Å; L195-A199 PolarHBondContact O-N 3.11Å |
| 196 | G | 62.7 | Low | 73.7 | Confident | 45 Ų | 45 | 95.2 Ų | 95.2 | 46% | 0.464 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -65.2 | -36.8 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | T192 F193 A199 S200 | T192-G196 PolarHBondContact O-N 3.17Å; F193-G196 PolarHBondContact O-N 2.99Å; G196-A199 PolarHBondContact O-N 3.34Å; G196-S200 PolarHBondContact O-N 3.08Å |
| 197 | W | 52.1 | Low | 72.5 | Confident | 206 Ų | 206 | 96.7 Ų | 96.7 | 78% | 0.78 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -74.4 | -30.3 | 178.2 | -142.2 | 77.7 | 0 | 0 | 0 | 113.2 | F193 I194 L195 A199 S200 | F193-W197 WeakPolarHBondContact O-CB 3.29Å; F193-W197 PolarHBondContact O-N 3.18Å; I194-W197 PolarHBondContact O-N 3.39Å; L195-W197 VanDerWaalsContact C-N 3.34Å; W197-A199 VanDerWaalsContact C-N 3.33Å; W197-S200 PolarHBondContact O-OG 3.3Å; W197-S200 VanDerWaalsContact O-OG 3.07Å |
| 198 | I | 55.1 | Low | 71.1 | Confident | 128 Ų | 128 | 100.2 Ų | 100.2 | 66% | 0.656 | 55% | 0.55 | S | S | * | * | H | α-helix | trans | -76.7 | -23.4 | 174.6 | -66.8 | 165.3 | 0 | 0 | 0 | 111.4 | I194 L195 | I194-I198 HydrophobicContact CG2-CD1 3.71Å; I194-I198 HydrophobicContact CG2-CG1 4.49Å; I194-I198 VanDerWaalsContact O-CG1 3.28Å; I194-I198 WeakPolarHBondContact O-CG1 3.42Å; I194-I198 PolarHBondContact O-N 3.02Å; L195-I198 PolarHBondContact O-N 3.11Å |
| 199 | A | 61.4 | Low | 69.7 | Low | 91 Ų | 91 | 105.7 Ų | 105.7 | 75% | 0.752 | 58% | 0.581 | S | S | * | * | trans | -89.8 | -5.5 | -179.3 | 0 | 0 | 0 | 0 | 0 | 114.4 | L195 G196 W197 | L195-A199 WeakPolarHBondContact O-CB 3.41Å; L195-A199 PolarHBondContact O-N 3.11Å; G196-A199 PolarHBondContact O-N 3.34Å; W197-A199 VanDerWaalsContact C-N 3.33Å | ||
| 200 | S | 56.1 | Low | 68.2 | Low | 139 Ų | 139 | 103.7 Ų | 103.7 | 97% | 0.972 | 58% | 0.583 | S | S | * | * | trans | -103.2 | 0 | 176.1 | 60.4 | 0 | 0 | 0 | 0 | 111.8 | G196 W197 | G196-S200 PolarHBondContact O-N 3.08Å; W197-S200 PolarHBondContact O-OG 3.3Å; W197-S200 VanDerWaalsContact O-OG 3.07Å |
Retrieved 200 of 200 residues in 943.9 ms
(Link to these results)