G7NCG2_MACMU Loading...

Zinc finger protein-like 1

Required for cis-Golgi integrity and efficient ER to Golgi transport.

AlphaFold DB , UniProt , Accession G7NCG2, Species MACMU (Macaca mulatta, Rhesus macaque), Gene ZFPL1, Length 310 aa.

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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
1M74.4Confident90.4Very high153 Ų153100.7 Ų100.775%0.75450%0.501SS*.  0116.20-70.4-71.1-166.300109.7V11 N13M1-V11 HydrophobicContact SD-CG1 4.18Å; M1-N13 VanDerWaalsContact CA-OD1 3.31Å; M1-N13 WeakPolarHBondContact CA-OD1 3.34Å; M1-N13 WeakPolarHBondContact CE-ND2 3.49Å; M1-N13 WeakPolarHBondContact CG-OD1 3.2Å; M1-N13 PolarHBondContact N-OD1 3.49Å; M1-N13 HydrophobicContact SD-CB 4.39Å; M1-N13 PolarHBondContact SD-ND2 3.12Å; M1-N13 PolarHBondContact SD-OD1 3.09Å
2G87.7Confident90.8Very high17 Ų1793.4 Ų93.418%0.17547%0.466CS..EExtended strand (participates in β ladder)trans-126.8170.4178.300000112V11 T12G2-V11 WeakPolarHBondContact O-CA 3.32Å; G2-T12 PolarHBondContact N-O 2.9Å; G2-T12 PolarHBondContact O-N 3.24Å; G2-T12 VanDerWaalsContact O-O 3.09Å
3L94.2Very high91Very high103 Ų10391.5 Ų91.554%0.53946%0.458SS..EExtended strand (participates in β ladder)trans-94.3133.5171.4-67.6169.3000109.7R9 V11 N22L3-R9 WeakPolarHBondContact CD2-O 3.27Å; L3-V11 HydrophobicContact CD2-CB 4.49Å; L3-V11 HydrophobicContact CD2-CG2 3.66Å; L3-N22 WeakPolarHBondContact O-CB 3.39Å
4C94.7Very high91.3Very high5 Ų586.2 Ų86.23%0.03443%0.432CS..  trans-63.9141171.2-1790000110.6C6 K10 T12 N22 C24 C27C4-C6 PolarHBondContact O-N 3.12Å; C4-C6 PolarHBondContact SG-SG 3.1Å; C4-K10 WeakPolarHBondContact CB-O 3.32Å; C4-K10 PolarHBondContact N-O 3.3Å; C4-T12 HydrophobicContact CB-CG2 4.13Å; C4-N22 WeakPolarHBondContact CA-O 3.47Å; C4-C24 HydrophobicContact CB-CB 3.8Å; C4-C24 PolarHBondContact SG-N 3.44Å; C4-C27 VanDerWaalsContact SG-SG 3.63Å
5K89.1Confident91.6Very high165 Ų16581.1 Ų81.172%0.71741%0.406SS*.SBendtrans-74.30.2179.4-66.6-170.4179.8179.30115V21 N22K5-V21 HydrophobicContact CD-CB 4.11Å; K5-V21 HydrophobicContact CD-CG1 3.81Å; K5-V21 VanDerWaalsContact NZ-CG1 3.27Å; K5-N22 PolarHBondContact N-O 2.77Å
6C92.3Very high91.9Very high20 Ų2076 Ų7614%0.13538%0.381CS..SBendtrans-76.1165.5178.171.80000112.5C4 K8 R9 C24 C27C4-C6 PolarHBondContact O-N 3.12Å; C4-C6 PolarHBondContact SG-SG 3.1Å; C6-K8 PolarHBondContact O-N 3.25Å; C6-R9 WeakPolarHBondContact O-CG 3.34Å; C6-R9 PolarHBondContact O-N 2.77Å; C6-C24 VanDerWaalsContact SG-SG 3.64Å; C6-C27 WeakPolarHBondContact CB-SG 3.38Å
7P92.8Very high92.1Very high133 Ų13371.8 Ų71.886%0.86436%0.36SS*.THydrogen-bonded Turntrans-54.6-30178.5-27.135.5000113.8R9P7-R9 VanDerWaalsContact C-N 3.27Å; P7-R9 PolarHBondContact O-N 3.35Å
8K89.9Confident92.2Very high126 Ų12671.8 Ų71.855%0.54836%0.358SS..THydrogen-bonded Turntrans-72.8-15.4179.2-60.2-178.6175.4178.60113.8C6 K10 H26C6-K8 PolarHBondContact O-N 3.25Å; K8-K10 HydrophobicContact CB-CG 4.15Å; K8-K10 PolarHBondContact O-N 2.9Å; K8-H26 PolarHBondContact NZ-CD2 2.94Å
9R92.2Very high92.2Very high187 Ų18773.4 Ų73.471%0.70636%0.364SS*.  trans42.241178.1-60.5-176.4-179.8-136.21.9114.5L3 C6 P7L3-R9 WeakPolarHBondContact CD2-O 3.27Å; C6-R9 WeakPolarHBondContact O-CG 3.34Å; C6-R9 PolarHBondContact O-N 2.77Å; P7-R9 VanDerWaalsContact C-N 3.27Å; P7-R9 PolarHBondContact O-N 3.35Å
10K92.7Very high92.3Very high95 Ų9578.8 Ų78.841%0.41338%0.38SS..  trans-68.6138.2-179-68.7-169.4170.8-171.20110.8C4 K8 C24 H26C4-K10 WeakPolarHBondContact CB-O 3.32Å; C4-K10 PolarHBondContact N-O 3.3Å; K8-K10 HydrophobicContact CB-CG 4.15Å; K8-K10 PolarHBondContact O-N 2.9Å; K10-C24 HydrophobicContact CB-CB 4.04Å; K10-H26 PolarHBondContact NZ-CE1 3.09Å
11V94.6Very high92.4Very high104 Ų10476.2 Ų76.263%0.6337%0.369SS*.EExtended strand (participates in β ladder)trans-62.1136.2166.8-179.40000108.4M1 G2 L3M1-V11 HydrophobicContact SD-CG1 4.18Å; G2-V11 WeakPolarHBondContact O-CA 3.32Å; L3-V11 HydrophobicContact CD2-CB 4.49Å; L3-V11 HydrophobicContact CD2-CG2 3.66Å
12T94.6Very high93.5Very high13 Ų1370.5 Ų70.58%0.0834%0.342CS..EExtended strand (participates in β ladder)trans-150.9150.7-175.5-175.10000110.8G2 C4 L14 N22 V23G2-T12 PolarHBondContact N-O 2.9Å; G2-T12 PolarHBondContact O-N 3.24Å; G2-T12 VanDerWaalsContact O-O 3.09Å; C4-T12 HydrophobicContact CB-CG2 4.13Å; T12-L14 PolarHBondContact OG1-N 2.97Å; T12-N22 HydrophobicContact CG2-CB 3.97Å; T12-V23 VanDerWaalsContact CB-O 3.28Å; T12-V23 WeakPolarHBondContact CB-O 3.43Å; T12-V23 WeakPolarHBondContact CG2-O 3.35Å; T12-V23 PolarHBondContact OG1-O 2.84Å
13N94.2Very high93.8Very high68 Ų6869.8 Ų69.836%0.36433%0.334SS..  trans-100.5-2.7164.5-84.9-34.3000112.7M1 S39 Y40M1-N13 VanDerWaalsContact CA-OD1 3.31Å; M1-N13 WeakPolarHBondContact CA-OD1 3.34Å; M1-N13 WeakPolarHBondContact CE-ND2 3.49Å; M1-N13 WeakPolarHBondContact CG-OD1 3.2Å; M1-N13 PolarHBondContact N-OD1 3.49Å; M1-N13 HydrophobicContact SD-CB 4.39Å; M1-N13 PolarHBondContact SD-ND2 3.12Å; M1-N13 PolarHBondContact SD-OD1 3.09Å; N13-S39 CarbonylContact O-C 3.49Å; N13-S39 WeakPolarHBondContact O-CA 3.37Å; N13-Y40 PolarHBondContact O-N 3.29Å
14L95.2Very high93.9Very high18 Ų1865.1 Ų65.19%0.09431%0.31CS..EExtended strand (participates in β ladder)trans-85.2136.4-177-51.9173.8000110.6T12 N22 V23 E25 L28 V37 Q38 Y71T12-L14 PolarHBondContact OG1-N 2.97Å; L14-N22 WeakPolarHBondContact O-CA 3.41Å; L14-V23 HydrophobicContact CB-CG2 4.05Å; L14-V23 WeakPolarHBondContact CB-O 3.4Å; L14-V23 PolarHBondContact O-N 3.25Å; L14-E25 HydrophobicContact CD1-CG 4.24Å; L14-L28 HydrophobicContact CD1-CD1 4.03Å; L14-L28 HydrophobicContact CD1-CD2 3.98Å; L14-V37 HydrophobicContact CB-CG1 3.88Å; L14-Q38 WeakPolarHBondContact CA-O 3.41Å; L14-Y71 HydrophobicContact CD1-CD1 4.49Å; L14-Y71 HydrophobicContact CD1-CE1 3.88Å; L14-Y71 HydrophobicContact CD1-CE2 4.24Å; L14-Y71 HydrophobicContact CD2-CD2 3.81Å; L14-Y71 HydrophobicContact CD2-CE2 3.56Å; L14-Y71 HydrophobicContact CD2-CG 4.42Å
15F95.9Very high93.9Very high9 Ų968 Ų684%0.03932%0.323CS..EExtended strand (participates in β ladder)trans-132.2131-178.4-166.4-95.7000110.1F17 R20 V21 V37 Q38 Y40 W43F15-F17 HydrophobicContact CD1-CD2 4.32Å; F15-R20 HydrophobicContact CE1-CB 4.29Å; F15-R20 VanDerWaalsContact CZ-CA 3.48Å; F15-R20 HydrophobicContact CZ-CB 4.12Å; F15-R20 WeakPolarHBondContact CZ-O 3.43Å; F15-V21 VanDerWaalsContact CD2-C 3.48Å; F15-V37 WeakPolarHBondContact O-CA 3.43Å; F15-Q38 PolarHBondContact N-O 3.13Å; F15-Q38 PolarHBondContact O-N 3.05Å; F15-Q38 VanDerWaalsContact O-N 3.12Å; F15-Y40 HydrophobicContact CB-CD2 4.22Å; F15-Y40 AromaticContact CD2-CD2 3.5Å; F15-Y40 HydrophobicContact CD2-CD2 3.5Å; F15-Y40 VanDerWaalsContact CD2-CD2 3.5Å; F15-Y40 HydrophobicContact CD2-CE2 4.04Å; F15-Y40 AromaticContact CE2-CD2 3.94Å; F15-Y40 HydrophobicContact CE2-CD2 3.94Å; F15-Y40 AromaticContact CE2-CE2 3.99Å; F15-Y40 HydrophobicContact CE2-CE2 3.99Å; F15-Y40 AromaticContact CG-CD2 3.93Å; F15-Y40 HydrophobicContact CG-CD2 3.93Å; F15-W43 HydrophobicContact CD1-CB 3.84Å; F15-W43 AromaticContact CD1-CD1 3.79Å; F15-W43 AromaticContact CD1-CD2 3.81Å; F15-W43 HydrophobicContact CD1-CD2 3.81Å; F15-W43 HydrophobicContact CD1-CE3 4.42Å; F15-W43 AromaticContact CD1-CG 3.47Å; F15-W43 HydrophobicContact CD1-CG 3.47Å; F15-W43 VanDerWaalsContact CD1-CG 3.47Å; F15-W43 HydrophobicContact CE1-CB 4.31Å; F15-W43 AromaticContact CE1-CD1 3.58Å; F15-W43 AromaticContact CE1-CD2 3.35Å; F15-W43 HydrophobicContact CE1-CD2 3.35Å; F15-W43 AromaticContact CE1-CE2 3.43Å; F15-W43 VanDerWaalsContact CE1-CE2 3.43Å; F15-W43 AromaticContact CE1-CE3 3.98Å; F15-W43 HydrophobicContact CE1-CE3 3.98Å; F15-W43 AromaticContact CE1-CG 3.45Å; F15-W43 HydrophobicContact CE1-CG 3.45Å; F15-W43 VanDerWaalsContact CE1-CG 3.45Å; F15-W43 HydrophobicContact CE1-CZ2 4.1Å; F15-W43 AromaticContact CE1-NE1 3.55Å; F15-W43 HydrophobicContact CG-CB 4.45Å; F15-W43 HydrophobicContact CG-CG 4.4Å; F15-W43 AromaticContact CZ-CD2 3.81Å; F15-W43 HydrophobicContact CZ-CD2 3.81Å; F15-W43 AromaticContact CZ-CE2 3.85Å; F15-W43 HydrophobicContact CZ-CE3 4Å; F15-W43 HydrophobicContact CZ-CG 4.36Å; F15-W43 HydrophobicContact CZ-CH2 4.26Å; F15-W43 HydrophobicContact CZ-CZ2 4.08Å; F15-W43 HydrophobicContact CZ-CZ3 4.22Å
16C95.5Very high94.1Very high0 Ų063 Ų630%030%0.302CS..EExtended strand (participates in β ladder)trans-86.6120.9176.1179.50000109.7H19 R20 V21 V23 C35 V37C16-H19 HydrophobicContact CB-CB 4.36Å; C16-H19 PolarHBondContact SG-ND1 2.93Å; C16-H19 VanDerWaalsContact SG-ND1 3.35Å; C16-R20 VanDerWaalsContact O-CA 3.23Å; C16-R20 WeakPolarHBondContact O-CA 3.43Å; C16-R20 PolarHBondContact O-N 3.1Å; C16-V21 HydrophobicContact CB-CG2 4.49Å; C16-V21 PolarHBondContact N-O 2.71Å; C16-V21 PolarHBondContact O-N 3.08Å; C16-V23 HydrophobicContact CB-CG1 3.94Å; C16-V23 HydrophobicContact CB-CG2 4.22Å; C16-C35 VanDerWaalsContact SG-CB 3.54Å; C16-V37 HydrophobicContact CB-CG2 4.09Å
17F95.1Very high94.3Very high5 Ų562.7 Ų62.72%0.02230%0.3CS..THydrogen-bonded Turntrans-73.9-37.5-175.3-82.1-127.4000111.7F15 R20 I36 Q38 Q42 W43 D46 Y49F15-F17 HydrophobicContact CD1-CD2 4.32Å; F17-R20 WeakPolarHBondContact O-CG 3.49Å; F17-I36 PolarHBondContact N-O 2.85Å; F17-Q38 HydrophobicContact CE2-CB 3.74Å; F17-Q38 HydrophobicContact CE2-CG 4.4Å; F17-Q38 HydrophobicContact CZ-CB 4.17Å; F17-Q42 HydrophobicContact CZ-CG 4.43Å; F17-W43 AromaticContact CD1-CD1 3.91Å; F17-W43 HydrophobicContact CD2-CB 4.4Å; F17-W43 HydrophobicContact CE1-CB 4.19Å; F17-W43 AromaticContact CE1-CD1 3.92Å; F17-W43 HydrophobicContact CE1-CG 4.49Å; F17-W43 HydrophobicContact CE2-CB 3.62Å; F17-W43 HydrophobicContact CE2-CG 4.27Å; F17-W43 VanDerWaalsContact CZ-CA 3.41Å; F17-W43 HydrophobicContact CZ-CB 3.53Å; F17-W43 HydrophobicContact CZ-CG 4.23Å; F17-D46 WeakPolarHBondContact CE1-O 3.37Å; F17-Y49 HydrophobicContact CB-CD1 3.79Å; F17-Y49 HydrophobicContact CB-CE1 4.3Å; F17-Y49 HydrophobicContact CB-CG 4.04Å; F17-Y49 HydrophobicContact CD1-CD1 4.18Å; F17-Y49 HydrophobicContact CD1-CG 4.38Å
18E93.6Very high94.4Very high71 Ų7156.4 Ų56.433%0.33226%0.259SS..THydrogen-bonded Turntrans-64.5-47.2177-72.3166.2-146.100112.3C35 I36 Y49E18-C35 WeakPolarHBondContact OE1-CA 3.37Å; E18-C35 WeakPolarHBondContact OE2-CA 3.42Å; E18-C35 PolarHBondContact OE2-SG 3.23Å; E18-I36 PolarHBondContact OE1-N 3.43Å; E18-Y49 HydrophobicContact CG-CE2 3.8Å
19H93.5Very high94.6Very high102 Ų10253.3 Ų53.347%0.47225%0.25SS..THydrogen-bonded Turntrans-92.7-11.2-174.8-6695.9000113.6C16 V21 H32 C35C16-H19 HydrophobicContact CB-CB 4.36Å; C16-H19 PolarHBondContact SG-ND1 2.93Å; C16-H19 VanDerWaalsContact SG-ND1 3.35Å; H19-V21 HydrophobicContact CB-CG2 3.83Å; H19-V21 WeakPolarHBondContact O-CG1 3.05Å; H19-V21 PolarHBondContact O-N 2.72Å; H19-H32 AromaticContact CE1-CE1 3.82Å; H19-H32 AromaticContact CE1-ND1 3.66Å; H19-H32 AromaticContact CG-CE1 3.68Å; H19-H32 AromaticContact ND1-CE1 3.31Å; H19-H32 PolarHBondContact ND1-CE1 3.35Å; H19-H32 VanDerWaalsContact ND1-CE1 3.31Å; H19-H32 AromaticContact ND1-ND1 3.25Å; H19-H32 PolarHBondContact ND1-ND1 2.92Å; H19-C35 PolarHBondContact CE1-SG 3.48Å
20R94.1Very high94.6Very high181 Ų18147.9 Ų47.968%0.68325%0.246SC*.THydrogen-bonded Turntrans5448.1-177.3-54.1-178.9-176.2-169.4-1.2112.9F15 C16 F17F15-R20 HydrophobicContact CE1-CB 4.29Å; F15-R20 VanDerWaalsContact CZ-CA 3.48Å; F15-R20 HydrophobicContact CZ-CB 4.12Å; F15-R20 WeakPolarHBondContact CZ-O 3.43Å; C16-R20 VanDerWaalsContact O-CA 3.23Å; C16-R20 WeakPolarHBondContact O-CA 3.43Å; C16-R20 PolarHBondContact O-N 3.1Å; F17-R20 WeakPolarHBondContact O-CG 3.49Å
21V94.9Very high94.7Very high25 Ų2549.3 Ų49.315%0.15226%0.258CS..EExtended strand (participates in β ladder)trans-139.4148-179.2-62.90000113K5 F15 C16 H19 V23K5-V21 HydrophobicContact CD-CB 4.11Å; K5-V21 HydrophobicContact CD-CG1 3.81Å; K5-V21 VanDerWaalsContact NZ-CG1 3.27Å; F15-V21 VanDerWaalsContact CD2-C 3.48Å; C16-V21 HydrophobicContact CB-CG2 4.49Å; C16-V21 PolarHBondContact N-O 2.71Å; C16-V21 PolarHBondContact O-N 3.08Å; H19-V21 HydrophobicContact CB-CG2 3.83Å; H19-V21 WeakPolarHBondContact O-CG1 3.05Å; H19-V21 PolarHBondContact O-N 2.72Å; V21-V23 HydrophobicContact CG2-CG1 4.06Å
22N95.7Very high94.6Very high33 Ų3345.4 Ų45.418%0.17623%0.233CC..EExtended strand (participates in β ladder)trans-66.9130.9169.4-70.5-61.3000110.7L3 C4 K5 T12 L14L3-N22 WeakPolarHBondContact O-CB 3.39Å; C4-N22 WeakPolarHBondContact CA-O 3.47Å; K5-N22 PolarHBondContact N-O 2.77Å; T12-N22 HydrophobicContact CG2-CB 3.97Å; L14-N22 WeakPolarHBondContact O-CA 3.41Å
23V95.9Very high94.6Very high2 Ų247.2 Ų47.21%0.01225%0.249CC..  trans-128.6147.3-174.5-70.10000110.6T12 L14 C16 V21 C27 L28 V37T12-V23 VanDerWaalsContact CB-O 3.28Å; T12-V23 WeakPolarHBondContact CB-O 3.43Å; T12-V23 WeakPolarHBondContact CG2-O 3.35Å; T12-V23 PolarHBondContact OG1-O 2.84Å; L14-V23 HydrophobicContact CB-CG2 4.05Å; L14-V23 WeakPolarHBondContact CB-O 3.4Å; L14-V23 PolarHBondContact O-N 3.25Å; C16-V23 HydrophobicContact CB-CG1 3.94Å; C16-V23 HydrophobicContact CB-CG2 4.22Å; V21-V23 HydrophobicContact CG2-CG1 4.06Å; V23-C27 HydrophobicContact CB-CB 4.44Å; V23-L28 HydrophobicContact CB-CD1 3.85Å; V23-L28 HydrophobicContact CG2-CD1 3.54Å; V23-V37 HydrophobicContact CG2-CG1 3.73Å; V23-V37 HydrophobicContact CG2-CG2 4.25Å
24C95.2Very high94.6Very high5 Ų548.5 Ų48.53%0.03425%0.251CS..  trans-105.8163172.471.40000110C4 C6 K10 H26 C27 L28C4-C24 HydrophobicContact CB-CB 3.8Å; C4-C24 PolarHBondContact SG-N 3.44Å; C6-C24 VanDerWaalsContact SG-SG 3.64Å; K10-C24 HydrophobicContact CB-CB 4.04Å; C24-H26 PolarHBondContact O-N 3.27Å; C24-C27 WeakPolarHBondContact O-CA 3.43Å; C24-C27 WeakPolarHBondContact O-CB 3.48Å; C24-C27 PolarHBondContact O-N 3.33Å; C24-L28 WeakPolarHBondContact O-CD1 3.22Å; C24-L28 PolarHBondContact O-N 3.23Å; C24-L28 VanDerWaalsContact O-N 3.1Å
25E93.9Very high94.5Very high65 Ų6548 Ų4830%0.30425%0.25SC..Hα-helixtrans-54.2-29.3-176.9-64.3-176.4-161.700114.3L14 L28 V29 Y71 P113 V114L14-E25 HydrophobicContact CD1-CG 4.24Å; E25-L28 WeakPolarHBondContact O-CB 3.29Å; E25-L28 PolarHBondContact O-N 3.3Å; E25-V29 PolarHBondContact O-N 2.63Å; E25-Y71 HydrophobicContact CG-CE1 4.38Å; E25-Y71 PolarHBondContact OE1-OH 2.97Å; E25-P113 HydrophobicContact CB-CG 3.6Å; E25-P113 WeakPolarHBondContact OE2-CD 3.17Å; E25-V114 HydrophobicContact CB-CG2 4.16Å
26H94.7Very high94.5Very high61 Ų6148.7 Ų48.728%0.28225%0.253SS..Hα-helixtrans-69-37.3176.1-65.265.8000111.8K8 K10 C24 L28 A30K8-H26 PolarHBondContact NZ-CD2 2.94Å; K10-H26 PolarHBondContact NZ-CE1 3.09Å; C24-H26 PolarHBondContact O-N 3.27Å; H26-L28 VanDerWaalsContact C-N 3.33Å; H26-A30 WeakPolarHBondContact O-CB 3.49Å; H26-A30 PolarHBondContact O-N 3.1Å; H26-A30 VanDerWaalsContact O-N 3.11Å
27C95.4Very high94.5Very high13 Ų1348.9 Ų48.99%0.08825%0.254CS..Hα-helixtrans-72.7-30.6176.3-61.50000111.7C4 C6 V23 C24 V29 A30 N31 H32C4-C27 VanDerWaalsContact SG-SG 3.63Å; C6-C27 WeakPolarHBondContact CB-SG 3.38Å; V23-C27 HydrophobicContact CB-CB 4.44Å; C24-C27 WeakPolarHBondContact O-CA 3.43Å; C24-C27 WeakPolarHBondContact O-CB 3.48Å; C24-C27 PolarHBondContact O-N 3.33Å; C27-V29 VanDerWaalsContact C-N 3.28Å; C27-V29 PolarHBondContact O-N 2.92Å; C27-A30 PolarHBondContact O-N 3.31Å; C27-N31 PolarHBondContact O-N 3.08Å; C27-H32 PolarHBondContact O-N 3.49Å
28L94.9Very high94.4Very high1 Ų152.3 Ų52.31%0.00527%0.27CS..Hα-helixtrans-57.4-44.4174.7-88.470.4000111.2L14 V23 C24 E25 H26 H32 A33 V37 Y71 V114L14-L28 HydrophobicContact CD1-CD1 4.03Å; L14-L28 HydrophobicContact CD1-CD2 3.98Å; V23-L28 HydrophobicContact CB-CD1 3.85Å; V23-L28 HydrophobicContact CG2-CD1 3.54Å; C24-L28 WeakPolarHBondContact O-CD1 3.22Å; C24-L28 PolarHBondContact O-N 3.23Å; C24-L28 VanDerWaalsContact O-N 3.1Å; E25-L28 WeakPolarHBondContact O-CB 3.29Å; E25-L28 PolarHBondContact O-N 3.3Å; H26-L28 VanDerWaalsContact C-N 3.33Å; L28-H32 CarbonylContact O-C 3.02Å; L28-A33 WeakPolarHBondContact O-CA 3.46Å; L28-A33 PolarHBondContact O-N 3.06Å; L28-A33 VanDerWaalsContact O-N 3.14Å; L28-V37 HydrophobicContact CD1-CG1 4.25Å; L28-V37 HydrophobicContact CD2-CG1 4.19Å; L28-V37 HydrophobicContact CG-CG1 4.35Å; L28-V37 HydrophobicContact CG-CG2 4.37Å; L28-Y71 HydrophobicContact CD2-CD1 3.43Å; L28-Y71 VanDerWaalsContact CD2-CD1 3.43Å; L28-Y71 HydrophobicContact CD2-CE1 3.68Å; L28-Y71 HydrophobicContact CD2-CG 4.4Å; L28-V114 HydrophobicContact CB-CG2 4.12Å; L28-V114 HydrophobicContact CD2-CG2 4.31Å
29V93.9Very high94.5Very high61 Ų6151.3 Ų51.337%0.3727%0.271SS..Hα-helixtrans-77.2-43.6179.8-177.10000111.6E25 C27 P113 V114 A117E25-V29 PolarHBondContact O-N 2.63Å; C27-V29 VanDerWaalsContact C-N 3.28Å; C27-V29 PolarHBondContact O-N 2.92Å; V29-P113 HydrophobicContact CG2-CB 4.24Å; V29-V114 HydrophobicContact CG2-CB 4.46Å; V29-V114 HydrophobicContact CG2-CG2 3.85Å; V29-A117 HydrophobicContact CG1-CB 4.07Å; V29-A117 HydrophobicContact CG2-CB 4.36Å
30A93.4Very high94.5Very high74 Ų7449.8 Ų49.861%0.61226%0.262SS*.Hα-helixtrans-76.8-47.6-172.300000114.1H26 C27H26-A30 WeakPolarHBondContact O-CB 3.49Å; H26-A30 PolarHBondContact O-N 3.1Å; H26-A30 VanDerWaalsContact O-N 3.11Å; C27-A30 PolarHBondContact O-N 3.31Å
31N93.7Very high94.4Very high124 Ų12446.5 Ų46.566%0.66326%0.257SS*.THydrogen-bonded Turntrans-123.8-14.3-166.4-64.4-16000113.6C27C27-N31 PolarHBondContact O-N 3.08Å
32H94.1Very high94.3Very high23 Ų2348.9 Ų48.911%0.10627%0.267CS..  trans-12538.2-176.1-63.4-74.6000111.6H19 C27 L28 K34 C35 R67H19-H32 AromaticContact CE1-CE1 3.82Å; H19-H32 AromaticContact CE1-ND1 3.66Å; H19-H32 AromaticContact CG-CE1 3.68Å; H19-H32 AromaticContact ND1-CE1 3.31Å; H19-H32 PolarHBondContact ND1-CE1 3.35Å; H19-H32 VanDerWaalsContact ND1-CE1 3.31Å; H19-H32 AromaticContact ND1-ND1 3.25Å; H19-H32 PolarHBondContact ND1-ND1 2.92Å; C27-H32 PolarHBondContact O-N 3.49Å; L28-H32 CarbonylContact O-C 3.02Å; H32-K34 VanDerWaalsContact C-N 3.29Å; H32-K34 PolarHBondContact O-N 3.17Å; H32-C35 HydrophobicContact CB-CB 4.02Å; H32-C35 PolarHBondContact O-N 2.61Å; H32-R67 PolarHBondContact O-NH2 3.11Å
33A92.9Very high94.2Very high51 Ų5150.3 Ų50.342%0.42127%0.27SS..SBendtrans-60.1-39.8-176.500000112.3L28 L73L28-A33 WeakPolarHBondContact O-CA 3.46Å; L28-A33 PolarHBondContact O-N 3.06Å; L28-A33 VanDerWaalsContact O-N 3.14Å; A33-L73 WeakPolarHBondContact O-CD2 3.41Å
34K94.2Very high94Very high95 Ų9555 Ų5541%0.41329%0.294SS..SBendtrans-98.7-3.8-178.4-59.6-169.6176-175.20114.7H32 A61 L73H32-K34 VanDerWaalsContact C-N 3.29Å; H32-K34 PolarHBondContact O-N 3.17Å; K34-A61 PolarHBondContact NZ-O 3.13Å; K34-L73 WeakPolarHBondContact O-CD1 3.38Å
35C94.8Very high94Very high8 Ų862 Ų625%0.05433%0.327CS..SBendtrans-81.6143.2-170.7-59.70000113.2C16 E18 H19 H32 V37 R67 L73C16-C35 VanDerWaalsContact SG-CB 3.54Å; E18-C35 WeakPolarHBondContact OE1-CA 3.37Å; E18-C35 WeakPolarHBondContact OE2-CA 3.42Å; E18-C35 PolarHBondContact OE2-SG 3.23Å; H19-C35 PolarHBondContact CE1-SG 3.48Å; H32-C35 HydrophobicContact CB-CB 4.02Å; H32-C35 PolarHBondContact O-N 2.61Å; C35-V37 HydrophobicContact CB-CG2 4.41Å; C35-V37 PolarHBondContact O-N 3.35Å; C35-R67 PolarHBondContact O-NH1 3.4Å; C35-R67 PolarHBondContact O-NH2 3.22Å; C35-L73 WeakPolarHBondContact O-CD1 3.45Å
36I95.1Very high93.9Very high22 Ų2262.6 Ų62.611%0.11333%0.332CS..  trans-68.1122.8167.8-54.3-54.9000110.2F17 E18 Y49 L60 L73F17-I36 PolarHBondContact N-O 2.85Å; E18-I36 PolarHBondContact OE1-N 3.43Å; I36-Y49 HydrophobicContact CB-CD2 4.19Å; I36-Y49 HydrophobicContact CG1-CD2 3.89Å; I36-L60 HydrophobicContact CD1-CD1 3.46Å; I36-L60 VanDerWaalsContact CD1-CD1 3.46Å; I36-L73 HydrophobicContact CD1-CD1 4.19Å
37V95.2Very high93.7Very high4 Ų462.9 Ų62.92%0.02434%0.341CS..EExtended strand (participates in β ladder)trans-133.7125.9-178.3178.50000108.8L14 F15 C16 V23 L28 C35L14-V37 HydrophobicContact CB-CG1 3.88Å; F15-V37 WeakPolarHBondContact O-CA 3.43Å; C16-V37 HydrophobicContact CB-CG2 4.09Å; V23-V37 HydrophobicContact CG2-CG1 3.73Å; V23-V37 HydrophobicContact CG2-CG2 4.25Å; L28-V37 HydrophobicContact CD1-CG1 4.25Å; L28-V37 HydrophobicContact CD2-CG1 4.19Å; L28-V37 HydrophobicContact CG-CG1 4.35Å; L28-V37 HydrophobicContact CG-CG2 4.37Å; C35-V37 HydrophobicContact CB-CG2 4.41Å; C35-V37 PolarHBondContact O-N 3.35Å
38Q94.2Very high93.5Very high77 Ų7768.3 Ų68.336%0.3637%0.369SS..EExtended strand (participates in β ladder)trans-138.6-169.6176.6-64-178.6-16.500109.9L14 F15 F17 Q42L14-Q38 WeakPolarHBondContact CA-O 3.41Å; F15-Q38 PolarHBondContact N-O 3.13Å; F15-Q38 PolarHBondContact O-N 3.05Å; F15-Q38 VanDerWaalsContact O-N 3.12Å; F17-Q38 HydrophobicContact CE2-CB 3.74Å; F17-Q38 HydrophobicContact CE2-CG 4.4Å; F17-Q38 HydrophobicContact CZ-CB 4.17Å; Q38-Q42 VanDerWaalsContact OE1-CG 3.25Å
39S94.3Very high93.4Very high50 Ų5073.2 Ų73.235%0.3539%0.388SS..EExtended strand (participates in β ladder)trans-67.7147.4175.484.80000111.4N13 L41 Q42 W43N13-S39 CarbonylContact O-C 3.49Å; N13-S39 WeakPolarHBondContact O-CA 3.37Å; S39-L41 PolarHBondContact O-N 3.39Å; S39-Q42 WeakPolarHBondContact O-CB 3.44Å; S39-Q42 PolarHBondContact O-N 3.43Å; S39-Q42 WeakPolarHBondContact OG-CB 3.4Å; S39-Q42 PolarHBondContact OG-N 3.42Å; S39-Q42 VanDerWaalsContact OG-N 3.08Å; S39-W43 PolarHBondContact O-N 3.49Å
40Y93.6Very high93.4Very high70 Ų7072.8 Ų72.828%0.27538%0.384SS..Hα-helixtrans-60.8-31.5174.4179.3-112000112.5N13 F15 W43 L44N13-Y40 PolarHBondContact O-N 3.29Å; F15-Y40 HydrophobicContact CB-CD2 4.22Å; F15-Y40 AromaticContact CD2-CD2 3.5Å; F15-Y40 HydrophobicContact CD2-CD2 3.5Å; F15-Y40 VanDerWaalsContact CD2-CD2 3.5Å; F15-Y40 HydrophobicContact CD2-CE2 4.04Å; F15-Y40 AromaticContact CE2-CD2 3.94Å; F15-Y40 HydrophobicContact CE2-CD2 3.94Å; F15-Y40 AromaticContact CE2-CE2 3.99Å; F15-Y40 HydrophobicContact CE2-CE2 3.99Å; F15-Y40 AromaticContact CG-CD2 3.93Å; F15-Y40 HydrophobicContact CG-CD2 3.93Å; Y40-W43 AromaticContact CD2-CE3 3.98Å; Y40-W43 HydrophobicContact CD2-CE3 3.98Å; Y40-W43 AromaticContact CE2-CE3 3.59Å; Y40-W43 HydrophobicContact CE2-CE3 3.59Å; Y40-W43 AromaticContact CE2-CZ3 3.73Å; Y40-W43 HydrophobicContact CE2-CZ3 3.73Å; Y40-W43 PolarHBondContact O-N 3.04Å; Y40-L44 HydrophobicContact CD1-CD1 4.06Å; Y40-L44 HydrophobicContact CE1-CD1 3.55Å; Y40-L44 HydrophobicContact CE1-CG 4.13Å; Y40-L44 HydrophobicContact CE2-CG 4.45Å; Y40-L44 WeakPolarHBondContact O-CG 3.34Å; Y40-L44 PolarHBondContact O-N 3.48Å
41L93.2Very high93.4Very high113 Ų11372.2 Ų72.259%0.59237%0.374SS*.Hα-helixtrans-66-42175.8-66.2179.3000111.3S39 W43 L44 Q45S39-L41 PolarHBondContact O-N 3.39Å; L41-W43 VanDerWaalsContact C-N 3.31Å; L41-W43 PolarHBondContact O-N 3.4Å; L41-L44 PolarHBondContact O-N 3.25Å; L41-Q45 WeakPolarHBondContact O-CG 3.36Å; L41-Q45 PolarHBondContact O-N 2.84Å; L41-Q45 VanDerWaalsContact O-N 3.11Å
42Q92.8Very high93.4Very high75 Ų7568.9 Ų68.935%0.3536%0.356SS..Hα-helixtrans-60.2-44.7176.6-17064.425.800110.6F17 Q38 S39 L44 Q45 D46F17-Q42 HydrophobicContact CZ-CG 4.43Å; Q38-Q42 VanDerWaalsContact OE1-CG 3.25Å; S39-Q42 WeakPolarHBondContact O-CB 3.44Å; S39-Q42 PolarHBondContact O-N 3.43Å; S39-Q42 WeakPolarHBondContact OG-CB 3.4Å; S39-Q42 PolarHBondContact OG-N 3.42Å; S39-Q42 VanDerWaalsContact OG-N 3.08Å; Q42-L44 VanDerWaalsContact C-N 3.27Å; Q42-L44 PolarHBondContact O-N 3.35Å; Q42-Q45 PolarHBondContact O-N 3.49Å; Q42-Q45 VanDerWaalsContact O-N 3.11Å; Q42-D46 CarbonylContact O-C 3.57Å; Q42-D46 PolarHBondContact O-N 3.24Å
43W93.2Very high93.5Very high62 Ų6267.8 Ų67.824%0.23535%0.351CS..Hα-helixtrans-60.3-34.5177.6178.171.9000113.8F15 F17 S39 Y40 L41 D46F15-W43 HydrophobicContact CD1-CB 3.84Å; F15-W43 AromaticContact CD1-CD1 3.79Å; F15-W43 AromaticContact CD1-CD2 3.81Å; F15-W43 HydrophobicContact CD1-CD2 3.81Å; F15-W43 HydrophobicContact CD1-CE3 4.42Å; F15-W43 AromaticContact CD1-CG 3.47Å; F15-W43 HydrophobicContact CD1-CG 3.47Å; F15-W43 VanDerWaalsContact CD1-CG 3.47Å; F15-W43 HydrophobicContact CE1-CB 4.31Å; F15-W43 AromaticContact CE1-CD1 3.58Å; F15-W43 AromaticContact CE1-CD2 3.35Å; F15-W43 HydrophobicContact CE1-CD2 3.35Å; F15-W43 AromaticContact CE1-CE2 3.43Å; F15-W43 VanDerWaalsContact CE1-CE2 3.43Å; F15-W43 AromaticContact CE1-CE3 3.98Å; F15-W43 HydrophobicContact CE1-CE3 3.98Å; F15-W43 AromaticContact CE1-CG 3.45Å; F15-W43 HydrophobicContact CE1-CG 3.45Å; F15-W43 VanDerWaalsContact CE1-CG 3.45Å; F15-W43 HydrophobicContact CE1-CZ2 4.1Å; F15-W43 AromaticContact CE1-NE1 3.55Å; F15-W43 HydrophobicContact CG-CB 4.45Å; F15-W43 HydrophobicContact CG-CG 4.4Å; F15-W43 AromaticContact CZ-CD2 3.81Å; F15-W43 HydrophobicContact CZ-CD2 3.81Å; F15-W43 AromaticContact CZ-CE2 3.85Å; F15-W43 HydrophobicContact CZ-CE3 4Å; F15-W43 HydrophobicContact CZ-CG 4.36Å; F15-W43 HydrophobicContact CZ-CH2 4.26Å; F15-W43 HydrophobicContact CZ-CZ2 4.08Å; F15-W43 HydrophobicContact CZ-CZ3 4.22Å; F17-W43 AromaticContact CD1-CD1 3.91Å; F17-W43 HydrophobicContact CD2-CB 4.4Å; F17-W43 HydrophobicContact CE1-CB 4.19Å; F17-W43 AromaticContact CE1-CD1 3.92Å; F17-W43 HydrophobicContact CE1-CG 4.49Å; F17-W43 HydrophobicContact CE2-CB 3.62Å; F17-W43 HydrophobicContact CE2-CG 4.27Å; F17-W43 VanDerWaalsContact CZ-CA 3.41Å; F17-W43 HydrophobicContact CZ-CB 3.53Å; F17-W43 HydrophobicContact CZ-CG 4.23Å; S39-W43 PolarHBondContact O-N 3.49Å; Y40-W43 AromaticContact CD2-CE3 3.98Å; Y40-W43 HydrophobicContact CD2-CE3 3.98Å; Y40-W43 AromaticContact CE2-CE3 3.59Å; Y40-W43 HydrophobicContact CE2-CE3 3.59Å; Y40-W43 AromaticContact CE2-CZ3 3.73Å; Y40-W43 HydrophobicContact CE2-CZ3 3.73Å; Y40-W43 PolarHBondContact O-N 3.04Å; L41-W43 VanDerWaalsContact C-N 3.31Å; L41-W43 PolarHBondContact O-N 3.4Å; W43-D46 WeakPolarHBondContact CA-O 3.46Å; W43-D46 CarbonylContact O-C 3.53Å
44L92.2Very high93.5Very high101 Ų10172.6 Ų72.653%0.52936%0.358SS..Hα-helixtrans-72.6-32.2176.5-73175.4000112.6Y40 L41 Q42Y40-L44 HydrophobicContact CD1-CD1 4.06Å; Y40-L44 HydrophobicContact CE1-CD1 3.55Å; Y40-L44 HydrophobicContact CE1-CG 4.13Å; Y40-L44 HydrophobicContact CE2-CG 4.45Å; Y40-L44 WeakPolarHBondContact O-CG 3.34Å; Y40-L44 PolarHBondContact O-N 3.48Å; L41-L44 PolarHBondContact O-N 3.25Å; Q42-L44 VanDerWaalsContact C-N 3.27Å; Q42-L44 PolarHBondContact O-N 3.35Å
45Q93.8Very high93.6Very high153 Ų15370.5 Ų70.572%0.71535%0.351SS*.Hα-helixtrans-79-44.2178.3-70.8174.8-13.900111.3L41 Q42L41-Q45 WeakPolarHBondContact O-CG 3.36Å; L41-Q45 PolarHBondContact O-N 2.84Å; L41-Q45 VanDerWaalsContact O-N 3.11Å; Q42-Q45 PolarHBondContact O-N 3.49Å; Q42-Q45 VanDerWaalsContact O-N 3.11Å
46D91.6Very high93.6Very high77 Ų7772 Ų7241%0.41236%0.361SS..  trans-143.8114.9-179.4-173.8-0.6000109.3F17 Q42 W43 D48F17-D46 WeakPolarHBondContact CE1-O 3.37Å; Q42-D46 CarbonylContact O-C 3.57Å; Q42-D46 PolarHBondContact O-N 3.24Å; W43-D46 WeakPolarHBondContact CA-O 3.46Å; W43-D46 CarbonylContact O-C 3.53Å; D46-D48 WeakPolarHBondContact OD1-CB 3.46Å; D46-D48 PolarHBondContact OD1-N 3.12Å
47S90.9Very high93.6Very high67 Ų6776.3 Ų76.347%0.46938%0.384SS..  trans-87.8-9.7178.666.40000113.4
48D92.6Very high93.7Very high126 Ų12679 Ų7967%0.67440%0.398SS*.  trans-75.8142.2-178.2-66.3-18.7000110D46D46-D48 WeakPolarHBondContact OD1-CB 3.46Å; D46-D48 PolarHBondContact OD1-N 3.12Å
49Y92.2Very high93.8Very high104 Ų10478.3 Ų78.341%0.40840%0.4SS..  trans-142.2151.3179.367.6-85.6000111.1F17 E18 I36 P51F17-Y49 HydrophobicContact CB-CD1 3.79Å; F17-Y49 HydrophobicContact CB-CE1 4.3Å; F17-Y49 HydrophobicContact CB-CG 4.04Å; F17-Y49 HydrophobicContact CD1-CD1 4.18Å; F17-Y49 HydrophobicContact CD1-CG 4.38Å; E18-Y49 HydrophobicContact CG-CE2 3.8Å; I36-Y49 HydrophobicContact CB-CD2 4.19Å; I36-Y49 HydrophobicContact CG1-CD2 3.89Å; Y49-P51 HydrophobicContact CE2-CB 4.25Å
50N92.5Very high93.8Very high53 Ų5376.2 Ų76.228%0.28339%0.385SS..  trans-100.4114.1174.9-172.7-9.9000109.6N52N50-N52 PolarHBondContact O-N 2.95Å; N50-N52 WeakPolarHBondContact OD1-CB 3.33Å; N50-N52 PolarHBondContact OD1-N 3.18Å
51P93.4Very high93.7Very high62 Ų6276.3 Ų76.340%0.40340%0.401SS..  trans-78.31.9178.333.7-36.4000113.3Y49 L60Y49-P51 HydrophobicContact CE2-CB 4.25Å; P51-L60 WeakPolarHBondContact O-CB 3.4Å; P51-L60 WeakPolarHBondContact O-CG 3.46Å; P51-L60 PolarHBondContact O-N 3.31Å
52N95.5Very high93.8Very high53 Ų5374 Ų7428%0.28339%0.394SS..BIsolated β-bridgetrans-93.9146.9-178.3-56.9-25.5000111.6N50 R54 I58 P59N50-N52 PolarHBondContact O-N 2.95Å; N50-N52 WeakPolarHBondContact OD1-CB 3.33Å; N50-N52 PolarHBondContact OD1-N 3.18Å; N52-R54 PolarHBondContact O-N 2.82Å; N52-I58 WeakPolarHBondContact CA-O 3.18Å; N52-P59 WeakPolarHBondContact OD1-CA 3.3Å
53C95.5Very high93.8Very high0 Ų076.6 Ų76.60%040%0.4CS..  trans-64.8128.9172.2177.70000109.6L55 C56 N57 I58 L60 H75C53-L55 PolarHBondContact O-N 3.11Å; C53-C56 PolarHBondContact O-N 2.85Å; C53-N57 WeakPolarHBondContact O-CA 3.18Å; C53-N57 PolarHBondContact O-N 2.82Å; C53-I58 PolarHBondContact N-O 2.96Å; C53-L60 HydrophobicContact CB-CD2 3.82Å; C53-L60 HydrophobicContact CB-CG 4.45Å; C53-H75 VanDerWaalsContact CB-ND1 3.33Å; C53-H75 WeakPolarHBondContact CB-ND1 3.49Å; C53-H75 PolarHBondContact SG-N 3.49Å
54R93.3Very high93.9Very high153 Ų15378.4 Ų78.458%0.57741%0.412SS*.THydrogen-bonded Turntrans-68.8-14.2-178.1-62.9-66.9-171.9164.51.9114.5N52 F74N52-R54 PolarHBondContact O-N 2.82Å; R54-F74 HydrophobicContact CB-CE1 4.09Å
55L95.3Very high94.1Very high50 Ų5074.6 Ų74.626%0.26239%0.393SS..THydrogen-bonded Turntrans-86.3-37.5-179.9-68.9172.9000112.8C53 F74 C78 P98C53-L55 PolarHBondContact O-N 3.11Å; L55-F74 HydrophobicContact CD1-CB 4.37Å; L55-F74 HydrophobicContact CD1-CD1 3.92Å; L55-F74 HydrophobicContact CD1-CG 4.36Å; L55-F74 HydrophobicContact CG-CD1 3.92Å; L55-F74 HydrophobicContact CG-CE1 4.39Å; L55-C78 HydrophobicContact CB-CB 3.8Å; L55-C78 HydrophobicContact CD1-CB 3.66Å; L55-C78 HydrophobicContact CG-CB 4.39Å; L55-P98 HydrophobicContact CD1-CG 4.41Å; L55-P98 HydrophobicContact CD2-CB 4.06Å; L55-P98 HydrophobicContact CD2-CG 3.79Å; L55-P98 HydrophobicContact CG-CG 4.34Å
56C95.6Very high94.1Very high40 Ų4067.7 Ų67.727%0.2736%0.361SS..THydrogen-bonded Turntrans-122.7-5.2-175.464.60000114.1C53 I58 H75 C78C53-C56 PolarHBondContact O-N 2.85Å; C56-I58 HydrophobicContact CB-CD1 4.44Å; C56-I58 PolarHBondContact O-N 3.11Å; C56-I58 VanDerWaalsContact O-N 3.14Å; C56-H75 PolarHBondContact SG-ND1 2.93Å; C56-C78 VanDerWaalsContact SG-SG 3.64Å
57N95.4Very high94.3Very high112 Ų11265.1 Ų65.160%0.59935%0.345SS*.  trans58.718.3-177.3-59.9-51.3000115.5C53C53-N57 WeakPolarHBondContact O-CA 3.18Å; C53-N57 PolarHBondContact O-N 2.82Å
58I96.3Very high94.6Very high61 Ų6162 Ų6231%0.31332%0.323SS..SBendtrans-94.7147.2174.9-63170.6000109.5N52 C53 C56 L60 S62 H75N52-I58 WeakPolarHBondContact CA-O 3.18Å; C53-I58 PolarHBondContact N-O 2.96Å; C56-I58 HydrophobicContact CB-CD1 4.44Å; C56-I58 PolarHBondContact O-N 3.11Å; C56-I58 VanDerWaalsContact O-N 3.14Å; I58-L60 PolarHBondContact O-N 3.03Å; I58-S62 WeakPolarHBondContact CG2-OG 3.47Å; I58-H75 PolarHBondContact O-CE1 3.49Å
59P95.9Very high94.6Very high63 Ų6357.9 Ų57.941%0.40930%0.303SS..BIsolated β-bridgetrans-53.2133.4177.919.4-34.6000113.3N52 A61 S62 H75N52-P59 WeakPolarHBondContact OD1-CA 3.3Å; P59-A61 PolarHBondContact O-N 3.32Å; P59-S62 WeakPolarHBondContact O-CB 3.4Å; P59-S62 PolarHBondContact O-N 3.28Å; P59-S62 VanDerWaalsContact O-N 3.13Å; P59-S62 PolarHBondContact O-OG 3.4Å; P59-H75 PolarHBondContact O-CE1 3.43Å; P59-H75 PolarHBondContact O-NE2 3Å; P59-H75 VanDerWaalsContact O-NE2 3.11Å
60L94.3Very high94.7Very high5 Ų555.2 Ų55.23%0.02630%0.299CS..G310 helixtrans-59.7-27.9178.7-73.4166.1000112.7I36 P51 C53 I58 S62 T65 L73 H75I36-L60 HydrophobicContact CD1-CD1 3.46Å; I36-L60 VanDerWaalsContact CD1-CD1 3.46Å; P51-L60 WeakPolarHBondContact O-CB 3.4Å; P51-L60 WeakPolarHBondContact O-CG 3.46Å; P51-L60 PolarHBondContact O-N 3.31Å; C53-L60 HydrophobicContact CB-CD2 3.82Å; C53-L60 HydrophobicContact CB-CG 4.45Å; I58-L60 PolarHBondContact O-N 3.03Å; L60-S62 PolarHBondContact O-N 2.64Å; L60-T65 HydrophobicContact CB-CG2 4.05Å; L60-T65 HydrophobicContact CD2-CG2 3.82Å; L60-T65 WeakPolarHBondContact O-CG2 3.19Å; L60-L73 HydrophobicContact CD1-CB 3.9Å; L60-L73 HydrophobicContact CD1-CD1 4.32Å; L60-L73 HydrophobicContact CD2-CB 4.21Å; L60-H75 WeakPolarHBondContact CA-NE2 3.33Å
61A93Very high94.8Very high73 Ų7355.5 Ų55.560%0.60330%0.296SS*.G310 helixtrans-61.3-28.7177.600000113.8K34 P59 R63K34-A61 PolarHBondContact NZ-O 3.13Å; P59-A61 PolarHBondContact O-N 3.32Å; A61-R63 PolarHBondContact O-N 3.43Å
62S94.1Very high94.9Very high65 Ų6554.3 Ų54.346%0.45529%0.286SS..G310 helixtrans-70.7-31-167.762.80000115.5I58 P59 L60 H75I58-S62 WeakPolarHBondContact CG2-OG 3.47Å; P59-S62 WeakPolarHBondContact O-CB 3.4Å; P59-S62 PolarHBondContact O-N 3.28Å; P59-S62 VanDerWaalsContact O-N 3.13Å; P59-S62 PolarHBondContact O-OG 3.4Å; L60-S62 PolarHBondContact O-N 2.64Å; S62-H75 PolarHBondContact OG-NE2 3.21Å
63R93.4Very high94.9Very high128 Ų12852.4 Ų52.448%0.48328%0.276SS..SBendtrans-133.1178-174.8-60.6178.1-178.4176.5-0.5110.1A61A61-R63 PolarHBondContact O-N 3.43Å
64E95.1Very high94.9Very high101 Ų10152.4 Ų52.447%0.47228%0.276SS..  trans-64.7134.5170.2-173.5176.5-166.300110.5H75 W76 K121E64-H75 CarbonylContact O-C 3.56Å; E64-H75 VanDerWaalsContact O-CA 3.3Å; E64-H75 WeakPolarHBondContact O-CA 3.41Å; E64-W76 HydrophobicContact CB-CB 4.49Å; E64-W76 HydrophobicContact CG-CB 4.28Å; E64-W76 PolarHBondContact O-N 3.37Å; E64-K121 IonicContact OE1-NZ 2.64Å; E64-K121 PolarHBondContact OE1-NZ 3.22Å
65T95.7Very high95.1Very high21 Ų2145.1 Ų45.113%0.12925%0.249CC..EExtended strand (participates in β ladder)trans-117.1145.5-179.556.50000110.7L60 F74L60-T65 HydrophobicContact CB-CG2 4.05Å; L60-T65 HydrophobicContact CD2-CG2 3.82Å; L60-T65 WeakPolarHBondContact O-CG2 3.19Å; T65-F74 CarbonylContact C-O 3.52Å; T65-F74 WeakPolarHBondContact CA-O 3.45Å; T65-F74 WeakPolarHBondContact CB-O 3.4Å
66T95.4Very high95.1Very high7 Ų744 Ų444%0.04324%0.241CC..EExtended strand (participates in β ladder)trans-115.4140169.6-138.20000109.6L68 F74 W76 L79 L118T66-L68 HydrophobicContact CG2-CD2 4.23Å; T66-F74 PolarHBondContact N-O 2.89Å; T66-F74 PolarHBondContact O-N 3.28Å; T66-W76 HydrophobicContact CG2-CE3 3.92Å; T66-W76 HydrophobicContact CG2-CZ3 4.31Å; T66-L79 HydrophobicContact CG2-CD2 3.57Å; T66-L118 HydrophobicContact CG2-CD1 4.34Å
67R95.6Very high95.1Very high23 Ų2344.8 Ų44.89%0.08725%0.25CS..EExtended strand (participates in β ladder)trans-102.5125.4175.8-170.9-179.1-64.6-81.73.9109.5H32 C35 Y71 L73 V114H32-R67 PolarHBondContact O-NH2 3.11Å; C35-R67 PolarHBondContact O-NH1 3.4Å; C35-R67 PolarHBondContact O-NH2 3.22Å; R67-Y71 PolarHBondContact NH1-O 3.06Å; R67-L73 HydrophobicContact CB-CD2 3.65Å; R67-L73 HydrophobicContact CG-CD2 4.05Å; R67-L73 HydrophobicContact CG-CG 4.49Å; R67-V114 HydrophobicContact CG-CG1 4.41Å
68L95.6Very high95.2Very high1 Ų139.9 Ų39.91%0.00523%0.225CC..  trans-79.7169175.2-59.9-173.4000111.6T66 C70 Y71 D72 F74 L79 C97 I104 L118T66-L68 HydrophobicContact CG2-CD2 4.23Å; L68-C70 VanDerWaalsContact CB-SG 3.6Å; L68-C70 PolarHBondContact O-N 2.96Å; L68-Y71 WeakPolarHBondContact O-CA 3.4Å; L68-Y71 PolarHBondContact O-N 3Å; L68-D72 PolarHBondContact N-O 3.47Å; L68-F74 HydrophobicContact CD1-CD2 4.08Å; L68-F74 HydrophobicContact CD1-CE2 3.74Å; L68-F74 HydrophobicContact CG-CD2 4.29Å; L68-F74 HydrophobicContact CG-CE2 4.3Å; L68-L79 HydrophobicContact CD2-CD2 4.07Å; L68-C97 HydrophobicContact CD1-CB 3.75Å; L68-I104 HydrophobicContact CD1-CG1 4.11Å; L68-I104 HydrophobicContact CD2-CG1 4.43Å; L68-I104 HydrophobicContact CD2-CG2 4.07Å; L68-L118 HydrophobicContact CD2-CD1 4.09Å; L68-L118 HydrophobicContact CD2-CD2 4.25Å
69V94Very high95.1Very high40 Ų4037.1 Ų37.124%0.24221%0.211CC..THydrogen-bonded Turntrans-63.4-29177.6-173.40000112Y71 P106 L110 L118V69-Y71 PolarHBondContact O-N 3.29Å; V69-P106 HydrophobicContact CG2-CB 3.68Å; V69-P106 HydrophobicContact CG2-CG 4.48Å; V69-L110 HydrophobicContact CG1-CD2 3.59Å; V69-L118 HydrophobicContact CG2-CD2 3.81Å
70C94Very high95.1Very high49 Ų4935.6 Ų35.633%0.33120%0.199SC..THydrogen-bonded Turntrans-72.31.2171.961.10000114L68 D72 C100L68-C70 VanDerWaalsContact CB-SG 3.6Å; L68-C70 PolarHBondContact O-N 2.96Å; C70-D72 PolarHBondContact O-N 3.11Å; C70-D72 PolarHBondContact SG-OD2 3.42Å; C70-C100 VanDerWaalsContact CB-SG 3.52Å
71Y94.8Very high95.1Very high58 Ų5841.3 Ų41.323%0.22723%0.225CC..  trans72-3.7-176.3-50.8-65.3000116.6L14 E25 L28 R67 L68 V69 V114L14-Y71 HydrophobicContact CD1-CD1 4.49Å; L14-Y71 HydrophobicContact CD1-CE1 3.88Å; L14-Y71 HydrophobicContact CD1-CE2 4.24Å; L14-Y71 HydrophobicContact CD2-CD2 3.81Å; L14-Y71 HydrophobicContact CD2-CE2 3.56Å; L14-Y71 HydrophobicContact CD2-CG 4.42Å; E25-Y71 HydrophobicContact CG-CE1 4.38Å; E25-Y71 PolarHBondContact OE1-OH 2.97Å; L28-Y71 HydrophobicContact CD2-CD1 3.43Å; L28-Y71 VanDerWaalsContact CD2-CD1 3.43Å; L28-Y71 HydrophobicContact CD2-CE1 3.68Å; L28-Y71 HydrophobicContact CD2-CG 4.4Å; R67-Y71 PolarHBondContact NH1-O 3.06Å; L68-Y71 WeakPolarHBondContact O-CA 3.4Å; L68-Y71 PolarHBondContact O-N 3Å; V69-Y71 PolarHBondContact O-N 3.29Å; Y71-V114 HydrophobicContact CE1-CG2 4.39Å
72D94.8Very high95.2Very high37 Ų3743.6 Ų43.620%0.19822%0.219CC..  trans-62.9146.1172-63.8-39.5000111.5L68 C70 F74 C97 C100L68-D72 PolarHBondContact N-O 3.47Å; C70-D72 PolarHBondContact O-N 3.11Å; C70-D72 PolarHBondContact SG-OD2 3.42Å; D72-F74 HydrophobicContact CB-CE2 3.62Å; D72-F74 HydrophobicContact CB-CZ 4Å; D72-C97 PolarHBondContact OD2-SG 3Å; D72-C100 PolarHBondContact OD2-SG 3.13Å
73L94.9Very high95.1Very high13 Ų1340.7 Ų40.77%0.06820%0.198CC..EExtended strand (participates in β ladder)trans-116.3134-177.2-80.6172.5000111.4A33 K34 C35 I36 L60 R67A33-L73 WeakPolarHBondContact O-CD2 3.41Å; K34-L73 WeakPolarHBondContact O-CD1 3.38Å; C35-L73 WeakPolarHBondContact O-CD1 3.45Å; I36-L73 HydrophobicContact CD1-CD1 4.19Å; L60-L73 HydrophobicContact CD1-CB 3.9Å; L60-L73 HydrophobicContact CD1-CD1 4.32Å; L60-L73 HydrophobicContact CD2-CB 4.21Å; R67-L73 HydrophobicContact CB-CD2 3.65Å; R67-L73 HydrophobicContact CG-CD2 4.05Å; R67-L73 HydrophobicContact CG-CG 4.49Å
74F96.6Very high94.9Very high1 Ų138.3 Ų38.30%0.00421%0.206CC..EExtended strand (participates in β ladder)trans-138159.1174.7-55.1-85.7000109.6R54 L55 T65 T66 L68 D72 P98 S99R54-F74 HydrophobicContact CB-CE1 4.09Å; L55-F74 HydrophobicContact CD1-CB 4.37Å; L55-F74 HydrophobicContact CD1-CD1 3.92Å; L55-F74 HydrophobicContact CD1-CG 4.36Å; L55-F74 HydrophobicContact CG-CD1 3.92Å; L55-F74 HydrophobicContact CG-CE1 4.39Å; T65-F74 CarbonylContact C-O 3.52Å; T65-F74 WeakPolarHBondContact CA-O 3.45Å; T65-F74 WeakPolarHBondContact CB-O 3.4Å; T66-F74 PolarHBondContact N-O 2.89Å; T66-F74 PolarHBondContact O-N 3.28Å; L68-F74 HydrophobicContact CD1-CD2 4.08Å; L68-F74 HydrophobicContact CD1-CE2 3.74Å; L68-F74 HydrophobicContact CG-CD2 4.29Å; L68-F74 HydrophobicContact CG-CE2 4.3Å; D72-F74 HydrophobicContact CB-CE2 3.62Å; D72-F74 HydrophobicContact CB-CZ 4Å; F74-P98 HydrophobicContact CE1-CB 4.19Å; F74-P98 HydrophobicContact CE1-CG 4.07Å; F74-P98 HydrophobicContact CZ-CB 4.34Å; F74-P98 HydrophobicContact CZ-CG 4.18Å; F74-S99 WeakPolarHBondContact CZ-OG 3.2Å
75H97Very high94.7Very high0 Ų039.8 Ų39.80%021%0.213CC..EExtended strand (participates in β ladder)trans-64.6138.2164.4-64.1128.3000109.9C53 C56 I58 P59 L60 S62 E64 A77 C78 L79C53-H75 VanDerWaalsContact CB-ND1 3.33Å; C53-H75 WeakPolarHBondContact CB-ND1 3.49Å; C53-H75 PolarHBondContact SG-N 3.49Å; C56-H75 PolarHBondContact SG-ND1 2.93Å; I58-H75 PolarHBondContact O-CE1 3.49Å; P59-H75 PolarHBondContact O-CE1 3.43Å; P59-H75 PolarHBondContact O-NE2 3Å; P59-H75 VanDerWaalsContact O-NE2 3.11Å; L60-H75 WeakPolarHBondContact CA-NE2 3.33Å; S62-H75 PolarHBondContact OG-NE2 3.21Å; E64-H75 CarbonylContact O-C 3.56Å; E64-H75 VanDerWaalsContact O-CA 3.3Å; E64-H75 WeakPolarHBondContact O-CA 3.41Å; H75-A77 VanDerWaalsContact C-N 3.31Å; H75-A77 PolarHBondContact O-N 3.4Å; H75-C78 HydrophobicContact CB-CB 4.14Å; H75-C78 PolarHBondContact O-N 3.28Å; H75-L79 PolarHBondContact O-N 3.5Å
76W96Very high94.5Very high27 Ų2741.8 Ų41.810%0.10222%0.222CC..Hα-helixtrans-58.8-44.8179.2177-124.7000111.7E64 T66 C78 L79 N80 K121 L122 V125E64-W76 HydrophobicContact CB-CB 4.49Å; E64-W76 HydrophobicContact CG-CB 4.28Å; E64-W76 PolarHBondContact O-N 3.37Å; T66-W76 HydrophobicContact CG2-CE3 3.92Å; T66-W76 HydrophobicContact CG2-CZ3 4.31Å; W76-C78 PolarHBondContact O-N 3.35Å; W76-L79 HydrophobicContact CE3-CD2 4.36Å; W76-L79 HydrophobicContact CZ3-CD2 4.2Å; W76-L79 PolarHBondContact O-N 3.42Å; W76-N80 WeakPolarHBondContact CZ2-ND2 3.34Å; W76-N80 PolarHBondContact NE1-ND2 3.29Å; W76-N80 VanDerWaalsContact NE1-ND2 3.13Å; W76-N80 PolarHBondContact O-N 2.94Å; W76-K121 HydrophobicContact CH2-CB 4.34Å; W76-K121 WeakPolarHBondContact CH2-O 3.46Å; W76-K121 WeakPolarHBondContact CZ2-O 3.31Å; W76-K121 HydrophobicContact CZ3-CB 4.41Å; W76-L122 HydrophobicContact CH2-CD2 4.17Å; W76-L122 HydrophobicContact CZ3-CD2 4.21Å; W76-V125 HydrophobicContact CH2-CG1 4.47Å; W76-V125 HydrophobicContact CH2-CG2 3.93Å; W76-V125 HydrophobicContact CZ2-CG1 3.74Å; W76-V125 HydrophobicContact CZ2-CG2 4.02Å
77A96.3Very high94.1Very high55 Ų5545 Ų4546%0.45524%0.243SC..Hα-helixtrans-58.4-45176.200000112.7H75 L79 N80 E81H75-A77 VanDerWaalsContact C-N 3.31Å; H75-A77 PolarHBondContact O-N 3.4Å; A77-L79 VanDerWaalsContact C-N 3.35Å; A77-L79 PolarHBondContact O-N 3.45Å; A77-N80 PolarHBondContact O-N 2.95Å; A77-E81 WeakPolarHBondContact O-CB 3.41Å; A77-E81 PolarHBondContact O-N 3.24Å
78C96.3Very high93.4Very high10 Ų1056.1 Ų56.17%0.06829%0.285CS..Hα-helixtrans-66.4-37.7-179.9-62.80000112.1L55 C56 H75 W76 R82L55-C78 HydrophobicContact CB-CB 3.8Å; L55-C78 HydrophobicContact CD1-CB 3.66Å; L55-C78 HydrophobicContact CG-CB 4.39Å; C56-C78 VanDerWaalsContact SG-SG 3.64Å; H75-C78 HydrophobicContact CB-CB 4.14Å; H75-C78 PolarHBondContact O-N 3.28Å; W76-C78 PolarHBondContact O-N 3.35Å; C78-R82 WeakPolarHBondContact O-CB 3.09Å; C78-R82 PolarHBondContact O-N 3.28Å; C78-R82 VanDerWaalsContact O-N 3.11Å
79L95.4Very high93Very high3 Ų362.9 Ų62.92%0.01632%0.322CS..Hα-helixtrans-65-43.3175.3-170.971.4000111T66 L68 H75 W76 A77 R82 A83 I104T66-L79 HydrophobicContact CG2-CD2 3.57Å; L68-L79 HydrophobicContact CD2-CD2 4.07Å; H75-L79 PolarHBondContact O-N 3.5Å; W76-L79 HydrophobicContact CE3-CD2 4.36Å; W76-L79 HydrophobicContact CZ3-CD2 4.2Å; W76-L79 PolarHBondContact O-N 3.42Å; A77-L79 VanDerWaalsContact C-N 3.35Å; A77-L79 PolarHBondContact O-N 3.45Å; L79-R82 PolarHBondContact O-N 3.03Å; L79-A83 WeakPolarHBondContact O-CB 3.38Å; L79-A83 PolarHBondContact O-N 2.91Å; L79-I104 HydrophobicContact CD1-CD1 3.96Å
80N94.8Very high92.8Very high30 Ų3062.5 Ų62.516%0.1632%0.319CS..Hα-helixtrans-64.6-45177.9-79-22.5000112.8W76 A77 R82 A83 A84 W127W76-N80 WeakPolarHBondContact CZ2-ND2 3.34Å; W76-N80 PolarHBondContact NE1-ND2 3.29Å; W76-N80 VanDerWaalsContact NE1-ND2 3.13Å; W76-N80 PolarHBondContact O-N 2.94Å; A77-N80 PolarHBondContact O-N 2.95Å; N80-R82 VanDerWaalsContact C-N 3.3Å; N80-R82 PolarHBondContact O-N 3.49Å; N80-A83 PolarHBondContact O-N 3.11Å; N80-A84 WeakPolarHBondContact O-CB 3.45Å; N80-A84 PolarHBondContact O-N 3.21Å; N80-W127 PolarHBondContact OD1-NE1 2.85Å
81E94.8Very high92.5Very high125 Ų12563 Ų6358%0.58433%0.327SS*.Hα-helixtrans-59.2-44.1176.9-176179.2-173.400111.1A77 A83 A84 Q85A77-E81 WeakPolarHBondContact O-CB 3.41Å; A77-E81 PolarHBondContact O-N 3.24Å; E81-A83 PolarHBondContact O-N 3.47Å; E81-A84 PolarHBondContact O-N 3.44Å; E81-Q85 WeakPolarHBondContact O-CG 3.11Å; E81-Q85 PolarHBondContact O-N 3Å; E81-Q85 VanDerWaalsContact O-N 3.13Å
82R93.9Very high92.1Very high122 Ų12263.1 Ų63.146%0.4634%0.335SS..Hα-helixtrans-64.2-41.3176.6-178.659.3175.9-83.4-2.1112.4C78 L79 N80 A84 Q85C78-R82 WeakPolarHBondContact O-CB 3.09Å; C78-R82 PolarHBondContact O-N 3.28Å; C78-R82 VanDerWaalsContact O-N 3.11Å; L79-R82 PolarHBondContact O-N 3.03Å; N80-R82 VanDerWaalsContact C-N 3.3Å; N80-R82 PolarHBondContact O-N 3.49Å; R82-A84 VanDerWaalsContact C-N 3.33Å; R82-Q85 PolarHBondContact O-N 3.18Å
83A92.6Very high91.7Very high4 Ų464.9 Ų64.93%0.03335%0.354CS..Hα-helixtrans-66.8-36.1176.900000111.9L79 N80 E81 Q85 L86 Y95 W127L79-A83 WeakPolarHBondContact O-CB 3.38Å; L79-A83 PolarHBondContact O-N 2.91Å; N80-A83 PolarHBondContact O-N 3.11Å; E81-A83 PolarHBondContact O-N 3.47Å; A83-Q85 VanDerWaalsContact C-N 3.29Å; A83-Q85 PolarHBondContact O-N 3.25Å; A83-L86 WeakPolarHBondContact O-CB 3.38Å; A83-L86 PolarHBondContact O-N 3.4Å; A83-Y95 HydrophobicContact CB-CD1 4.04Å; A83-Y95 HydrophobicContact CB-CE1 3.84Å; A83-W127 HydrophobicContact CB-CD2 3.52Å; A83-W127 HydrophobicContact CB-CE3 3.77Å; A83-W127 HydrophobicContact CB-CG 4.16Å; A83-W127 HydrophobicContact CB-CH2 3.78Å; A83-W127 HydrophobicContact CB-CZ2 3.52Å; A83-W127 HydrophobicContact CB-CZ3 3.89Å
84A89.3Confident91.4Very high77 Ų7766 Ų6664%0.63637%0.369SS*.Hα-helixtrans-69.3-24.3177.200000113.5N80 E81 R82 L86N80-A84 WeakPolarHBondContact O-CB 3.45Å; N80-A84 PolarHBondContact O-N 3.21Å; E81-A84 PolarHBondContact O-N 3.44Å; R82-A84 VanDerWaalsContact C-N 3.33Å; A84-L86 VanDerWaalsContact C-N 3.25Å; A84-L86 PolarHBondContact O-N 3.37Å
85Q91.3Very high91.3Very high133 Ų13366.5 Ų66.562%0.62137%0.371SS*.THydrogen-bonded Turntrans-73.5-16.2173.1-70.5168.813.200113.1E81 R82 A83E81-Q85 WeakPolarHBondContact O-CG 3.11Å; E81-Q85 PolarHBondContact O-N 3Å; E81-Q85 VanDerWaalsContact O-N 3.13Å; R82-Q85 PolarHBondContact O-N 3.18Å; A83-Q85 VanDerWaalsContact C-N 3.29Å; A83-Q85 PolarHBondContact O-N 3.25Å
86L90.3Very high91.2Very high62 Ų6271.2 Ų71.233%0.32539%0.393SS..SBendtrans-78.9149177.5-65.2170.7000110.7A83 A84 T90 Y95A83-L86 WeakPolarHBondContact O-CB 3.38Å; A83-L86 PolarHBondContact O-N 3.4Å; A84-L86 VanDerWaalsContact C-N 3.25Å; A84-L86 PolarHBondContact O-N 3.37Å; L86-T90 HydrophobicContact CD1-CG2 4.38Å; L86-Y95 HydrophobicContact CB-CE1 4.48Å; L86-Y95 HydrophobicContact CD1-CD1 3.7Å; L86-Y95 HydrophobicContact CD1-CE1 3.78Å; L86-Y95 HydrophobicContact CD1-CG 4.47Å
87P87.7Confident91.1Very high75 Ų7570 Ų7049%0.48739%0.389SS..  trans-54.9144.1176.1-27.636.2000112.7N89 T90P87-N89 WeakPolarHBondContact CB-OD1 3.46Å; P87-N89 PolarHBondContact O-N 3Å; P87-N89 VanDerWaalsContact O-N 3.1Å; P87-T90 WeakPolarHBondContact O-CB 3.45Å; P87-T90 PolarHBondContact O-N 3.3Å; P87-T90 PolarHBondContact O-OG1 3.21Å
88R81.8Confident91Very high256 Ų25669.5 Ų69.597%0.96638%0.381SS*.THydrogen-bonded Turntrans-60.2-22.7179.6-65.4-175.4179.6-169-0.8113.9T90R88-T90 VanDerWaalsContact C-N 3.27Å
89N85.8Confident90.8Very high144 Ų14472 Ų7277%0.7740%0.398SS*.THydrogen-bonded Turntrans-87.311.6175.267.4-34.9000113.5P87 A91P87-N89 WeakPolarHBondContact CB-OD1 3.46Å; P87-N89 PolarHBondContact O-N 3Å; P87-N89 VanDerWaalsContact O-N 3.1Å; N89-A91 PolarHBondContact O-N 2.92Å; N89-A91 VanDerWaalsContact O-N 3.17Å
90T89.7Confident90.6Very high31 Ų3174.9 Ų74.919%0.1942%0.418CS..  trans-64.7117.1176.9-60.30000109.5L86 P87 R88 Y95L86-T90 HydrophobicContact CD1-CG2 4.38Å; P87-T90 WeakPolarHBondContact O-CB 3.45Å; P87-T90 PolarHBondContact O-N 3.3Å; P87-T90 PolarHBondContact O-OG1 3.21Å; R88-T90 VanDerWaalsContact C-N 3.27Å; T90-Y95 HydrophobicContact CG2-CD2 3.9Å; T90-Y95 HydrophobicContact CG2-CE2 3.65Å
91A88.4Confident90.6Very high60 Ų6078.8 Ų78.850%0.49644%0.439SS..  trans-62.2156.6174.500000110.9N89 A93 G94N89-A91 PolarHBondContact O-N 2.92Å; N89-A91 VanDerWaalsContact O-N 3.17Å; A91-A93 PolarHBondContact O-N 3.17Å; A91-A93 VanDerWaalsContact O-N 3.11Å; A91-G94 WeakPolarHBondContact O-CA 3.33Å; A91-G94 PolarHBondContact O-N 2.78Å
92P86.8Confident90.5Very high60 Ų6073.8 Ų73.839%0.3942%0.421SS..G310 helixtrans-56.5-34.8-177.8-26.337.2000113.1G94 Y95 F105P92-G94 PolarHBondContact O-N 3.4Å; P92-Y95 PolarHBondContact O-N 3.28Å; P92-F105 HydrophobicContact CB-CD2 3.96Å; P92-F105 HydrophobicContact CB-CE2 4.1Å; P92-F105 VanDerWaalsContact O-CD2 3.22Å; P92-F105 WeakPolarHBondContact O-CD2 3.43Å; P92-F105 WeakPolarHBondContact O-CE2 3.34Å
93A86.3Confident90.4Very high74 Ų7472 Ų7261%0.61243%0.425SS*.G310 helixtrans-66.8-18.6175.600000114.4A91 Y95A91-A93 PolarHBondContact O-N 3.17Å; A91-A93 VanDerWaalsContact O-N 3.11Å; A93-Y95 VanDerWaalsContact C-N 3.33Å
94G89.5Confident90.5Very high36 Ų3672.1 Ų72.137%0.37143%0.425SS..G310 helixtrans-76.5-18.8176.800000113.6A91 P92 Q96A91-G94 WeakPolarHBondContact O-CA 3.33Å; A91-G94 PolarHBondContact O-N 2.78Å; P92-G94 PolarHBondContact O-N 3.4Å; G94-Q96 PolarHBondContact O-N 2.86Å
95Y92.9Very high90.7Very high12 Ų1269.3 Ų69.35%0.04740%0.399CS..  trans-83.1101.2175.4-65.4-88.8000110A83 L86 T90 P92 A93 I104 F105 W127A83-Y95 HydrophobicContact CB-CD1 4.04Å; A83-Y95 HydrophobicContact CB-CE1 3.84Å; L86-Y95 HydrophobicContact CB-CE1 4.48Å; L86-Y95 HydrophobicContact CD1-CD1 3.7Å; L86-Y95 HydrophobicContact CD1-CE1 3.78Å; L86-Y95 HydrophobicContact CD1-CG 4.47Å; T90-Y95 HydrophobicContact CG2-CD2 3.9Å; T90-Y95 HydrophobicContact CG2-CE2 3.65Å; P92-Y95 PolarHBondContact O-N 3.28Å; A93-Y95 VanDerWaalsContact C-N 3.33Å; Y95-I104 WeakPolarHBondContact O-CB 3.5Å; Y95-I104 PolarHBondContact O-N 3.19Å; Y95-F105 AromaticContact CD2-CE2 3.56Å; Y95-F105 HydrophobicContact CD2-CE2 3.56Å; Y95-F105 HydrophobicContact CD2-CZ 4.23Å; Y95-F105 HydrophobicContact CE2-CE2 4.37Å; Y95-F105 AromaticContact CG-CE2 3.79Å; Y95-F105 HydrophobicContact CG-CE2 3.79Å; Y95-F105 HydrophobicContact CG-CZ 4.45Å; Y95-W127 AromaticContact CD1-CE3 3.63Å; Y95-W127 HydrophobicContact CD1-CE3 3.63Å; Y95-W127 HydrophobicContact CD1-CH2 4.43Å; Y95-W127 AromaticContact CD1-CZ3 3.47Å; Y95-W127 HydrophobicContact CD1-CZ3 3.47Å; Y95-W127 VanDerWaalsContact CD1-CZ3 3.47Å; Y95-W127 HydrophobicContact CE1-CD2 4.18Å; Y95-W127 AromaticContact CE1-CE3 3.35Å; Y95-W127 HydrophobicContact CE1-CE3 3.35Å; Y95-W127 AromaticContact CE1-CZ3 3.74Å; Y95-W127 HydrophobicContact CE1-CZ3 3.74Å; Y95-W127 HydrophobicContact CE2-CE3 4.37Å; Y95-W127 HydrophobicContact CG-CE3 4.26Å; Y95-W127 AromaticContact CG-CZ3 3.93Å; Y95-W127 HydrophobicContact CG-CZ3 3.93Å; Y95-W127 AromaticContact CZ-CE3 3.74Å
96Q95Very high90.7Very high100 Ų10063.4 Ų63.447%0.46737%0.372SS..BIsolated β-bridgetrans-115.7148.5-172.8-65.4177.50.500112.4G94 G102 I104G94-Q96 PolarHBondContact O-N 2.86Å; Q96-G102 CarbonylContact C-O 3.54Å; Q96-G102 WeakPolarHBondContact CA-O 3.36Å; Q96-I104 WeakPolarHBondContact O-CD1 3.22Å
97C95.1Very high90.7Very high1 Ų163.5 Ų63.51%0.00738%0.376CS..  trans-62.8128.4174.6176.80000110.1L68 D72 S99 C100 N101 G102L68-C97 HydrophobicContact CD1-CB 3.75Å; D72-C97 PolarHBondContact OD2-SG 3Å; C97-S99 PolarHBondContact O-N 3.08Å; C97-S99 VanDerWaalsContact O-N 3.08Å; C97-S99 PolarHBondContact SG-N 3.24Å; C97-S99 VanDerWaalsContact SG-N 3.4Å; C97-C100 VanDerWaalsContact SG-SG 3.63Å; C97-N101 WeakPolarHBondContact O-CA 3.18Å; C97-N101 PolarHBondContact O-N 3.16Å; C97-G102 PolarHBondContact N-O 2.64Å
98P92.8Very high90.6Very high45 Ų4566.8 Ų66.829%0.29240%0.395SS..THydrogen-bonded Turntrans-62-17.6178.3-2332.2000115.3L55 F74L55-P98 HydrophobicContact CD1-CG 4.41Å; L55-P98 HydrophobicContact CD2-CB 4.06Å; L55-P98 HydrophobicContact CD2-CG 3.79Å; L55-P98 HydrophobicContact CG-CG 4.34Å; F74-P98 HydrophobicContact CE1-CB 4.19Å; F74-P98 HydrophobicContact CE1-CG 4.07Å; F74-P98 HydrophobicContact CZ-CB 4.34Å; F74-P98 HydrophobicContact CZ-CG 4.18Å
99S92.1Very high91Very high61 Ų6161.3 Ų61.343%0.42739%0.385SS..THydrogen-bonded Turntrans-100.3-38.6-175-62.50000113.7F74 C97F74-S99 WeakPolarHBondContact CZ-OG 3.2Å; C97-S99 PolarHBondContact O-N 3.08Å; C97-S99 VanDerWaalsContact O-N 3.08Å; C97-S99 PolarHBondContact SG-N 3.24Å; C97-S99 VanDerWaalsContact SG-N 3.4Å
100C92.8Very high91.2Very high64 Ų6457.7 Ų57.743%0.43237%0.365SS..THydrogen-bonded Turntrans-122.61-176.8620000114.2C70 D72 C97 G102C70-C100 VanDerWaalsContact CB-SG 3.52Å; D72-C100 PolarHBondContact OD2-SG 3.13Å; C97-C100 VanDerWaalsContact SG-SG 3.63Å; C100-G102 PolarHBondContact O-N 3.46Å
101N93.3Very high91Very high112 Ų11260.7 Ų60.760%0.59939%0.393SS*.  trans56.512.4-175-55.7-37.2000114.8C97C97-N101 WeakPolarHBondContact O-CA 3.18Å; C97-N101 PolarHBondContact O-N 3.16Å
102G92.5Very high91.2Very high21 Ų2158.3 Ų58.322%0.21637%0.374CS..  trans-69.3159.4175.100000112.3Q96 C97 C100 I104Q96-G102 CarbonylContact C-O 3.54Å; Q96-G102 WeakPolarHBondContact CA-O 3.36Å; C97-G102 PolarHBondContact N-O 2.64Å; C100-G102 PolarHBondContact O-N 3.46Å; G102-I104 PolarHBondContact O-N 3.11Å
103P92.7Very high91.6Very high84 Ų8457.1 Ų57.155%0.54537%0.367SS..BIsolated β-bridgetrans-63.8134.3179.127.2-34.4000111.2
104I94.5Very high92Very high6 Ų654 Ų543%0.03134%0.34CS..SBendtrans-70.9-38173.8-72171.7000110.5L68 L79 Y95 Q96 G102 P106 L118 L122L68-I104 HydrophobicContact CD1-CG1 4.11Å; L68-I104 HydrophobicContact CD2-CG1 4.43Å; L68-I104 HydrophobicContact CD2-CG2 4.07Å; L79-I104 HydrophobicContact CD1-CD1 3.96Å; Y95-I104 WeakPolarHBondContact O-CB 3.5Å; Y95-I104 PolarHBondContact O-N 3.19Å; Q96-I104 WeakPolarHBondContact O-CD1 3.22Å; G102-I104 PolarHBondContact O-N 3.11Å; I104-P106 WeakPolarHBondContact O-CD 3.45Å; I104-L118 WeakPolarHBondContact O-CD2 3.44Å; I104-L122 HydrophobicContact CG2-CD1 4.36Å; I104-L122 HydrophobicContact CG2-CD2 4.26Å
105F94.4Very high92.2Very high19 Ų1952.3 Ų52.38%0.08332%0.323CS..SBendtrans-75.7123.3-179.1-65-80.9000111.2P92 Y95 L122 W127 A128 L132P92-F105 HydrophobicContact CB-CD2 3.96Å; P92-F105 HydrophobicContact CB-CE2 4.1Å; P92-F105 VanDerWaalsContact O-CD2 3.22Å; P92-F105 WeakPolarHBondContact O-CD2 3.43Å; P92-F105 WeakPolarHBondContact O-CE2 3.34Å; Y95-F105 AromaticContact CD2-CE2 3.56Å; Y95-F105 HydrophobicContact CD2-CE2 3.56Å; Y95-F105 HydrophobicContact CD2-CZ 4.23Å; Y95-F105 HydrophobicContact CE2-CE2 4.37Å; Y95-F105 AromaticContact CG-CE2 3.79Å; Y95-F105 HydrophobicContact CG-CE2 3.79Å; Y95-F105 HydrophobicContact CG-CZ 4.45Å; F105-L122 HydrophobicContact CD1-CD1 4.01Å; F105-L122 HydrophobicContact CE1-CD1 4.26Å; F105-W127 HydrophobicContact CE2-CZ3 4.36Å; F105-W127 HydrophobicContact CZ-CE3 4.24Å; F105-W127 AromaticContact CZ-CZ3 3.83Å; F105-W127 HydrophobicContact CZ-CZ3 3.83Å; F105-A128 HydrophobicContact CE1-CB 3.84Å; F105-A128 WeakPolarHBondContact CE1-O 3.48Å; F105-A128 HydrophobicContact CZ-CB 4.09Å; F105-L132 HydrophobicContact CD1-CD2 3.85Å; F105-L132 HydrophobicContact CD1-CG 4.06Å; F105-L132 HydrophobicContact CE1-CD2 4.45Å; F105-L132 HydrophobicContact CE1-CG 4.15Å
106P91.5Very high92.3Very high8 Ų854.3 Ų54.35%0.05234%0.339CS..PPolyproline II helixtrans-67.1139.9174.523.4-28.3000110.7V69 I104 A115 R119V69-P106 HydrophobicContact CG2-CB 3.68Å; V69-P106 HydrophobicContact CG2-CG 4.48Å; I104-P106 WeakPolarHBondContact O-CD 3.45Å; P106-A115 HydrophobicContact CB-CB 3.82Å; P106-A115 HydrophobicContact CG-CB 4.48Å; P106-R119 HydrophobicContact CG-CG 3.43Å; P106-R119 VanDerWaalsContact CG-CG 3.43Å
107P89.8Confident92.3Very high65 Ų6551 Ų5142%0.42233%0.329SS..PPolyproline II helixtrans-55.1145.4171.9-2332.1000111.6N109 L110 R119P107-N109 VanDerWaalsContact C-N 3.26Å; P107-N109 WeakPolarHBondContact CB-OD1 3.43Å; P107-N109 PolarHBondContact O-N 3.46Å; P107-L110 HydrophobicContact CB-CB 4.2Å; P107-L110 HydrophobicContact CG-CB 4.45Å; P107-L110 WeakPolarHBondContact O-CB 3.46Å; P107-L110 PolarHBondContact O-N 3.44Å; P107-R119 PolarHBondContact O-NH1 3.19Å
108T85.7Confident92.3Very high144 Ų14451.1 Ų51.188%0.88333%0.329SS*.THydrogen-bonded Turntrans-63.2-33.1-176.851.80000112.7L110T108-L110 VanDerWaalsContact C-N 3.32Å
109N89.1Confident92.3Very high141 Ų14151.9 Ų51.975%0.75433%0.326SS*.THydrogen-bonded Turntrans-78.1-8.8175.849.3-44.3000114.1P107 A111P107-N109 VanDerWaalsContact C-N 3.26Å; P107-N109 WeakPolarHBondContact CB-OD1 3.43Å; P107-N109 PolarHBondContact O-N 3.46Å; N109-A111 PolarHBondContact O-N 3.26Å
110L90.4Very high92.4Very high67 Ų6755.9 Ų55.935%0.35134%0.338SS..  trans-85.898178.9-172.867000111V69 P107 T108 G112 A115 R119V69-L110 HydrophobicContact CG1-CD2 3.59Å; P107-L110 HydrophobicContact CB-CB 4.2Å; P107-L110 HydrophobicContact CG-CB 4.45Å; P107-L110 WeakPolarHBondContact O-CB 3.46Å; P107-L110 PolarHBondContact O-N 3.44Å; T108-L110 VanDerWaalsContact C-N 3.32Å; L110-G112 VanDerWaalsContact C-N 3.34Å; L110-G112 PolarHBondContact O-N 3.42Å; L110-A115 HydrophobicContact CD2-CB 3.92Å; L110-A115 HydrophobicContact CG-CB 4.05Å; L110-R119 PolarHBondContact O-NH1 3.44Å; L110-R119 PolarHBondContact O-NH2 3.1Å
111A86.1Confident92.4Very high95 Ų9556.7 Ų56.779%0.78533%0.334SS*.  trans-92.640.7179.300000113.7N109N109-A111 PolarHBondContact O-N 3.26Å
112G92.6Very high92.5Very high9 Ų951.3 Ų51.39%0.09331%0.305CS..  trans-80.4151.7174.400000112.5L110 V114 A115 S116L110-G112 VanDerWaalsContact C-N 3.34Å; L110-G112 PolarHBondContact O-N 3.42Å; G112-V114 VanDerWaalsContact C-N 3.3Å; G112-V114 PolarHBondContact O-N 2.89Å; G112-A115 PolarHBondContact O-N 2.86Å; G112-S116 WeakPolarHBondContact O-CB 3.44Å; G112-S116 PolarHBondContact O-N 3.14Å; G112-S116 PolarHBondContact O-OG 2.71Å
113P93.8Very high92.5Very high35 Ų3551.4 Ų51.423%0.22730%0.304CS..Hα-helixtrans-60.6-37.3174.825.1-36000112.4E25 V29 S116 A117E25-P113 HydrophobicContact CB-CG 3.6Å; E25-P113 WeakPolarHBondContact OE2-CD 3.17Å; V29-P113 HydrophobicContact CG2-CB 4.24Å; P113-S116 PolarHBondContact O-N 2.78Å; P113-A117 WeakPolarHBondContact O-CB 3.46Å; P113-A117 PolarHBondContact O-N 3.46Å
114V94.9Very high92.5Very high8 Ų851.3 Ų51.35%0.04830%0.302CS..Hα-helixtrans-65.9-46.1176.3176.20000110.6E25 L28 V29 R67 Y71 G112 S116 A117 L118E25-V114 HydrophobicContact CB-CG2 4.16Å; L28-V114 HydrophobicContact CB-CG2 4.12Å; L28-V114 HydrophobicContact CD2-CG2 4.31Å; V29-V114 HydrophobicContact CG2-CB 4.46Å; V29-V114 HydrophobicContact CG2-CG2 3.85Å; R67-V114 HydrophobicContact CG-CG1 4.41Å; Y71-V114 HydrophobicContact CE1-CG2 4.39Å; G112-V114 VanDerWaalsContact C-N 3.3Å; G112-V114 PolarHBondContact O-N 2.89Å; V114-S116 VanDerWaalsContact C-N 3.28Å; V114-S116 PolarHBondContact O-N 3.49Å; V114-A117 PolarHBondContact O-N 3.36Å; V114-L118 WeakPolarHBondContact O-CB 3.28Å; V114-L118 PolarHBondContact O-N 3.34Å
115A94.9Very high92.3Very high2 Ų252.2 Ų52.22%0.01731%0.308CS..Hα-helixtrans-61.3-38177.500000112.2P106 L110 G112 L118 R119P106-A115 HydrophobicContact CB-CB 3.82Å; P106-A115 HydrophobicContact CG-CB 4.48Å; L110-A115 HydrophobicContact CD2-CB 3.92Å; L110-A115 HydrophobicContact CG-CB 4.05Å; G112-A115 PolarHBondContact O-N 2.86Å; A115-L118 PolarHBondContact O-N 3.14Å; A115-R119 WeakPolarHBondContact O-CG 3.33Å; A115-R119 PolarHBondContact O-N 2.78Å
116S94.3Very high92.1Very high54 Ų5453.2 Ų53.238%0.37831%0.314SS..Hα-helixtrans-70.4-46.2179.7-53.10000111.9G112 P113 V114 L118 R119 E120G112-S116 WeakPolarHBondContact O-CB 3.44Å; G112-S116 PolarHBondContact O-N 3.14Å; G112-S116 PolarHBondContact O-OG 2.71Å; P113-S116 PolarHBondContact O-N 2.78Å; V114-S116 VanDerWaalsContact C-N 3.28Å; V114-S116 PolarHBondContact O-N 3.49Å; S116-L118 VanDerWaalsContact C-N 3.28Å; S116-L118 PolarHBondContact O-N 2.97Å; S116-R119 PolarHBondContact O-N 2.94Å; S116-R119 PolarHBondContact OG-NH2 3.27Å; S116-R119 VanDerWaalsContact OG-NH2 3.11Å; S116-E120 PolarHBondContact O-N 2.83Å
117A93.9Very high92Very high31 Ų3154.9 Ų54.926%0.25632%0.319SS..Hα-helixtrans-61.5-37.4174.200000112.1V29 P113 V114 E120 K121V29-A117 HydrophobicContact CG1-CB 4.07Å; V29-A117 HydrophobicContact CG2-CB 4.36Å; P113-A117 WeakPolarHBondContact O-CB 3.46Å; P113-A117 PolarHBondContact O-N 3.46Å; V114-A117 PolarHBondContact O-N 3.36Å; A117-E120 PolarHBondContact O-N 3.3Å; A117-K121 WeakPolarHBondContact O-CG 3.34Å; A117-K121 PolarHBondContact O-N 2.93Å; A117-K121 VanDerWaalsContact O-N 3.12Å
118L95.3Very high92.1Very high3 Ų351.8 Ų51.82%0.01630%0.299CS..Hα-helixtrans-67.3-43.4175.7-178.861.5000111.9T66 L68 V69 I104 V114 A115 S116 E120 K121 L122T66-L118 HydrophobicContact CG2-CD1 4.34Å; L68-L118 HydrophobicContact CD2-CD1 4.09Å; L68-L118 HydrophobicContact CD2-CD2 4.25Å; V69-L118 HydrophobicContact CG2-CD2 3.81Å; I104-L118 WeakPolarHBondContact O-CD2 3.44Å; V114-L118 WeakPolarHBondContact O-CB 3.28Å; V114-L118 PolarHBondContact O-N 3.34Å; A115-L118 PolarHBondContact O-N 3.14Å; S116-L118 VanDerWaalsContact C-N 3.28Å; S116-L118 PolarHBondContact O-N 2.97Å; L118-E120 VanDerWaalsContact C-N 3.3Å; L118-E120 PolarHBondContact O-N 2.81Å; L118-K121 PolarHBondContact O-N 2.98Å; L118-L122 HydrophobicContact CD1-CD1 4.15Å; L118-L122 HydrophobicContact CD1-CG 4.08Å; L118-L122 HydrophobicContact CD2-CD1 4.45Å; L118-L122 HydrophobicContact CG-CD1 3.85Å; L118-L122 HydrophobicContact CG-CG 4.23Å; L118-L122 WeakPolarHBondContact O-CB 3.01Å; L118-L122 VanDerWaalsContact O-CG 3.29Å; L118-L122 WeakPolarHBondContact O-CG 3.35Å; L118-L122 PolarHBondContact O-N 3.42Å
119R94.3Very high92.2Very high61 Ų6146.9 Ų46.923%0.2327%0.265CS..Hα-helixtrans-58.6-42.7174.9-78.3-177.9-73.1-103-0.3111.9P106 P107 L110 A115 S116 K121 L122 A123 L132P106-R119 HydrophobicContact CG-CG 3.43Å; P106-R119 VanDerWaalsContact CG-CG 3.43Å; P107-R119 PolarHBondContact O-NH1 3.19Å; L110-R119 PolarHBondContact O-NH1 3.44Å; L110-R119 PolarHBondContact O-NH2 3.1Å; A115-R119 WeakPolarHBondContact O-CG 3.33Å; A115-R119 PolarHBondContact O-N 2.78Å; S116-R119 PolarHBondContact O-N 2.94Å; S116-R119 PolarHBondContact OG-NH2 3.27Å; S116-R119 VanDerWaalsContact OG-NH2 3.11Å; R119-K121 VanDerWaalsContact C-N 3.34Å; R119-K121 PolarHBondContact O-N 3.06Å; R119-L122 PolarHBondContact O-N 2.93Å; R119-A123 WeakPolarHBondContact O-CB 3.49Å; R119-A123 PolarHBondContact O-N 3.31Å; R119-L132 HydrophobicContact CG-CD2 4.22Å
120E93.6Very high92Very high145 Ų14543.3 Ų43.368%0.67826%0.255SS*.Hα-helixtrans-60.1-45.1177-173.3-178.6176.800111.4S116 A117 L118 A123S116-E120 PolarHBondContact O-N 2.83Å; A117-E120 PolarHBondContact O-N 3.3Å; L118-E120 VanDerWaalsContact C-N 3.3Å; L118-E120 PolarHBondContact O-N 2.81Å; E120-A123 PolarHBondContact O-N 3.38Å
121K93.5Very high91.6Very high80 Ų8041.1 Ų41.135%0.34825%0.248SC..Hα-helixtrans-64.8-46.2175-70.1-70.1178.2-179.30112.4E64 W76 A117 L118 R119 A123 T124E64-K121 IonicContact OE1-NZ 2.64Å; E64-K121 PolarHBondContact OE1-NZ 3.22Å; W76-K121 HydrophobicContact CH2-CB 4.34Å; W76-K121 WeakPolarHBondContact CH2-O 3.46Å; W76-K121 WeakPolarHBondContact CZ2-O 3.31Å; W76-K121 HydrophobicContact CZ3-CB 4.41Å; A117-K121 WeakPolarHBondContact O-CG 3.34Å; A117-K121 PolarHBondContact O-N 2.93Å; A117-K121 VanDerWaalsContact O-N 3.12Å; L118-K121 PolarHBondContact O-N 2.98Å; R119-K121 VanDerWaalsContact C-N 3.34Å; R119-K121 PolarHBondContact O-N 3.06Å; K121-A123 VanDerWaalsContact C-N 3.26Å; K121-A123 PolarHBondContact O-N 3.46Å; K121-T124 WeakPolarHBondContact O-CB 3.36Å; K121-T124 WeakPolarHBondContact O-CG2 3.49Å; K121-T124 PolarHBondContact O-N 3.25Å; K121-T124 VanDerWaalsContact O-N 3.1Å; K121-T124 PolarHBondContact O-OG1 3.35Å
122L93.9Very high91.5Very high0 Ų038.9 Ų38.90%022%0.223CC..Hα-helixtrans-63.1-31.9177.9-71.5175.2000112.2W76 I104 F105 L118 R119 T124 V125 W127 A128 L132W76-L122 HydrophobicContact CH2-CD2 4.17Å; W76-L122 HydrophobicContact CZ3-CD2 4.21Å; I104-L122 HydrophobicContact CG2-CD1 4.36Å; I104-L122 HydrophobicContact CG2-CD2 4.26Å; F105-L122 HydrophobicContact CD1-CD1 4.01Å; F105-L122 HydrophobicContact CE1-CD1 4.26Å; L118-L122 HydrophobicContact CD1-CD1 4.15Å; L118-L122 HydrophobicContact CD1-CG 4.08Å; L118-L122 HydrophobicContact CD2-CD1 4.45Å; L118-L122 HydrophobicContact CG-CD1 3.85Å; L118-L122 HydrophobicContact CG-CG 4.23Å; L118-L122 WeakPolarHBondContact O-CB 3.01Å; L118-L122 VanDerWaalsContact O-CG 3.29Å; L118-L122 WeakPolarHBondContact O-CG 3.35Å; L118-L122 PolarHBondContact O-N 3.42Å; R119-L122 PolarHBondContact O-N 2.93Å; L122-T124 PolarHBondContact O-N 3.37Å; L122-T124 VanDerWaalsContact O-N 3.08Å; L122-V125 WeakPolarHBondContact O-CG2 3.46Å; L122-V125 PolarHBondContact O-N 3.13Å; L122-W127 HydrophobicContact CD2-CH2 3.76Å; L122-W127 HydrophobicContact CD2-CZ2 4.16Å; L122-A128 HydrophobicContact CB-CB 3.87Å; L122-A128 HydrophobicContact CD2-CB 3.78Å; L122-A128 HydrophobicContact CG-CB 4.36Å; L122-A128 WeakPolarHBondContact O-CB 3.47Å; L122-L132 HydrophobicContact CB-CD1 3.75Å
123A92.8Very high91Very high23 Ų2341.7 Ų41.719%0.1925%0.252CS..THydrogen-bonded Turntrans-64.2-13.6175.800000113.6R119 E120 K121 R129 L132 L134R119-A123 WeakPolarHBondContact O-CB 3.49Å; R119-A123 PolarHBondContact O-N 3.31Å; E120-A123 PolarHBondContact O-N 3.38Å; K121-A123 VanDerWaalsContact C-N 3.26Å; K121-A123 PolarHBondContact O-N 3.46Å; A123-R129 VanDerWaalsContact O-CD 3.27Å; A123-R129 WeakPolarHBondContact O-CD 3.23Å; A123-R129 VanDerWaalsContact O-CG 3.32Å; A123-R129 WeakPolarHBondContact O-CG 3.47Å; A123-R129 PolarHBondContact O-NH1 3.31Å; A123-L132 HydrophobicContact CB-CD1 4.49Å; A123-L134 HydrophobicContact CB-CD1 3.77Å
124T92.1Very high90.5Very high82 Ų8243.4 Ų43.450%0.50326%0.259SS..THydrogen-bonded Turntrans-79.3-15.8178.368.10000114.2K121 L122K121-T124 WeakPolarHBondContact O-CB 3.36Å; K121-T124 WeakPolarHBondContact O-CG2 3.49Å; K121-T124 PolarHBondContact O-N 3.25Å; K121-T124 VanDerWaalsContact O-N 3.1Å; K121-T124 PolarHBondContact O-OG1 3.35Å; L122-T124 PolarHBondContact O-N 3.37Å; L122-T124 VanDerWaalsContact O-N 3.08Å
125V91.4Very high89.8Confident24 Ų2447.8 Ų47.815%0.14529%0.287CS..SBendtrans-123135.3-172.2-68.70000112.4W76 L122 W127 A128 R129W76-V125 HydrophobicContact CH2-CG1 4.47Å; W76-V125 HydrophobicContact CH2-CG2 3.93Å; W76-V125 HydrophobicContact CZ2-CG1 3.74Å; W76-V125 HydrophobicContact CZ2-CG2 4.02Å; L122-V125 WeakPolarHBondContact O-CG2 3.46Å; L122-V125 PolarHBondContact O-N 3.13Å; V125-W127 HydrophobicContact CG2-CD2 4.32Å; V125-W127 HydrophobicContact CG2-CG 4.44Å; V125-W127 HydrophobicContact CG2-CZ2 4.04Å; V125-W127 VanDerWaalsContact CG2-NE1 3.32Å; V125-W127 PolarHBondContact O-N 2.97Å; V125-A128 HydrophobicContact CG2-CB 3.65Å; V125-A128 PolarHBondContact O-N 3.22Å; V125-A128 VanDerWaalsContact O-N 3.09Å; V125-R129 VanDerWaalsContact O-CG 3.32Å; V125-R129 WeakPolarHBondContact O-CG 3.44Å; V125-R129 PolarHBondContact O-N 2.97Å
126N89.4Confident89.2Confident41 Ų4153 Ų5322%0.21931%0.314CS..Hα-helixtrans-59.6-42-171.7-78.8-31.5000113.9A128 R129 A130 L136 I137 E139N126-A128 PolarHBondContact O-N 3.47Å; N126-R129 PolarHBondContact O-N 2.92Å; N126-A130 PolarHBondContact O-N 2.87Å; N126-L136 HydrophobicContact CB-CD2 4.36Å; N126-I137 PolarHBondContact OD1-N 3.43Å; N126-E139 PolarHBondContact ND2-OE1 2.79Å; N126-E139 VanDerWaalsContact ND2-OE1 3.09Å
127W89.6Confident88.6Confident43 Ų4354.1 Ų54.116%0.16332%0.315CS..Hα-helixtrans-59.5-33.4178.269.1-98.5000112.6N80 A83 Y95 F105 L122 V125N80-W127 PolarHBondContact OD1-NE1 2.85Å; A83-W127 HydrophobicContact CB-CD2 3.52Å; A83-W127 HydrophobicContact CB-CE3 3.77Å; A83-W127 HydrophobicContact CB-CG 4.16Å; A83-W127 HydrophobicContact CB-CH2 3.78Å; A83-W127 HydrophobicContact CB-CZ2 3.52Å; A83-W127 HydrophobicContact CB-CZ3 3.89Å; Y95-W127 AromaticContact CD1-CE3 3.63Å; Y95-W127 HydrophobicContact CD1-CE3 3.63Å; Y95-W127 HydrophobicContact CD1-CH2 4.43Å; Y95-W127 AromaticContact CD1-CZ3 3.47Å; Y95-W127 HydrophobicContact CD1-CZ3 3.47Å; Y95-W127 VanDerWaalsContact CD1-CZ3 3.47Å; Y95-W127 HydrophobicContact CE1-CD2 4.18Å; Y95-W127 AromaticContact CE1-CE3 3.35Å; Y95-W127 HydrophobicContact CE1-CE3 3.35Å; Y95-W127 AromaticContact CE1-CZ3 3.74Å; Y95-W127 HydrophobicContact CE1-CZ3 3.74Å; Y95-W127 HydrophobicContact CE2-CE3 4.37Å; Y95-W127 HydrophobicContact CG-CE3 4.26Å; Y95-W127 AromaticContact CG-CZ3 3.93Å; Y95-W127 HydrophobicContact CG-CZ3 3.93Å; Y95-W127 AromaticContact CZ-CE3 3.74Å; F105-W127 HydrophobicContact CE2-CZ3 4.36Å; F105-W127 HydrophobicContact CZ-CE3 4.24Å; F105-W127 AromaticContact CZ-CZ3 3.83Å; F105-W127 HydrophobicContact CZ-CZ3 3.83Å; L122-W127 HydrophobicContact CD2-CH2 3.76Å; L122-W127 HydrophobicContact CD2-CZ2 4.16Å; V125-W127 HydrophobicContact CG2-CD2 4.32Å; V125-W127 HydrophobicContact CG2-CG 4.44Å; V125-W127 HydrophobicContact CG2-CZ2 4.04Å; V125-W127 VanDerWaalsContact CG2-NE1 3.32Å; V125-W127 PolarHBondContact O-N 2.97Å
128A91.3Very high87.5Confident0 Ų059.6 Ų59.60%034%0.34CS..Hα-helixtrans-89.7-28.2-179.400000112.8F105 L122 V125 N126 A130 G131 L132F105-A128 HydrophobicContact CE1-CB 3.84Å; F105-A128 WeakPolarHBondContact CE1-O 3.48Å; F105-A128 HydrophobicContact CZ-CB 4.09Å; L122-A128 HydrophobicContact CB-CB 3.87Å; L122-A128 HydrophobicContact CD2-CB 3.78Å; L122-A128 HydrophobicContact CG-CB 4.36Å; L122-A128 WeakPolarHBondContact O-CB 3.47Å; V125-A128 HydrophobicContact CG2-CB 3.65Å; V125-A128 PolarHBondContact O-N 3.22Å; V125-A128 VanDerWaalsContact O-N 3.09Å; N126-A128 PolarHBondContact O-N 3.47Å; A128-A130 VanDerWaalsContact C-N 3.31Å; A128-A130 PolarHBondContact O-N 2.66Å; A128-G131 CarbonylContact O-C 3.49Å; A128-G131 WeakPolarHBondContact O-CA 3.47Å; A128-G131 PolarHBondContact O-N 2.97Å; A128-L132 WeakPolarHBondContact O-CG 3.5Å; A128-L132 PolarHBondContact O-N 2.83Å
129R89.9Confident85.9Confident41 Ų4166.5 Ų66.516%0.15537%0.373CS..Hα-helixtrans-59.2-42.9173.7-71.5177.574.189.7-4112A123 V125 N126 G131 L132 G133 L134 P135 L136A123-R129 VanDerWaalsContact O-CD 3.27Å; A123-R129 WeakPolarHBondContact O-CD 3.23Å; A123-R129 VanDerWaalsContact O-CG 3.32Å; A123-R129 WeakPolarHBondContact O-CG 3.47Å; A123-R129 PolarHBondContact O-NH1 3.31Å; V125-R129 VanDerWaalsContact O-CG 3.32Å; V125-R129 WeakPolarHBondContact O-CG 3.44Å; V125-R129 PolarHBondContact O-N 2.97Å; N126-R129 PolarHBondContact O-N 2.92Å; R129-G131 VanDerWaalsContact C-N 3.26Å; R129-G131 PolarHBondContact O-N 2.96Å; R129-L132 CarbonylContact O-C 3.59Å; R129-L132 PolarHBondContact O-N 2.83Å; R129-L132 VanDerWaalsContact O-N 3.11Å; R129-G133 PolarHBondContact O-N 2.93Å; R129-G133 VanDerWaalsContact O-N 3.08Å; R129-L134 HydrophobicContact CB-CB 4.14Å; R129-L134 HydrophobicContact CG-CB 4.42Å; R129-L134 PolarHBondContact O-N 3.18Å; R129-P135 PolarHBondContact NE-O 3.45Å; R129-P135 PolarHBondContact NH2-O 3.12Å; R129-L136 HydrophobicContact CB-CD2 4.49Å
130A83.6Confident83.7Confident66 Ų6670.3 Ų70.355%0.54540%0.402SS..Hα-helixtrans-56.3-42.1172.500000111.7N126 A128 L132 G133 L136N126-A130 PolarHBondContact O-N 2.87Å; A128-A130 VanDerWaalsContact C-N 3.31Å; A128-A130 PolarHBondContact O-N 2.66Å; A130-L132 VanDerWaalsContact C-N 3.34Å; A130-L132 PolarHBondContact O-N 3.27Å; A130-G133 PolarHBondContact O-N 2.89Å; A130-L136 HydrophobicContact CB-CD2 4.36Å
131G82.3Confident81.3Confident21 Ų2168.6 Ų68.622%0.21640%0.401CS..Hα-helixtrans-75-18.717800000115.8A128 R129A128-G131 CarbonylContact O-C 3.49Å; A128-G131 WeakPolarHBondContact O-CA 3.47Å; A128-G131 PolarHBondContact O-N 2.97Å; R129-G131 VanDerWaalsContact C-N 3.26Å; R129-G131 PolarHBondContact O-N 2.96Å
132L84.5Confident78.7Confident47 Ų4769.9 Ų69.925%0.24642%0.42CS..Hα-helixtrans-91.8-2.9172.4-67.8175.2000113.3F105 R119 L122 A123 A128 R129 A130 L134F105-L132 HydrophobicContact CD1-CD2 3.85Å; F105-L132 HydrophobicContact CD1-CG 4.06Å; F105-L132 HydrophobicContact CE1-CD2 4.45Å; F105-L132 HydrophobicContact CE1-CG 4.15Å; R119-L132 HydrophobicContact CG-CD2 4.22Å; L122-L132 HydrophobicContact CB-CD1 3.75Å; A123-L132 HydrophobicContact CB-CD1 4.49Å; A128-L132 WeakPolarHBondContact O-CG 3.5Å; A128-L132 PolarHBondContact O-N 2.83Å; R129-L132 CarbonylContact O-C 3.59Å; R129-L132 PolarHBondContact O-N 2.83Å; R129-L132 VanDerWaalsContact O-N 3.11Å; A130-L132 VanDerWaalsContact C-N 3.34Å; A130-L132 PolarHBondContact O-N 3.27Å; L132-L134 VanDerWaalsContact C-N 3.27Å; L132-L134 HydrophobicContact CB-CD1 4.02Å; L132-L134 HydrophobicContact CB-CG 4.08Å; L132-L134 HydrophobicContact CD1-CD1 4.13Å; L132-L134 PolarHBondContact O-N 2.86Å
133G81.4Confident76.2Confident69 Ų6975.4 Ų75.471%0.71146%0.456SS*.THydrogen-bonded Turntrans69.324-174.700000113.7R129 A130R129-G133 PolarHBondContact O-N 2.93Å; R129-G133 VanDerWaalsContact O-N 3.08Å; A130-G133 PolarHBondContact O-N 2.89Å
134L83.9Confident73.9Confident71 Ų7182.3 Ų82.337%0.37249%0.485SS..PPolyproline II helixtrans-92.9148.1177-66.9171.7000110.4A123 R129 L132A123-L134 HydrophobicContact CB-CD1 3.77Å; R129-L134 HydrophobicContact CB-CB 4.14Å; R129-L134 HydrophobicContact CG-CB 4.42Å; R129-L134 PolarHBondContact O-N 3.18Å; L132-L134 VanDerWaalsContact C-N 3.27Å; L132-L134 HydrophobicContact CB-CD1 4.02Å; L132-L134 HydrophobicContact CB-CG 4.08Å; L132-L134 HydrophobicContact CD1-CD1 4.13Å; L132-L134 PolarHBondContact O-N 2.86Å
135P80.8Confident71.7Confident99 Ų9983.7 Ų83.764%0.64350%0.495SS*.PPolyproline II helixtrans-60.1141176.325.6-33.4000109.8R129R129-P135 PolarHBondContact NE-O 3.45Å; R129-P135 PolarHBondContact NH2-O 3.12Å
136L81.9Confident69.5Low111 Ų11190.4 Ų90.458%0.58153%0.525SS*.PPolyproline II helixtrans-61.7146.2175.5-62.8177.4000109.8N126 R129 A130 D138N126-L136 HydrophobicContact CB-CD2 4.36Å; R129-L136 HydrophobicContact CB-CD2 4.49Å; A130-L136 HydrophobicContact CB-CD2 4.36Å; L136-D138 PolarHBondContact O-N 3.21Å
137I80.2Confident67.3Low78 Ų7894.5 Ų94.540%0.455%0.553SS.*PPolyproline II helixtrans-78.7122.7171.4-63.5160.4000105.4N126 E139N126-I137 PolarHBondContact OD1-N 3.43Å; I137-E139 PolarHBondContact O-N 3.43Å
138D72.4Confident65Low147 Ų147100.1 Ų100.179%0.78659%0.586SS**  trans-58.1109167.5-73.9-31.4000107L136 V140L136-D138 PolarHBondContact O-N 3.21Å; D138-V140 VanDerWaalsContact C-N 3.32Å; D138-V140 PolarHBondContact O-N 3.31Å
139E60.7Low63Low148 Ų148106.1 Ų106.169%0.69262%0.618SS**  trans-63.3102.4169.1-75.1-179.2-174.500105.5N126 I137 V141N126-E139 PolarHBondContact ND2-OE1 2.79Å; N126-E139 VanDerWaalsContact ND2-OE1 3.09Å; I137-E139 PolarHBondContact O-N 3.43Å; E139-V141 PolarHBondContact O-N 3.18Å
140V47.8Very low60.9Low140 Ų140110.7 Ų110.785%0.84865%0.651SS**  trans-59.699.1168.9-178.80000105.3D138 S142D138-V140 VanDerWaalsContact C-N 3.32Å; D138-V140 PolarHBondContact O-N 3.31Å; V140-S142 PolarHBondContact O-N 3.22Å
141V43.5Very low59.3Low110 Ų110111.6 Ų111.667%0.66765%0.653SS**  trans-49.1106.9174.2173.90000106.7E139E139-V141 PolarHBondContact O-N 3.18Å
142S38.4Very low57.8Low106 Ų106118.3 Ų118.374%0.74168%0.684SS**  trans-53.1129.7155.1179.40000106V140 E144V140-S142 PolarHBondContact O-N 3.22Å; S142-E144 PolarHBondContact O-N 3.44Å
143P42.1Very low56Low117 Ų117124.9 Ų124.976%0.7671%0.711SS**  trans-59.8108.2-16523.3-32.2000109.9
144E43.6Very low54.5Low167 Ų167127.5 Ų127.578%0.7872%0.718SS**  trans-69.4136.3161.2-167.3171.7144.600107.1S142 E146S142-E144 PolarHBondContact O-N 3.44Å; E144-E146 PolarHBondContact O-N 3.08Å
145P47.7Very low52.9Low112 Ų112130.4 Ų130.473%0.72773%0.734SS**  trans-67121.3-17926.9-32.5000110.5
146E44.4Very low51.5Low165 Ų165137.1 Ų137.177%0.77175%0.747SS**  trans26.3108.4152.4-68.9-79.1129.800117E144 L148E144-E146 PolarHBondContact O-N 3.08Å; E146-L148 PolarHBondContact O-N 2.8Å; E146-L148 VanDerWaalsContact O-N 3.1Å
147P42.5Very low49.8Very low126 Ų126135.2 Ų135.282%0.81874%0.743SS**  trans-69109158.528.6-29.8000108.5N149P147-N149 PolarHBondContact O-N 3.48Å; P147-N149 VanDerWaalsContact O-N 3.12Å
148L41.3Very low48.1Very low162 Ų162137.6 Ų137.685%0.84877%0.766SS**  trans-51.6119.7169.9-88.3159.9000110.3E146 T150E146-L148 PolarHBondContact O-N 2.8Å; E146-L148 VanDerWaalsContact O-N 3.1Å; L148-T150 PolarHBondContact O-N 2.92Å
149N50.6Low46.5Very low126 Ų126140 Ų14067%0.67477%0.77SS**  trans-39.2116.6164.9-171.616000113.2P147 S151P147-N149 PolarHBondContact O-N 3.48Å; P147-N149 VanDerWaalsContact O-N 3.12Å; N149-S151 PolarHBondContact OD1-N 3.42Å; N149-S151 PolarHBondContact OD1-OG 2.83Å; N149-S151 VanDerWaalsContact OD1-OG 3.12Å
150T44.7Very low45.6Very low136 Ų136140.3 Ų140.383%0.83478%0.776SS**  trans-133.764.415460.80000109.2L148 D152L148-T150 PolarHBondContact O-N 2.92Å; T150-D152 PolarHBondContact O-N 2.91Å
151S51.1Low45.1Very low85 Ų85138.3 Ų138.359%0.59478%0.775SS**  trans-74.595.5153.960.20000108.1N149N149-S151 PolarHBondContact OD1-N 3.42Å; N149-S151 PolarHBondContact OD1-OG 2.83Å; N149-S151 VanDerWaalsContact OD1-OG 3.12Å
152D51Low44.9Very low162 Ų162138 Ų13887%0.86678%0.777SS**  trans-173.681.8155.8-92.8-21.8000109.8T150T150-D152 PolarHBondContact O-N 2.91Å
153F45.3Very low44.7Very low186 Ų186138.8 Ų138.882%0.81678%0.783SS**  trans-163.583.9145.8-154.6-101.9000109.9
154S50.1Low44.5Very low124 Ų124139.5 Ų139.587%0.86779%0.786SS**  trans-121.888.6161-71.90000107.3
155D50.1Low44.8Very low132 Ų132137.6 Ų137.671%0.70679%0.787SS**  trans-170.1102.6151.2-123.6-16000112
156W52.1Low44Very low240 Ų240135.5 Ų135.591%0.90979%0.787SS**  trans-159.581140.6-156.1-89.3000110.3
157S46.5Very low44.2Very low71 Ų71133.4 Ų133.450%0.49779%0.787SS.*  trans43.9105.1139.556.80000119.8
158S44Very low43.9Very low127 Ų127136 Ų13689%0.88879%0.788SS**  trans-58.2124.1144.5-47.50000110.5
159F39Very low43.5Very low198 Ų198137 Ų13787%0.86879%0.789SS**  trans-102.5111.1165.349.4-87.3000108.7
160N42.7Very low42.7Very low154 Ų154136.5 Ų136.582%0.82479%0.79SS**  trans-101.5122.2168.8-153.521.3000106.7
161A36.6Very low42.1Very low98 Ų98136.3 Ų136.381%0.8178%0.784SS**  trans-126.3112.9170.200000108.3
162S39Very low41.4Very low104 Ų104137.3 Ų137.373%0.72779%0.791SS**  trans-118.4121.5167.6-63.10000108
163S35.2Very low40.6Very low123 Ų123134 Ų13486%0.8679%0.786SS**  trans179116.2140.449.20000112
164T37.6Very low40.2Very low132 Ų132131 Ų13181%0.8179%0.788SS**  trans-60.1-179.2162.4-22.40000110.7
165P48.2Very low39.5Very low126 Ų126129.4 Ų129.482%0.81878%0.783SS**  cis-148.3172.218.640.7-17.8000120
166G31.4Very low39.2Very low69 Ų69127.8 Ų127.871%0.71179%0.787SS**  trans157.2143155.100000114.9
167P48.9Very low39.1Very low121 Ų121122.4 Ų122.479%0.78678%0.783SS**  trans-119.5168-13939.6-26.2000115.8
168E35.5Very low38.8Very low180 Ų180123 Ų12384%0.84179%0.793SS**  trans176.6108.1149.3-95.4159.3-16400107.5
169E33.3Very low38.3Very low183 Ų183126.1 Ų126.186%0.85579%0.791SS**  64.8127.989.1-85.6-162.7159.800112.6
170V34.9Very low38.3Very low115 Ų115126.5 Ų126.570%0.69779%0.788SS**  cis-164158.816-163.20000109.5
171D32.5Very low37.8Very low133 Ų133124.1 Ų124.171%0.71178%0.783SS**  trans72.2118.3152-86.8-32.1000121.6
172S35Very low37.8Very low106 Ų106128.5 Ų128.574%0.74179%0.787SS**  62.1135.672.3-50.90000112.6
173A34.7Very low38Very low92 Ų92128.1 Ų128.176%0.7679%0.79SS**  cis-165.2157.2-0.200000108.4
174S36.8Very low38.6Very low122 Ų122128.5 Ų128.585%0.85379%0.789SS**  trans26.6124.7142.5-145.10000121.1
175A36.4Very low38.8Very low92 Ų92133.5 Ų133.576%0.7679%0.794SS**  177.4126.3123.500000112
176A43.3Very low38.8Very low98 Ų98133 Ų13381%0.8179%0.791SS**  trans-74.1153.9152.100000109.3
177P49.1Very low39.9Very low126 Ų126135.8 Ų135.882%0.81880%0.796SS**  -144.6160.6105.133.7-16.9000114.8
178A40.3Very low39.2Very low85 Ų85134.8 Ų134.870%0.70280%0.798SS**  trans-74.3148.7164.100000111.1
179F34.8Very low39.4Very low192 Ų192131.6 Ų131.684%0.84280%0.795SS**  175126.4128.5-105.1-82000111.5
180Y37.8Very low40.1Very low206 Ų206129.4 Ų129.481%0.80880%0.797SS**  trans24125.3150.5-84.4-100.8000121.9
181S32.7Very low39.9Very low104 Ų104127.4 Ų127.473%0.72780%0.799SS**  -175.6121114.9-82.80000115.2
182Q37.3Very low40.1Very low190 Ų190130.5 Ų130.589%0.88880%0.801SS**  trans66.3133133.8-62.5-178.4900123.5
183A42.3Very low40.5Very low96 Ų96130.9 Ų130.979%0.79380%0.801SS**PPolyproline II helixtrans-81.9158.9179.300000114.1
184P46.8Very low40.6Very low130 Ų130132.1 Ų132.184%0.84479%0.791SS**PPolyproline II helixtrans-100.6132.3158.9-6.626.6000113.5
185R41.9Very low40.6Very low238 Ų238135.5 Ų135.590%0.89879%0.793SS**PPolyproline II helixtrans-90.1150.1170.2-165-172.4-144.1-173.46.6109.7
186P49.6Very low40.5Very low116 Ų116138.9 Ų138.975%0.75379%0.793SS**  trans-121.2160.2144.6615.3000113.4
187P53.7Low40.2Very low126 Ų126140.4 Ų140.482%0.81879%0.793SS**PPolyproline II helixtrans-94.8173.3-15437.2-35.8000116.1
188A34.3Very low39.5Very low100 Ų100140.6 Ų140.683%0.82679%0.791SS**PPolyproline II helixtrans-83.9162.7-17800000115
189S40.5Very low39.6Very low114 Ų114144.2 Ų144.280%0.79780%0.797SS**PPolyproline II helixtrans-52.2168.2178.3-35.80000116.5
190P47.2Very low39.4Very low136 Ų136143 Ų14388%0.88379%0.794SS**  -147.3173.786.234.6-14.8000112.1
191G30.9Very low39.2Very low73 Ų73141.5 Ų141.575%0.75380%0.796SS**  cis169.8149.58.800000107.6
192R37.3Very low39.2Very low199 Ų199139.8 Ų139.875%0.75180%0.795SS**  trans-66160170.9-150.4-173.4143.1160.3-11.6110.1E194R192-E194 IonicContact CZ-OE1 3.7Å; R192-E194 IonicContact NH2-OE1 2.8Å; R192-E194 PolarHBondContact NH2-OE1 3.19Å
193P43.5Very low39.3Very low113 Ų113137.1 Ų137.173%0.73479%0.787SS**  -140.1138.580.419.24.9000113.4
194E35.5Very low39.2Very low118 Ų118138.3 Ų138.355%0.55179%0.787SS**  55.5119.2108.4-57.3-158.4143.700117.2R192R192-E194 IonicContact CZ-OE1 3.7Å; R192-E194 IonicContact NH2-OE1 2.8Å; R192-E194 PolarHBondContact NH2-OE1 3.19Å
195Q37.6Very low38.9Very low193 Ų193139.6 Ų139.690%0.90278%0.781SS**  trans-164.9134.5130.9-103.8160.636.300112.3
196H34.1Very low39.2Very low163 Ų163132.7 Ų132.776%0.75577%0.767SS**  trans-76.7146.5177.3-61.9-121.7000109.3
197T37.1Very low38.5Very low131 Ų131135.2 Ų135.280%0.80477%0.774SS**  trans-146.9104.2156.1-21.90000111
198V34.4Very low37.5Very low130 Ų130133.8 Ų133.879%0.78876%0.763SS**  trans-65.9128.2157.9171.50000107.2
199I42.5Very low37.5Very low160 Ų160137.7 Ų137.782%0.82176%0.763SS**  trans-113.3131.4158.7-61.6-175.5000108.7
200H30Very low37.2Very low167 Ų167136.8 Ų136.877%0.77376%0.763SS**  trans-79.7155.8-164.7-174.1-85.6000113
201M35.2Very low36.9Very low174 Ų174136 Ų13686%0.85776%0.758SS**  trans-41.8140.5166.2-130.786172.600113.4
202G32.7Very low37.3Very low69 Ų69144.3 Ų144.371%0.71177%0.766SS**  trans-170.982.716900000112.3
203N38.9Very low37.2Very low134 Ų134143.5 Ų143.572%0.71777%0.768SS**  trans-69.6138.4159-177.534.7000108.9E205N203-E205 PolarHBondContact OD1-N 3.3Å
204P40.6Very low36.9Very low121 Ų121144.5 Ų144.579%0.78677%0.772SS**  trans-126.2121.6132.624.7-9.5000111.4
205E39.6Very low36.9Very low156 Ų156148.1 Ų148.173%0.72978%0.782SS**  trans-63.7-175.9166.3-109.4-14914000111.8N203N203-E205 PolarHBondContact OD1-N 3.3Å
206P48.5Very low36.9Very low93 Ų93144.8 Ų144.860%0.60477%0.771SS**  -135.6147.8-75.135.1-14.1000112.5
207L33.6Very low37.1Very low169 Ų169143 Ų14389%0.88577%0.771SS**  trans-153.3140167.8-73174.6000109.1
208T33.5Very low37.4Very low97 Ų97146.2 Ų146.260%0.59577%0.769SS**  cis-173.9159.7-17.6200000105
209H34.9Very low37.5Very low181 Ų181145.1 Ų145.184%0.83876%0.758SS**  trans82128168.3-50.1-76.7000117.1
210A34.2Very low37.2Very low95 Ų95144.6 Ų144.679%0.78576%0.757SS**  cis-155.8160.628.500000112.9
211P41.1Very low37.6Very low119 Ų119143.1 Ų143.177%0.77376%0.755SS**  trans-99.3141.9-168.336.6-29.5000113.3
212R38.3Very low37.6Very low248 Ų248145.3 Ų145.394%0.93675%0.754SS**  trans-141.3108.4159.3-78.9-165.6167.6101.1-1.2112.8
213K35.7Very low38Very low183 Ų183148 Ų14880%0.79676%0.756SS**  trans46.8101.1149-73.6-174.2173.2-176.20119.3
214V36.4Very low38.1Very low133 Ų133148.1 Ų148.181%0.80677%0.765SS**  trans-70.4126.8147175.20000108.3D216V214-D216 HydrophobicContact CG1-CB 4.32Å
215Y36.6Very low38Very low194 Ų194145.4 Ų145.476%0.76176%0.758SS**  trans-108.2108.6152.7-103.1-88.3000106.6
216D37.2Very low38.3Very low124 Ų124146.6 Ų146.666%0.66377%0.769SS**  trans-90.8126.7161.9-177.47.2000106.7V214V214-D216 HydrophobicContact CG1-CB 4.32Å
217T38.4Very low38.4Very low126 Ų126150.6 Ų150.677%0.77378%0.779SS**  trans-138.1102163.340.70000107.3
218R43.4Very low39.1Very low197 Ų197145.5 Ų145.574%0.74377%0.768SS**  trans-64.5143.5161.7-97.9179.274123.87.1111.6
219D36.9Very low39.5Very low107 Ų107146 Ų14657%0.57277%0.766SS**  trans63.2115.8147.7-54.3-34.4000118.2
220D35.5Very low40.5Very low149 Ų149142.9 Ų142.980%0.79776%0.764SS**  -177.4149.981-118-55.8000114.2
221D37.8Very low41.5Very low136 Ų136144.2 Ų144.273%0.72776%0.758SS**  trans69.8116154.9-124.7-76.5000122.7
222R35.5Very low41.9Very low220 Ų220144.8 Ų144.883%0.8375%0.754SS**  129.5117.7127.4-131.8170.4-175.6163.31.9116.6
223T42.5Very low42.9Very low125 Ų125138.7 Ų138.777%0.76774%0.74SS**  trans90.7114.116162.50000119.7G225T223-G225 PolarHBondContact O-N 2.81Å; T223-G225 VanDerWaalsContact O-N 3.11Å
224P40Very low44.1Very low138 Ų138137.4 Ų137.490%0.89674%0.735SS**  trans-79.990.7166.931.5-28000109.2
225G37.6Very low45Very low63 Ų63140.7 Ų140.765%0.64973%0.734SS**  trans-76.3121.4160.500000108.8T223 H227T223-G225 PolarHBondContact O-N 2.81Å; T223-G225 VanDerWaalsContact O-N 3.11Å; G225-H227 PolarHBondContact O-N 3.11Å
226L47.3Very low45.6Very low181 Ų181141 Ų14195%0.94873%0.734SS**  trans-55.882.6170.3-82.7146.7000110.8G228L226-G228 PolarHBondContact O-N 3.33Å
227H49.2Very low46.6Very low178 Ų178146.4 Ų146.482%0.82475%0.745SS**  trans-84.479.4159.2-162.692.8000106.5G225 D229G225-H227 PolarHBondContact O-N 3.11Å; H227-D229 PolarHBondContact O-N 3.11Å; H227-D229 VanDerWaalsContact O-N 3.14Å
228G48.8Very low47.5Very low62 Ų62151.5 Ų151.564%0.63975%0.75SS**  trans-65.4108.7169.100000108.4L226 C230L226-G228 PolarHBondContact O-N 3.33Å; G228-C230 PolarHBondContact O-N 3.43Å
229D43.1Very low48.2Very low107 Ų107147.1 Ų147.157%0.57275%0.747SS**  trans-38.9112.6170.3-164.8-13.9000111.5H227 D231H227-D229 PolarHBondContact O-N 3.11Å; H227-D229 VanDerWaalsContact O-N 3.14Å; D229-D231 PolarHBondContact O-N 2.96Å; D229-D231 WeakPolarHBondContact OD1-CB 3.36Å; D229-D231 PolarHBondContact OD1-N 2.99Å
230C55Low49.3Very low116 Ų116147.1 Ų147.178%0.78476%0.762SS**THydrogen-bonded Turntrans-794.8-176.7-1630000112.2G228G228-C230 PolarHBondContact O-N 3.43Å
231D56.1Low50.4Low123 Ų123146.1 Ų146.166%0.65876%0.756SS**THydrogen-bonded Turntrans-94.9-12.5-179.6-14611.5000113.3D229 D233D229-D231 PolarHBondContact O-N 2.96Å; D229-D231 WeakPolarHBondContact OD1-CB 3.36Å; D229-D231 PolarHBondContact OD1-N 2.99Å; D231-D233 VanDerWaalsContact C-N 3.34Å; D231-D233 PolarHBondContact O-N 3.38Å
232D49.6Very low51.5Low131 Ų131141.3 Ų141.370%0.70174%0.738SS**G310 helixtrans-78.7-12.4179.3-103.2-26000114.3K234D232-K234 VanDerWaalsContact C-N 3.34Å; D232-K234 PolarHBondContact O-N 2.94Å
233D57.9Low52.9Low120 Ų120140 Ų14064%0.64273%0.733SS**G310 helixtrans-85.2-0.9-177.5-91.7-26.1000114.1D231D231-D233 VanDerWaalsContact C-N 3.34Å; D231-D233 PolarHBondContact O-N 3.38Å
234K61.3Low53.9Low156 Ų156138.2 Ų138.268%0.67872%0.719SS**G310 helixtrans-75.9-23.4-178.5-164.9173.5179.3-179.80114.1D232D232-K234 VanDerWaalsContact C-N 3.34Å; D232-K234 PolarHBondContact O-N 2.94Å
235Y55.9Low54.9Low201 Ų201134.6 Ų134.679%0.78870%0.701SS**SBendtrans-120.26.7-176.6-64.8-73.6000115.3R237Y235-R237 PolarHBondContact O-N 2.89Å; Y235-R237 VanDerWaalsContact O-N 3.1Å
236R49.8Very low56Low200 Ų200138.8 Ų138.876%0.75570%0.703SS**  trans-73.1111.4-178.5-149.3173.9-172.31664.8110.8R238R236-R238 PolarHBondContact O-N 3.43Å
237R56.8Low56.8Low238 Ų238134.5 Ų134.590%0.89868%0.681SS**PPolyproline II helixtrans-55.9127.6171.2-71.5-174.1-179.6-1481.2109.2Y235Y235-R237 PolarHBondContact O-N 2.89Å; Y235-R237 VanDerWaalsContact O-N 3.1Å
238R57.5Low57.4Low234 Ų234132.1 Ų132.188%0.88367%0.673SS**PPolyproline II helixtrans-52.1124.4-175.9-60.1178.7-178.5-104-0.7110.9R236 A240R236-R238 PolarHBondContact O-N 3.43Å; R238-A240 PolarHBondContact O-N 3.3Å
239P58.3Low57.7Low105 Ų105139 Ų13968%0.68268%0.68SS**PPolyproline II helixtrans-68.4126.4163.126.2-28.5000108.1L241 G242P239-L241 PolarHBondContact O-N 2.93Å; P239-G242 PolarHBondContact O-N 3.48Å
240A59.2Low58.1Low106 Ų106138.2 Ų138.288%0.87668%0.683SS**THydrogen-bonded Turntrans-63.75.8-17500000115R238R238-A240 PolarHBondContact O-N 3.3Å
241L60.1Low57.9Low129 Ų129143.8 Ų143.868%0.67569%0.687SS**THydrogen-bonded Turntrans-119.518-178.5-61.7172.6000113.4P239 W243 L244P239-L241 PolarHBondContact O-N 2.93Å; L241-W243 PolarHBondContact O-N 2.85Å; L241-L244 HydrophobicContact CD2-CD1 4.34Å; L241-L244 PolarHBondContact O-N 3.34Å
242G60.6Low57.6Low35 Ų35142.1 Ų142.136%0.36169%0.691SS.*Hα-helixtrans-61-26.117700000114.7P239 L244 A245 Q246P239-G242 PolarHBondContact O-N 3.48Å; G242-L244 PolarHBondContact O-N 2.97Å; G242-A245 PolarHBondContact O-N 3.32Å; G242-Q246 WeakPolarHBondContact O-CB 3.43Å; G242-Q246 PolarHBondContact O-N 2.95Å
243W65Low57.7Low192 Ų192139 Ų13973%0.72769%0.689SS**Hα-helixtrans-65-36.8176.5175.165.2000112.7L241 Q246 L247L241-W243 PolarHBondContact O-N 2.85Å; W243-Q246 PolarHBondContact O-N 3.42Å; W243-L247 WeakPolarHBondContact O-CB 3.46Å; W243-L247 PolarHBondContact O-N 3.07Å
244L61.8Low57.1Low88 Ų88137.6 Ų137.646%0.46169%0.689SS.*Hα-helixtrans-69.5-38.8177.8-89.1161.6000112L241 G242 Q246 L247 L248L241-L244 HydrophobicContact CD2-CD1 4.34Å; L241-L244 PolarHBondContact O-N 3.34Å; G242-L244 PolarHBondContact O-N 2.97Å; L244-Q246 VanDerWaalsContact C-N 3.3Å; L244-Q246 PolarHBondContact O-N 3.46Å; L244-L247 PolarHBondContact O-N 3.4Å; L244-L248 PolarHBondContact O-N 3.06Å
245A61.8Low56.5Low62 Ų62142 Ų14251%0.51270%0.701SS.*Hα-helixtrans-64.6-36.5173.200000111.7G242 R249G242-A245 PolarHBondContact O-N 3.32Å; A245-R249 VanDerWaalsContact O-CB 3.28Å; A245-R249 WeakPolarHBondContact O-CB 3.42Å; A245-R249 PolarHBondContact O-N 3.18Å
246Q61.3Low56.1Low151 Ų151140.9 Ų140.971%0.70670%0.701SS**Hα-helixtrans-71.5-34.4177-146.6140.8-52.100112.1G242 W243 L244 S250G242-Q246 WeakPolarHBondContact O-CB 3.43Å; G242-Q246 PolarHBondContact O-N 2.95Å; W243-Q246 PolarHBondContact O-N 3.42Å; L244-Q246 VanDerWaalsContact C-N 3.3Å; L244-Q246 PolarHBondContact O-N 3.46Å; Q246-S250 VanDerWaalsContact O-CB 3.32Å; Q246-S250 WeakPolarHBondContact O-CB 3.41Å; Q246-S250 PolarHBondContact O-N 3.25Å
247L63.9Low56.4Low90 Ų90142.1 Ų142.147%0.47171%0.706SS.*Hα-helixtrans-69-42.2174.9-157.481.8000111.7W243 L244 S250W243-L247 WeakPolarHBondContact O-CB 3.46Å; W243-L247 PolarHBondContact O-N 3.07Å; L244-L247 PolarHBondContact O-N 3.4Å; L247-S250 PolarHBondContact O-N 3.38Å; L247-S250 PolarHBondContact O-OG 3.09Å
248L62.1Low56.1Low128 Ų128135.8 Ų135.867%0.6770%0.695SS**Hα-helixtrans-69.5-35.2175.8-76.8157.1000112.1L244 R251L244-L248 PolarHBondContact O-N 3.06Å; L248-R251 PolarHBondContact O-N 2.91Å
249R54.5Low56.2Low207 Ų207128.7 Ų128.778%0.78168%0.675SS**Hα-helixtrans-74.2-28.3176-147.2168-150.7144.83112.9A245 R251 A252 G253A245-R249 VanDerWaalsContact O-CB 3.28Å; A245-R249 WeakPolarHBondContact O-CB 3.42Å; A245-R249 PolarHBondContact O-N 3.18Å; R249-R251 PolarHBondContact O-N 2.85Å; R249-A252 PolarHBondContact O-N 3.08Å; R249-G253 PolarHBondContact O-N 2.82Å
250S50.8Low56.8Low91 Ų91127.9 Ų127.964%0.63667%0.667SS**Hα-helixtrans-65.8-15.6173.776.10000113.7Q246 L247Q246-S250 VanDerWaalsContact O-CB 3.32Å; Q246-S250 WeakPolarHBondContact O-CB 3.41Å; Q246-S250 PolarHBondContact O-N 3.25Å; L247-S250 PolarHBondContact O-N 3.38Å; L247-S250 PolarHBondContact O-OG 3.09Å
251R51.2Low57.2Low232 Ų232129.8 Ų129.888%0.87566%0.662SS**Hα-helixtrans-101.6-13.6177.3-155.1167173.6170.8-3.4114.2L248 R249L248-R251 PolarHBondContact O-N 2.91Å; R249-R251 PolarHBondContact O-N 2.85Å
252A51.1Low57.8Low88 Ų88130.8 Ų130.873%0.72767%0.668SS**Hα-helixtrans-100.5-1.1178.900000114.2R249R249-A252 PolarHBondContact O-N 3.08Å
253G51.3Low58.6Low65 Ų65134.2 Ų134.267%0.6767%0.674SS**  trans-102.528.8-177.400000115.5R249 R255R249-G253 PolarHBondContact O-N 2.82Å; G253-R255 PolarHBondContact O-N 3.21Å
254S45.8Very low59.4Low92 Ų92131.2 Ų131.264%0.64366%0.663SS**  trans-81.394.7167.7-176.20000108.7K256S254-K256 PolarHBondContact O-N 2.69Å
255R48.4Very low60.5Low247 Ų247129.7 Ų129.793%0.93266%0.663SS**  trans-60.492.1156.6-105.3-178.2179.6174.70.4106.4G253 R257G253-R255 PolarHBondContact O-N 3.21Å; R255-R257 PolarHBondContact O-N 3.12Å; R255-R257 VanDerWaalsContact O-N 3.08Å
256K46.9Very low61.7Low179 Ų179128.7 Ų128.778%0.77866%0.659SS**  trans-54.8114.6175.9-63-174.8-179.4-178.60107.6S254S254-K256 PolarHBondContact O-N 2.69Å
257R55.1Low63.1Low226 Ų226126 Ų12685%0.85365%0.648SS**  trans-52.6133.2158.8-69.8177177.8178.7-2.2106.4R255 L259R255-R257 PolarHBondContact O-N 3.12Å; R255-R257 VanDerWaalsContact O-N 3.08Å; R257-L259 PolarHBondContact O-N 3Å
258P50.9Low64.4Low105 Ų105127.7 Ų127.768%0.68266%0.658SS**  trans-63.2106.6176.126.3-31.3000107.2T260P258-T260 PolarHBondContact O-N 2.81Å
259L59.3Low65.8Low85 Ų85127.8 Ų127.845%0.44566%0.658SS.*  trans-50.1127.6166.8-76.1137.8000106.9R257 Q263 R264R257-L259 PolarHBondContact O-N 3Å; L259-Q263 HydrophobicContact CB-CB 4.09Å; L259-Q263 HydrophobicContact CD2-CB 3.73Å; L259-Q263 HydrophobicContact CD2-CG 4.43Å; L259-R264 HydrophobicContact CB-CG 3.83Å; L259-R264 PolarHBondContact O-NE 2.95Å; L259-R264 VanDerWaalsContact O-NE 3.09Å
260T71.4Confident67.7Low87 Ų87122.6 Ų122.653%0.53465%0.645SS.*  trans-55.4148.6176.753.50000108.8P258 L262 Q263 R264P258-T260 PolarHBondContact O-N 2.81Å; T260-L262 PolarHBondContact O-N 3.46Å; T260-Q263 WeakPolarHBondContact O-CA 3.34Å; T260-Q263 WeakPolarHBondContact O-CB 3.41Å; T260-Q263 PolarHBondContact O-N 3.46Å; T260-Q263 WeakPolarHBondContact OG1-CG 3.49Å; T260-Q263 PolarHBondContact OG1-OE1 3.48Å; T260-R264 PolarHBondContact O-N 3.4Å
261L68.4Low69.8Low147 Ų147123.3 Ų123.377%0.7764%0.642SS**Hα-helixtrans-51.3-33-175.1-74.3171.8000112.7R264 A265L261-R264 PolarHBondContact O-N 3.33Å; L261-A265 WeakPolarHBondContact O-CB 3.47Å; L261-A265 PolarHBondContact O-N 3.36Å
262L73.4Confident71.9Confident150 Ų150114.5 Ų114.579%0.78562%0.622SS**Hα-helixtrans-62.8-41.2174.5-154.688.4000113.3T260 A265 G266T260-L262 PolarHBondContact O-N 3.46Å; L262-A265 PolarHBondContact O-N 2.79Å; L262-G266 PolarHBondContact O-N 3.42Å
263Q76.8Confident74Confident107 Ų107114.7 Ų114.750%0.561%0.611SS.*Hα-helixtrans-72.2-32.8178.4-71.2175.9-28.300112.1L259 T260 L267L259-Q263 HydrophobicContact CB-CB 4.09Å; L259-Q263 HydrophobicContact CD2-CB 3.73Å; L259-Q263 HydrophobicContact CD2-CG 4.43Å; T260-Q263 WeakPolarHBondContact O-CA 3.34Å; T260-Q263 WeakPolarHBondContact O-CB 3.41Å; T260-Q263 PolarHBondContact O-N 3.46Å; T260-Q263 WeakPolarHBondContact OG1-CG 3.49Å; T260-Q263 PolarHBondContact OG1-OE1 3.48Å; Q263-L267 WeakPolarHBondContact O-CB 3.49Å; Q263-L267 PolarHBondContact O-N 2.78Å
264R80.7Confident76.1Confident128 Ų128116.5 Ų116.548%0.48361%0.605SS.*Hα-helixtrans-69.8-42.1173.1-63.5-175.7-173.7-165.3-3.4111.4L259 T260 L261 L267 L268L259-R264 HydrophobicContact CB-CG 3.83Å; L259-R264 PolarHBondContact O-NE 2.95Å; L259-R264 VanDerWaalsContact O-NE 3.09Å; T260-R264 PolarHBondContact O-N 3.4Å; L261-R264 PolarHBondContact O-N 3.33Å; R264-L267 PolarHBondContact O-N 3.22Å; R264-L268 WeakPolarHBondContact O-CG 3.44Å; R264-L268 PolarHBondContact O-N 2.89Å
265A85.8Confident78.5Confident57 Ų57114.1 Ų114.147%0.47159%0.594SS.*Hα-helixtrans-61.7-45.1174.200000111.4L261 L262 L267 L268 L269L261-A265 WeakPolarHBondContact O-CB 3.47Å; L261-A265 PolarHBondContact O-N 3.36Å; L262-A265 PolarHBondContact O-N 2.79Å; A265-L267 PolarHBondContact O-N 2.89Å; A265-L268 PolarHBondContact O-N 3.2Å; A265-L269 WeakPolarHBondContact O-CB 3.46Å; A265-L269 PolarHBondContact O-N 3.47Å
266G87.8Confident80.8Confident41 Ų41107.8 Ų107.842%0.42357%0.574SS.*Hα-helixtrans-61.2-40.3176.400000113.5L262 L269 L270L262-G266 PolarHBondContact O-N 3.42Å; G266-L269 PolarHBondContact O-N 3.46Å; G266-L270 WeakPolarHBondContact O-CB 3.42Å; G266-L270 PolarHBondContact O-N 3.34Å
267L88.9Confident83Confident93 Ų93103.7 Ų103.749%0.48756%0.56SS.*Hα-helixtrans-66.9-41.5177.4-176.765.6000112.2Q263 R264 A265 L269 L270 L271Q263-L267 WeakPolarHBondContact O-CB 3.49Å; Q263-L267 PolarHBondContact O-N 2.78Å; R264-L267 PolarHBondContact O-N 3.22Å; A265-L267 PolarHBondContact O-N 2.89Å; L267-L269 VanDerWaalsContact C-N 3.34Å; L267-L270 PolarHBondContact O-N 3.36Å; L267-L271 HydrophobicContact CD1-CD1 4.33Å; L267-L271 HydrophobicContact CG-CD1 4.08Å; L267-L271 WeakPolarHBondContact O-CB 3.39Å; L267-L271 PolarHBondContact O-N 2.88Å
268L91.3Very high84.9Confident127 Ų12795.9 Ų95.967%0.66554%0.544SS*.Hα-helixtrans-65.4-38.8176.2-71173000111.6R264 A265 L271 G272R264-L268 WeakPolarHBondContact O-CG 3.44Å; R264-L268 PolarHBondContact O-N 2.89Å; A265-L268 PolarHBondContact O-N 3.2Å; L268-L271 PolarHBondContact O-N 2.93Å; L268-G272 PolarHBondContact O-N 3.49Å
269L92.3Very high86.9Confident129 Ų12995.3 Ų95.368%0.67553%0.534SS*.Hα-helixtrans-65.4-42.8176.2-148.6168.8000111A265 G266 L267 G272 L273A265-L269 WeakPolarHBondContact O-CB 3.46Å; A265-L269 PolarHBondContact O-N 3.47Å; G266-L269 PolarHBondContact O-N 3.46Å; L267-L269 VanDerWaalsContact C-N 3.34Å; L269-G272 PolarHBondContact O-N 2.86Å; L269-L273 WeakPolarHBondContact O-CB 3.29Å; L269-L273 PolarHBondContact O-N 3.01Å
270L93.6Very high88.5Confident98 Ų9895.4 Ų95.451%0.51354%0.535SS..Hα-helixtrans-61.9-46.3175.3-172.395000112.1G266 L267 G272 L273 L274G266-L270 WeakPolarHBondContact O-CB 3.42Å; G266-L270 PolarHBondContact O-N 3.34Å; L267-L270 PolarHBondContact O-N 3.36Å; L270-G272 VanDerWaalsContact C-N 3.34Å; L270-L273 PolarHBondContact O-N 2.73Å; L270-L274 HydrophobicContact CD2-CD1 4.29Å; L270-L274 HydrophobicContact CG-CD1 4.23Å; L270-L274 WeakPolarHBondContact O-CB 3.32Å; L270-L274 WeakPolarHBondContact O-CG 3.3Å; L270-L274 PolarHBondContact O-N 3.37Å
271L94.9Very high89.3Confident107 Ų10793.6 Ų93.656%0.5653%0.529SS*.Hα-helixtrans-62.4-41.8176.2-91.8150000111.7L267 L268 L274 G275L267-L271 HydrophobicContact CD1-CD1 4.33Å; L267-L271 HydrophobicContact CG-CD1 4.08Å; L267-L271 WeakPolarHBondContact O-CB 3.39Å; L267-L271 PolarHBondContact O-N 2.88Å; L268-L271 PolarHBondContact O-N 2.93Å; L271-L274 PolarHBondContact O-N 2.94Å; L271-G275 PolarHBondContact O-N 3.24Å
272G95.6Very high90.4Very high46 Ų4691.1 Ų91.147%0.47452%0.516SS..Hα-helixtrans-61.2-45.117400000112.4L268 L269 L270 G275 F276L268-G272 PolarHBondContact O-N 3.49Å; L269-G272 PolarHBondContact O-N 2.86Å; L270-G272 VanDerWaalsContact C-N 3.34Å; G272-G275 PolarHBondContact O-N 3.01Å; G272-F276 WeakPolarHBondContact O-CB 3.43Å; G272-F276 PolarHBondContact O-N 3.21Å
273L95.8Very high91Very high92 Ų9290 Ų9048%0.48251%0.508SS..Hα-helixtrans-63.3-45177.6-176.569.4000111.8L269 L270 F276 L277L269-L273 WeakPolarHBondContact O-CB 3.29Å; L269-L273 PolarHBondContact O-N 3.01Å; L270-L273 PolarHBondContact O-N 2.73Å; L273-F276 PolarHBondContact O-N 2.87Å; L273-L277 HydrophobicContact CG-CD1 4.32Å; L273-L277 WeakPolarHBondContact O-CG 3.44Å; L273-L277 PolarHBondContact O-N 3.28Å
274L96Very high91.4Very high103 Ų10387.2 Ų87.254%0.53950%0.5SS..Hα-helixtrans-62.7-42.9176.3-79164.7000111.8L270 L271 L277 A278L270-L274 HydrophobicContact CD2-CD1 4.29Å; L270-L274 HydrophobicContact CG-CD1 4.23Å; L270-L274 WeakPolarHBondContact O-CB 3.32Å; L270-L274 WeakPolarHBondContact O-CG 3.3Å; L270-L274 PolarHBondContact O-N 3.37Å; L271-L274 PolarHBondContact O-N 2.94Å; L274-L277 PolarHBondContact O-N 2.99Å; L274-A278 WeakPolarHBondContact O-CB 3.24Å; L274-A278 PolarHBondContact O-N 2.92Å
275G95.7Very high91.5Very high42 Ų4290.3 Ų90.343%0.43351%0.512SS..Hα-helixtrans-62-41.8174.400000112.4L271 G272 A278 L279L271-G275 PolarHBondContact O-N 3.24Å; G272-G275 PolarHBondContact O-N 3.01Å; G275-A278 PolarHBondContact O-N 3.37Å; G275-L279 WeakPolarHBondContact O-CB 3.48Å; G275-L279 PolarHBondContact O-N 2.97Å
276F95.3Very high91.2Very high114 Ų11492.6 Ų92.650%0.552%0.516SS..Hα-helixtrans-64.9-44176.7-178.9-104.9000112.3G272 L273 A278 L279 L280G272-F276 WeakPolarHBondContact O-CB 3.43Å; G272-F276 PolarHBondContact O-N 3.21Å; L273-F276 PolarHBondContact O-N 2.87Å; F276-A278 VanDerWaalsContact C-N 3.33Å; F276-A278 PolarHBondContact O-N 3.47Å; F276-L279 WeakPolarHBondContact O-CB 3.49Å; F276-L279 PolarHBondContact O-N 3.34Å; F276-L280 HydrophobicContact CD1-CD1 3.95Å; F276-L280 HydrophobicContact CD1-CG 4.4Å; F276-L280 HydrophobicContact CE1-CD1 3.42Å; F276-L280 VanDerWaalsContact CE1-CD1 3.42Å; F276-L280 HydrophobicContact CE1-CG 4.02Å; F276-L280 HydrophobicContact CZ-CD1 3.87Å; F276-L280 HydrophobicContact CZ-CD2 4.24Å; F276-L280 HydrophobicContact CZ-CG 4.09Å; F276-L280 WeakPolarHBondContact O-CG 3.43Å; F276-L280 PolarHBondContact O-N 2.91Å
277L94.9Very high90.6Very high94 Ų9492.7 Ų92.749%0.49252%0.516SS..Hα-helixtrans-63.3-38.9174.8-71.2173.6000111.9L273 L274 L280 A281L273-L277 HydrophobicContact CG-CD1 4.32Å; L273-L277 WeakPolarHBondContact O-CG 3.44Å; L273-L277 PolarHBondContact O-N 3.28Å; L274-L277 PolarHBondContact O-N 2.99Å; L277-L280 PolarHBondContact O-N 3.29Å; L277-A281 WeakPolarHBondContact O-CB 3.47Å; L277-A281 PolarHBondContact O-N 3.42Å
278A93.6Very high89.7Confident61 Ų6196.2 Ų96.250%0.50452%0.523SS..Hα-helixtrans-64.7-39.8174.200000111.9L274 G275 F276 A281 L282L274-A278 WeakPolarHBondContact O-CB 3.24Å; L274-A278 PolarHBondContact O-N 2.92Å; G275-A278 PolarHBondContact O-N 3.37Å; F276-A278 VanDerWaalsContact C-N 3.33Å; F276-A278 PolarHBondContact O-N 3.47Å; A278-A281 PolarHBondContact O-N 3.05Å; A278-L282 WeakPolarHBondContact O-CB 3.48Å; A278-L282 PolarHBondContact O-N 3.09Å
279L93.6Very high88.4Confident93 Ų9392.9 Ų92.949%0.48751%0.514SS..Hα-helixtrans-64-44.6174.5-175.870.8000111.4G275 F276 A281 L282 M283G275-L279 WeakPolarHBondContact O-CB 3.48Å; G275-L279 PolarHBondContact O-N 2.97Å; F276-L279 WeakPolarHBondContact O-CB 3.49Å; F276-L279 PolarHBondContact O-N 3.34Å; L279-A281 VanDerWaalsContact C-N 3.33Å; L279-A281 PolarHBondContact O-N 3.47Å; L279-L282 WeakPolarHBondContact O-CB 3.35Å; L279-L282 PolarHBondContact O-N 3.24Å; L279-M283 HydrophobicContact CG-CG 4.36Å; L279-M283 WeakPolarHBondContact O-CB 3.28Å; L279-M283 VanDerWaalsContact O-CG 3.24Å; L279-M283 WeakPolarHBondContact O-CG 3.42Å; L279-M283 PolarHBondContact O-N 3.47Å
280L92Very high87Confident87 Ų8789.6 Ų89.646%0.45551%0.506SS..Hα-helixtrans-61.3-42.2175-73.3179.4000111.7F276 L277 L282 M283 S284F276-L280 HydrophobicContact CD1-CD1 3.95Å; F276-L280 HydrophobicContact CD1-CG 4.4Å; F276-L280 HydrophobicContact CE1-CD1 3.42Å; F276-L280 VanDerWaalsContact CE1-CD1 3.42Å; F276-L280 HydrophobicContact CE1-CG 4.02Å; F276-L280 HydrophobicContact CZ-CD1 3.87Å; F276-L280 HydrophobicContact CZ-CD2 4.24Å; F276-L280 HydrophobicContact CZ-CG 4.09Å; F276-L280 WeakPolarHBondContact O-CG 3.43Å; F276-L280 PolarHBondContact O-N 2.91Å; L277-L280 PolarHBondContact O-N 3.29Å; L280-L282 VanDerWaalsContact C-N 3.32Å; L280-L282 PolarHBondContact O-N 3.06Å; L280-M283 PolarHBondContact O-N 3.42Å; L280-S284 VanDerWaalsContact O-CB 3.29Å; L280-S284 WeakPolarHBondContact O-CB 3.39Å; L280-S284 PolarHBondContact O-N 3.49Å; L280-S284 PolarHBondContact O-OG 3.25Å
281A89.8Confident85.4Confident49 Ų4987.2 Ų87.241%0.40550%0.5SS..Hα-helixtrans-62.2-42174.900000111.3L277 A278 L279 S284 R285L277-A281 WeakPolarHBondContact O-CB 3.47Å; L277-A281 PolarHBondContact O-N 3.42Å; A278-A281 PolarHBondContact O-N 3.05Å; L279-A281 VanDerWaalsContact C-N 3.33Å; L279-A281 PolarHBondContact O-N 3.47Å; A281-S284 PolarHBondContact O-N 3.29Å; A281-S284 PolarHBondContact O-OG 3.09Å; A281-R285 WeakPolarHBondContact O-CG 3.28Å; A281-R285 PolarHBondContact O-N 3.12Å
282L90.2Very high83.9Confident96 Ų9689.1 Ų89.150%0.50351%0.511SS..Hα-helixtrans-63.2-50.3175.9-174.664.9000111.2A278 L279 L280 S284 R285 L286A278-L282 WeakPolarHBondContact O-CB 3.48Å; A278-L282 PolarHBondContact O-N 3.09Å; L279-L282 WeakPolarHBondContact O-CB 3.35Å; L279-L282 PolarHBondContact O-N 3.24Å; L280-L282 VanDerWaalsContact C-N 3.32Å; L280-L282 PolarHBondContact O-N 3.06Å; L282-S284 VanDerWaalsContact C-N 3.27Å; L282-S284 PolarHBondContact O-N 3.36Å; L282-R285 PolarHBondContact O-N 3.34Å; L282-L286 HydrophobicContact CD1-CD1 3.41Å; L282-L286 VanDerWaalsContact CD1-CD1 3.41Å; L282-L286 HydrophobicContact CG-CD1 3.75Å; L282-L286 WeakPolarHBondContact O-CD1 3.47Å; L282-L286 PolarHBondContact O-N 3.47Å
283M86.9Confident82.2Confident126 Ų12691.2 Ų91.262%0.62152%0.518SS*.Hα-helixtrans-61.1-35.7176.5-65.1-128.676.900111.9L279 L280 R285 G287L279-M283 HydrophobicContact CG-CG 4.36Å; L279-M283 WeakPolarHBondContact O-CB 3.28Å; L279-M283 VanDerWaalsContact O-CG 3.24Å; L279-M283 WeakPolarHBondContact O-CG 3.42Å; L279-M283 PolarHBondContact O-N 3.47Å; L280-M283 PolarHBondContact O-N 3.42Å; M283-R285 VanDerWaalsContact C-N 3.3Å; M283-R285 PolarHBondContact O-N 3.01Å; M283-G287 WeakPolarHBondContact O-CA 3.35Å; M283-G287 PolarHBondContact O-N 3.07Å
284S84.9Confident80.7Confident48 Ų4890 Ų9034%0.33651%0.513SS..Hα-helixtrans-68.7-28.8174.780.30000113L280 A281 L282 R288L280-S284 VanDerWaalsContact O-CB 3.29Å; L280-S284 WeakPolarHBondContact O-CB 3.39Å; L280-S284 PolarHBondContact O-N 3.49Å; L280-S284 PolarHBondContact O-OG 3.25Å; A281-S284 PolarHBondContact O-N 3.29Å; A281-S284 PolarHBondContact O-OG 3.09Å; L282-S284 VanDerWaalsContact C-N 3.27Å; L282-S284 PolarHBondContact O-N 3.36Å; S284-R288 WeakPolarHBondContact O-CB 3.49Å; S284-R288 VanDerWaalsContact O-CG 3.28Å; S284-R288 WeakPolarHBondContact O-CG 3.46Å; S284-R288 PolarHBondContact O-N 3.07Å
285R83.4Confident79.1Confident194 Ų19489.9 Ų89.973%0.73252%0.517SS*.Hα-helixtrans-80.3-44.2176.3-77.8-171.8166.4-150.2-4.5111.7A281 L282 M283 R288 A289A281-R285 WeakPolarHBondContact O-CG 3.28Å; A281-R285 PolarHBondContact O-N 3.12Å; L282-R285 PolarHBondContact O-N 3.34Å; M283-R285 VanDerWaalsContact C-N 3.3Å; M283-R285 PolarHBondContact O-N 3.01Å; R285-R288 PolarHBondContact O-N 3.46Å; R285-A289 WeakPolarHBondContact O-CB 3.43Å; R285-A289 PolarHBondContact O-N 2.98Å
286L79.1Confident77.6Confident105 Ų10594.8 Ų94.855%0.5553%0.534SS..Hα-helixtrans-68.7-37.5176-84.176000111.4L282 A289 A290L282-L286 HydrophobicContact CD1-CD1 3.41Å; L282-L286 VanDerWaalsContact CD1-CD1 3.41Å; L282-L286 HydrophobicContact CG-CD1 3.75Å; L282-L286 WeakPolarHBondContact O-CD1 3.47Å; L282-L286 PolarHBondContact O-N 3.47Å; L286-A289 PolarHBondContact O-N 3.34Å; L286-A290 WeakPolarHBondContact O-CB 3.43Å; L286-A290 PolarHBondContact O-N 2.76Å
287G74.9Confident76Confident42 Ų4295 Ų9543%0.43354%0.54SS..Hα-helixtrans-65-41175.300000112.8M283 A290 A291M283-G287 WeakPolarHBondContact O-CA 3.35Å; M283-G287 PolarHBondContact O-N 3.07Å; G287-A290 PolarHBondContact O-N 3.43Å; G287-A291 PolarHBondContact O-N 3.26Å; G287-A291 VanDerWaalsContact O-N 3.09Å
288R69.1Low74.6Confident167 Ų16793.5 Ų93.563%0.6353%0.532SS*.Hα-helixtrans-66.7-42.7173.4-77.8-176.4179.1109.6-4.2112.4S284 R285 A290 A291 D292S284-R288 WeakPolarHBondContact O-CB 3.49Å; S284-R288 VanDerWaalsContact O-CG 3.28Å; S284-R288 WeakPolarHBondContact O-CG 3.46Å; S284-R288 PolarHBondContact O-N 3.07Å; R285-R288 PolarHBondContact O-N 3.46Å; R288-A290 VanDerWaalsContact C-N 3.26Å; R288-A290 PolarHBondContact O-N 3.42Å; R288-A291 PolarHBondContact O-N 2.84Å; R288-A291 VanDerWaalsContact O-N 3.12Å; R288-D292 PolarHBondContact O-N 3.37Å
289A65.3Low73.3Confident57 Ų5793.4 Ų93.447%0.47153%0.526SS..Hα-helixtrans-62.3-33.7176.400000112.9R285 L286 S293R285-A289 WeakPolarHBondContact O-CB 3.43Å; R285-A289 PolarHBondContact O-N 2.98Å; L286-A289 PolarHBondContact O-N 3.34Å; A289-S293 PolarHBondContact O-N 3.29Å; A289-S293 PolarHBondContact O-OG 2.96Å
290A63.2Low72Confident60 Ų6094.9 Ų94.950%0.49653%0.534SS..Hα-helixtrans-70.8-36.3173.700000112.5L286 G287 R288 S293 D294L286-A290 WeakPolarHBondContact O-CB 3.43Å; L286-A290 PolarHBondContact O-N 2.76Å; G287-A290 PolarHBondContact O-N 3.43Å; R288-A290 VanDerWaalsContact C-N 3.26Å; R288-A290 PolarHBondContact O-N 3.42Å; A290-S293 PolarHBondContact O-N 3.01Å; A290-S293 PolarHBondContact O-OG 2.85Å; A290-D294 PolarHBondContact O-N 3.1Å
291A60.2Low70.7Confident49 Ų4997.5 Ų97.541%0.40555%0.546SS..Hα-helixtrans-71.7-36.2177.300000113.1G287 R288 S293 D294G287-A291 PolarHBondContact O-N 3.26Å; G287-A291 VanDerWaalsContact O-N 3.09Å; R288-A291 PolarHBondContact O-N 2.84Å; R288-A291 VanDerWaalsContact O-N 3.12Å; A291-S293 PolarHBondContact O-N 3.46Å; A291-D294 PolarHBondContact O-N 3Å
292D61.9Low69.6Low147 Ų14798.4 Ų98.479%0.78654%0.544SS*.THydrogen-bonded Turntrans-71.7-15.7176.9-67.7-29.6000113R288R288-D292 PolarHBondContact O-N 3.37Å
293S60.1Low68.6Low89 Ų8999.5 Ų99.562%0.62256%0.557SS**THydrogen-bonded Turntrans-109.55.1179.954.50000113.9A289 A290 A291 P295A289-S293 PolarHBondContact O-N 3.29Å; A289-S293 PolarHBondContact O-OG 2.96Å; A290-S293 PolarHBondContact O-N 3.01Å; A290-S293 PolarHBondContact O-OG 2.85Å; A291-S293 PolarHBondContact O-N 3.46Å; S293-P295 VanDerWaalsContact O-CD 3.3Å; S293-P295 WeakPolarHBondContact O-CD 3.42Å
294D64.7Low67.7Low68 Ų68101.6 Ų101.636%0.36456%0.564SS.*  trans-82.5112.1177.9-170.6-14.6000110.4A290 A291 N296 L297A290-D294 PolarHBondContact O-N 3.1Å; A291-D294 PolarHBondContact O-N 3Å; D294-N296 PolarHBondContact O-N 3.21Å; D294-N296 VanDerWaalsContact OD1-CB 3.32Å; D294-N296 WeakPolarHBondContact OD1-CB 3.15Å; D294-N296 PolarHBondContact OD1-N 3.26Å; D294-L297 HydrophobicContact CB-CB 4.48Å; D294-L297 HydrophobicContact CB-CD1 3.75Å; D294-L297 PolarHBondContact O-N 3.23Å
295P62.7Low67Low99 Ų99103.1 Ų103.164%0.64357%0.568SS**THydrogen-bonded Turntrans-63.5-14-179.326.9-35000113.6S293S293-P295 VanDerWaalsContact O-CD 3.3Å; S293-P295 WeakPolarHBondContact O-CD 3.42Å
296N64Low66.2Low146 Ų146105.7 Ų105.778%0.78158%0.578SS**THydrogen-bonded Turntrans-81.6-14.9175.6-160.424.5000113.2D294D294-N296 PolarHBondContact O-N 3.21Å; D294-N296 VanDerWaalsContact OD1-CB 3.32Å; D294-N296 WeakPolarHBondContact OD1-CB 3.15Å; D294-N296 PolarHBondContact OD1-N 3.26Å
297L61.9Low65.8Low118 Ų118105 Ų10562%0.61858%0.578SS**SBendtrans-101.20176.7-81.8131.1000113.2D294 P299D294-L297 HydrophobicContact CB-CB 4.48Å; D294-L297 HydrophobicContact CB-CD1 3.75Å; D294-L297 PolarHBondContact O-N 3.23Å; L297-P299 VanDerWaalsContact O-CD 3.3Å; L297-P299 WeakPolarHBondContact O-CD 3.32Å
298D65Low65.7Low62 Ų62106.1 Ų106.133%0.33259%0.589SS.*  trans-72.8115178.2-169-10.9000110.7L300 M301D298-L300 PolarHBondContact O-N 3.44Å; D298-L300 VanDerWaalsContact O-N 3.09Å; D298-L300 WeakPolarHBondContact OD1-CB 3.3Å; D298-L300 PolarHBondContact OD1-N 3.31Å; D298-M301 HydrophobicContact CB-CB 4.43Å; D298-M301 HydrophobicContact CB-CG 4.17Å; D298-M301 PolarHBondContact O-N 3.24Å
299P66.9Low65.5Low59 Ų59104.7 Ų104.738%0.38360%0.602SS.*THydrogen-bonded Turntrans-62.6-16.4179.325.3-33.8000113.4L297 I305L297-P299 VanDerWaalsContact O-CD 3.3Å; L297-P299 WeakPolarHBondContact O-CD 3.32Å; P299-I305 HydrophobicContact CB-CD1 4.22Å; P299-I305 HydrophobicContact CB-CG2 3.87Å
300L66.1Low65.1Low125 Ų125111.1 Ų111.165%0.65464%0.643SS**THydrogen-bonded Turntrans-77.7-21.1175.4-65173000113.5D298 V307D298-L300 PolarHBondContact O-N 3.44Å; D298-L300 VanDerWaalsContact O-N 3.09Å; D298-L300 WeakPolarHBondContact OD1-CB 3.3Å; D298-L300 PolarHBondContact OD1-N 3.31Å; L300-V307 HydrophobicContact CD2-CG2 3.57Å
301M64.6Low65.2Low142 Ų142113.7 Ų113.770%0.765%0.65SS**THydrogen-bonded Turntrans-91.3-8.5-179.7-68.7-66.7163.100113D298 P303D298-M301 HydrophobicContact CB-CB 4.43Å; D298-M301 HydrophobicContact CB-CG 4.17Å; D298-M301 PolarHBondContact O-N 3.24Å; M301-P303 WeakPolarHBondContact O-CD 3.45Å
302N66.2Low65.4Low68 Ų68117.1 Ų117.136%0.36466%0.663SS.*  trans-94.2112176.8-171-21.2000110.5H304 I305N302-H304 PolarHBondContact O-N 2.74Å; N302-H304 PolarHBondContact OD1-N 3.14Å; N302-H304 VanDerWaalsContact OD1-N 3.12Å; N302-I305 HydrophobicContact CB-CB 4.35Å; N302-I305 HydrophobicContact CB-CD1 3.78Å; N302-I305 HydrophobicContact CB-CG1 3.96Å; N302-I305 PolarHBondContact O-N 3.11Å
303P69.3Low65.6Low119 Ų119115.4 Ų115.477%0.77366%0.656SS**THydrogen-bonded Turntrans-64-9.2-176.726.2-34.4000114.1M301M301-P303 WeakPolarHBondContact O-CD 3.45Å
304H67.6Low66Low169 Ų169116.9 Ų116.978%0.78266%0.658SS**THydrogen-bonded Turntrans-95.2-6.8176.4-65.1-71.4000114.4N302N302-H304 PolarHBondContact O-N 2.74Å; N302-H304 PolarHBondContact OD1-N 3.14Å; N302-H304 VanDerWaalsContact OD1-N 3.12Å
305I70.1Confident66.1Low81 Ų81120 Ų12042%0.41568%0.677SS.*  trans-101.7120.7-179.6-61.4176.9000109.3P299 N302P299-I305 HydrophobicContact CB-CD1 4.22Å; P299-I305 HydrophobicContact CB-CG2 3.87Å; N302-I305 HydrophobicContact CB-CB 4.35Å; N302-I305 HydrophobicContact CB-CD1 3.78Å; N302-I305 HydrophobicContact CB-CG1 3.96Å; N302-I305 PolarHBondContact O-N 3.11Å
306R66.5Low66.3Low247 Ų247121.4 Ų121.493%0.93268%0.679SS**  trans-104.9106.9174.9-64.7-176.4-179.2-169.40.2109
307V71.3Confident66.4Low91 Ų91119.6 Ų119.655%0.55267%0.672SS**PPolyproline II helixtrans-81.6129.3171.4-80.90000109.9L300L300-V307 HydrophobicContact CD2-CG2 3.57Å
308G72.4Confident66.8Low65 Ų65119.8 Ų119.867%0.6768%0.676SS**PPolyproline II helixtrans-76.1156179.100000112.5
309P65.8Low66.9Low137 Ų137124.6 Ų124.689%0.8971%0.705SS**PPolyproline II helixtrans-66.2134.3178.227.6-32.2000110.5
310S56.5Low66.9Low192 Ų192130.5 Ų130.5100%1.34373%0.734SS**  trans-69.90172.9590000112.3

Retrieved 310 of 310 residues in 1029.7 ms (Link to these results)

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