A0A087X8C3_POEFO Loading...

Exportin-2

Export receptor for importin alpha. Mediates importin-alpha re-export from the nucleus to the cytoplasm after import substrates have been released into the nucleoplasm. Negatively regulates fluid secretion and plays a role in fluid homeostasis by down-regulating cftr activity.

AlphaFold DB , UniProt , Accession A0A087X8C3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 971 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
1M78.9Confident86.6Confident50 Ų5067.6 Ų67.625%0.24636%0.361CS..  0133.40-76.9175.47100108N7 L11 V36 N39 Q40 N41 L45M1-N7 HydrophobicContact CE-CB 3.84Å; M1-L11 HydrophobicContact CE-CG 4.48Å; M1-V36 HydrophobicContact SD-CB 4.2Å; M1-N39 HydrophobicContact CB-CB 4.33Å; M1-N39 HydrophobicContact CG-CB 3.77Å; M1-N39 HydrophobicContact SD-CB 4.28Å; M1-Q40 PolarHBondContact N-O 3.06Å; M1-Q40 VanDerWaalsContact O-O 3.09Å; M1-N41 WeakPolarHBondContact O-CB 3.47Å; M1-N41 PolarHBondContact O-ND2 2.85Å; M1-L45 HydrophobicContact CB-CD1 3.91Å; M1-L45 HydrophobicContact CE-CD1 3.89Å; M1-L45 HydrophobicContact SD-CD1 4.45Å
2E83.6Confident87Confident142 Ų14265.3 Ų65.366%0.66435%0.351SS*.  trans-75.9147.8176.6-68.2-178.8174.900111.1N4 N7E2-N4 VanDerWaalsContact C-N 3.3Å; E2-N4 PolarHBondContact O-N 2.99Å; E2-N7 PolarHBondContact N-ND2 3.38Å; E2-N7 PolarHBondContact O-ND2 3.14Å
3L82.6Confident87.4Confident85 Ų8569.1 Ų69.145%0.44537%0.365SS..SBendtrans-80.779.2177.9-153.3134000109.6L44 L45 T48L3-L44 HydrophobicContact CD1-CB 3.72Å; L3-L45 HydrophobicContact CG-CD2 4.09Å; L3-T48 HydrophobicContact CD2-CG2 4.33Å
4N87.1Confident87.7Confident54 Ų5467 Ų6729%0.28935%0.352SS..SBendtrans-132.7163.5-176.968.433.6000112.1E2 A6 N7 L8E2-N4 VanDerWaalsContact C-N 3.3Å; E2-N4 PolarHBondContact O-N 2.99Å; N4-A6 VanDerWaalsContact C-N 3.29Å; N4-A6 PolarHBondContact O-N 2.98Å; N4-A6 PolarHBondContact OD1-N 2.83Å; N4-N7 PolarHBondContact O-N 3.38Å; N4-N7 WeakPolarHBondContact OD1-CB 3.28Å; N4-N7 PolarHBondContact OD1-N 2.74Å; N4-N7 PolarHBondContact OD1-ND2 2.84Å; N4-L8 WeakPolarHBondContact O-CG 3.47Å; N4-L8 PolarHBondContact O-N 3.12Å; N4-L8 VanDerWaalsContact O-N 3.12Å
5D84.7Confident88Confident118 Ų11862.5 Ų62.563%0.63133%0.328SS*.Hα-helixtrans-64.4-31.8-174.1-66.7-29.8000113.3L8 Q9D5-L8 PolarHBondContact O-N 3.13Å; D5-Q9 WeakPolarHBondContact O-CB 3.37Å; D5-Q9 WeakPolarHBondContact O-CG 3.37Å; D5-Q9 PolarHBondContact O-N 2.94Å
6A88Confident88.2Confident59 Ų5969.1 Ų69.149%0.48835%0.347SS..Hα-helixtrans-64.9-42.5177.900000111.9N4 Q9 T10N4-A6 VanDerWaalsContact C-N 3.29Å; N4-A6 PolarHBondContact O-N 2.98Å; N4-A6 PolarHBondContact OD1-N 2.83Å; A6-Q9 PolarHBondContact O-N 3.41Å; A6-T10 WeakPolarHBondContact O-CB 3.48Å; A6-T10 PolarHBondContact O-N 3.13Å; A6-T10 PolarHBondContact O-OG1 3.46Å
7N89Confident88.4Confident36 Ų3670 Ų7019%0.19335%0.348CS..Hα-helixtrans-70.2-37176.5-75.1-27.1000112M1 E2 N4 T10 L11 L45M1-N7 HydrophobicContact CE-CB 3.84Å; E2-N7 PolarHBondContact N-ND2 3.38Å; E2-N7 PolarHBondContact O-ND2 3.14Å; N4-N7 PolarHBondContact O-N 3.38Å; N4-N7 WeakPolarHBondContact OD1-CB 3.28Å; N4-N7 PolarHBondContact OD1-N 2.74Å; N4-N7 PolarHBondContact OD1-ND2 2.84Å; N7-T10 PolarHBondContact O-N 3.41Å; N7-L11 WeakPolarHBondContact O-CG 2.92Å; N7-L11 PolarHBondContact O-N 3.47Å; N7-L45 HydrophobicContact CB-CD1 4.1Å; N7-L45 HydrophobicContact CB-CD2 4.2Å
8L87.6Confident88.4Confident18 Ų1867.8 Ų67.89%0.09434%0.34CS..Hα-helixtrans-62.6-43.7173.6-70.2171.4000111.6N4 D5 T12 L45 T48 L49N4-L8 WeakPolarHBondContact O-CG 3.47Å; N4-L8 PolarHBondContact O-N 3.12Å; N4-L8 VanDerWaalsContact O-N 3.12Å; D5-L8 PolarHBondContact O-N 3.13Å; L8-T12 WeakPolarHBondContact O-CB 3.27Å; L8-T12 PolarHBondContact O-N 3.19Å; L8-T12 PolarHBondContact O-OG1 3.38Å; L8-L45 HydrophobicContact CD2-CB 4.34Å; L8-L45 HydrophobicContact CD2-CD2 3.55Å; L8-L45 HydrophobicContact CG-CD2 3.79Å; L8-T48 HydrophobicContact CD1-CG2 4.12Å; L8-T48 HydrophobicContact CD2-CG2 4.18Å; L8-L49 HydrophobicContact CB-CD2 4.07Å; L8-L49 HydrophobicContact CD2-CD2 3.71Å; L8-L49 HydrophobicContact CD2-CG 3.66Å; L8-L49 HydrophobicContact CG-CD2 4.47Å
9Q89.1Confident88.3Confident132 Ų13269.2 Ų69.262%0.61735%0.347SS*.Hα-helixtrans-63.2-46.1175.2-77.1-179.7-3.900111.7D5 A6 L11 T12 E13D5-Q9 WeakPolarHBondContact O-CB 3.37Å; D5-Q9 WeakPolarHBondContact O-CG 3.37Å; D5-Q9 PolarHBondContact O-N 2.94Å; A6-Q9 PolarHBondContact O-N 3.41Å; Q9-L11 PolarHBondContact O-N 3.29Å; Q9-T12 WeakPolarHBondContact O-CB 3.39Å; Q9-T12 PolarHBondContact O-N 3.37Å; Q9-T12 VanDerWaalsContact O-N 3.15Å; Q9-E13 PolarHBondContact O-N 3.2Å
10T90.7Very high88.4Confident49 Ų4968.7 Ų68.730%0.30135%0.346SS..Hα-helixtrans-58.1-49.5178.3-56.90000111.2A6 N7 T12 E13 F14 F32A6-T10 WeakPolarHBondContact O-CB 3.48Å; A6-T10 PolarHBondContact O-N 3.13Å; A6-T10 PolarHBondContact O-OG1 3.46Å; N7-T10 PolarHBondContact O-N 3.41Å; T10-T12 VanDerWaalsContact C-N 3.3Å; T10-T12 PolarHBondContact O-N 3.14Å; T10-E13 PolarHBondContact O-N 2.93Å; T10-F14 HydrophobicContact CG2-CD2 3.98Å; T10-F14 HydrophobicContact CG2-CE2 4.04Å; T10-F14 WeakPolarHBondContact O-CD2 3.22Å; T10-F14 PolarHBondContact O-N 2.98Å; T10-F14 VanDerWaalsContact O-N 3.14Å; T10-F32 HydrophobicContact CG2-CE1 4.33Å; T10-F32 HydrophobicContact CG2-CZ 4.23Å
11L91.1Very high88.1Confident1 Ų171 Ų711%0.00537%0.366CS..Hα-helixtrans-61.9-39.1177.3-74.1174.4000112M1 N7 Q9 E13 F14 L15 L33 Y42 L45 L49M1-L11 HydrophobicContact CE-CG 4.48Å; N7-L11 WeakPolarHBondContact O-CG 2.92Å; N7-L11 PolarHBondContact O-N 3.47Å; Q9-L11 PolarHBondContact O-N 3.29Å; L11-E13 PolarHBondContact O-N 3.21Å; L11-F14 PolarHBondContact O-N 2.56Å; L11-L15 WeakPolarHBondContact O-CB 3.36Å; L11-L15 WeakPolarHBondContact O-CG 3.42Å; L11-L15 PolarHBondContact O-N 2.9Å; L11-L33 HydrophobicContact CD2-CD2 3.85Å; L11-Y42 HydrophobicContact CD2-CD2 4.29Å; L11-Y42 HydrophobicContact CD2-CE2 3.72Å; L11-L45 HydrophobicContact CD1-CB 3.62Å; L11-L45 HydrophobicContact CD1-CD1 3.87Å; L11-L45 HydrophobicContact CD1-CG 4.29Å; L11-L49 HydrophobicContact CB-CD1 4.02Å
12T91.6Very high88.3Confident40 Ų4071.9 Ų71.925%0.24537%0.371CS..Hα-helixtrans-59.6-45176.3-60.50000111.7L8 Q9 T10 R16 L49 I58L8-T12 WeakPolarHBondContact O-CB 3.27Å; L8-T12 PolarHBondContact O-N 3.19Å; L8-T12 PolarHBondContact O-OG1 3.38Å; Q9-T12 WeakPolarHBondContact O-CB 3.39Å; Q9-T12 PolarHBondContact O-N 3.37Å; Q9-T12 VanDerWaalsContact O-N 3.15Å; T10-T12 VanDerWaalsContact C-N 3.3Å; T10-T12 PolarHBondContact O-N 3.14Å; T12-R16 WeakPolarHBondContact O-CB 3.34Å; T12-R16 PolarHBondContact O-N 3.25Å; T12-L49 WeakPolarHBondContact OG1-CD2 3.43Å; T12-I58 HydrophobicContact CG2-CD1 4.07Å; T12-I58 HydrophobicContact CG2-CG1 4.07Å; T12-I58 HydrophobicContact CG2-CG2 4.08Å
13E92.1Very high87.9Confident114 Ų11468 Ų6853%0.53336%0.358SS..Hα-helixtrans-62.9-45178.2-72.9-174.9-179.600112.6Q9 T10 L11 R16 K17Q9-E13 PolarHBondContact O-N 3.2Å; T10-E13 PolarHBondContact O-N 2.93Å; L11-E13 PolarHBondContact O-N 3.21Å; E13-R16 WeakPolarHBondContact O-CB 3.48Å; E13-R16 PolarHBondContact O-N 3.45Å; E13-K17 WeakPolarHBondContact O-CG 3.49Å; E13-K17 PolarHBondContact O-N 3.49Å
14F91.9Very high88.1Confident40 Ų4068.8 Ų68.818%0.17537%0.367CS..Hα-helixtrans-70.9-39.4-179.9-82-79.9000112.3T10 L11 R16 K17 T18 A29 F32 L33T10-F14 HydrophobicContact CG2-CD2 3.98Å; T10-F14 HydrophobicContact CG2-CE2 4.04Å; T10-F14 WeakPolarHBondContact O-CD2 3.22Å; T10-F14 PolarHBondContact O-N 2.98Å; T10-F14 VanDerWaalsContact O-N 3.14Å; L11-F14 PolarHBondContact O-N 2.56Å; F14-R16 PolarHBondContact O-N 3.37Å; F14-K17 HydrophobicContact CD1-CD 4.41Å; F14-K17 PolarHBondContact O-N 3.27Å; F14-K17 VanDerWaalsContact O-N 3.16Å; F14-T18 WeakPolarHBondContact O-CG2 3.35Å; F14-T18 PolarHBondContact O-N 3.37Å; F14-T18 VanDerWaalsContact O-N 3.08Å; F14-A29 HydrophobicContact CD1-CB 4.04Å; F14-F32 HydrophobicContact CB-CD1 4.05Å; F14-F32 HydrophobicContact CB-CE1 4.43Å; F14-F32 HydrophobicContact CD1-CB 3.87Å; F14-F32 AromaticContact CD1-CD1 3.49Å; F14-F32 HydrophobicContact CD1-CD1 3.49Å; F14-F32 VanDerWaalsContact CD1-CD1 3.49Å; F14-F32 HydrophobicContact CD1-CE1 4.26Å; F14-F32 AromaticContact CD1-CG 3.81Å; F14-F32 HydrophobicContact CD1-CG 3.81Å; F14-F32 AromaticContact CD2-CD1 3.44Å; F14-F32 HydrophobicContact CD2-CD1 3.44Å; F14-F32 VanDerWaalsContact CD2-CD1 3.44Å; F14-F32 AromaticContact CD2-CE1 3.32Å; F14-F32 HydrophobicContact CD2-CE1 3.32Å; F14-F32 HydrophobicContact CD2-CG 4.26Å; F14-F32 HydrophobicContact CD2-CZ 4.07Å; F14-F32 HydrophobicContact CE1-CB 3.68Å; F14-F32 AromaticContact CE1-CD1 3.66Å; F14-F32 HydrophobicContact CE1-CD1 3.66Å; F14-F32 HydrophobicContact CE1-CD2 4.2Å; F14-F32 HydrophobicContact CE1-CE1 4.36Å; F14-F32 AromaticContact CE1-CG 3.56Å; F14-F32 HydrophobicContact CE1-CG 3.56Å; F14-F32 AromaticContact CE2-CD1 3.62Å; F14-F32 HydrophobicContact CE2-CD1 3.62Å; F14-F32 HydrophobicContact CE2-CD2 4.3Å; F14-F32 AromaticContact CE2-CE1 3.45Å; F14-F32 HydrophobicContact CE2-CE1 3.45Å; F14-F32 VanDerWaalsContact CE2-CE1 3.45Å; F14-F32 HydrophobicContact CE2-CE2 4.16Å; F14-F32 HydrophobicContact CE2-CG 4.04Å; F14-F32 AromaticContact CE2-CZ 3.74Å; F14-F32 HydrophobicContact CE2-CZ 3.74Å; F14-F32 AromaticContact CG-CD1 3.36Å; F14-F32 HydrophobicContact CG-CD1 3.36Å; F14-F32 AromaticContact CG-CE1 3.75Å; F14-F32 HydrophobicContact CG-CE1 3.75Å; F14-F32 HydrophobicContact CG-CG 4.15Å; F14-F32 HydrophobicContact CZ-CB 4.28Å; F14-F32 AromaticContact CZ-CD1 3.72Å; F14-F32 HydrophobicContact CZ-CD1 3.72Å; F14-F32 AromaticContact CZ-CD2 3.92Å; F14-F32 HydrophobicContact CZ-CD2 3.92Å; F14-F32 AromaticContact CZ-CE1 3.98Å; F14-F32 HydrophobicContact CZ-CE1 3.98Å; F14-F32 HydrophobicContact CZ-CE2 4.16Å; F14-F32 AromaticContact CZ-CG 3.68Å; F14-F32 HydrophobicContact CZ-CG 3.68Å; F14-F32 HydrophobicContact CZ-CZ 4.19Å; F14-L33 HydrophobicContact CB-CD2 3.99Å; F14-L33 HydrophobicContact CB-CG 4.26Å
15L91.6Very high88Confident0 Ų068.6 Ų68.60%037%0.368CS..Hα-helixtrans-57.9-41.1170.7-72.4170.5000110.7L11 K17 T18 L33 L46 L49 C61 A62 T65L11-L15 WeakPolarHBondContact O-CB 3.36Å; L11-L15 WeakPolarHBondContact O-CG 3.42Å; L11-L15 PolarHBondContact O-N 2.9Å; L15-K17 PolarHBondContact O-N 3.25Å; L15-T18 PolarHBondContact O-N 2.96Å; L15-T18 PolarHBondContact O-OG1 3.07Å; L15-L33 HydrophobicContact CD2-CD1 3.98Å; L15-L46 HydrophobicContact CD1-CD2 4.32Å; L15-L49 HydrophobicContact CD1-CD1 4.15Å; L15-C61 HydrophobicContact CD2-CB 4.49Å; L15-A62 HydrophobicContact CD1-CB 4.32Å; L15-T65 HydrophobicContact CD2-CG2 4.29Å; L15-T65 WeakPolarHBondContact CD2-OG1 3.23Å
16R91.5Very high88.1Confident168 Ų16867.4 Ų67.463%0.63435%0.354SS*.Hα-helixtrans-62.6-42176.1-158.2178.2-148-171.66.8112.7T12 E13 F14 T18 L19 I58T12-R16 WeakPolarHBondContact O-CB 3.34Å; T12-R16 PolarHBondContact O-N 3.25Å; E13-R16 WeakPolarHBondContact O-CB 3.48Å; E13-R16 PolarHBondContact O-N 3.45Å; F14-R16 PolarHBondContact O-N 3.37Å; R16-T18 PolarHBondContact O-N 3.37Å; R16-L19 WeakPolarHBondContact O-CB 3.1Å; R16-L19 PolarHBondContact O-N 3.25Å; R16-L19 VanDerWaalsContact O-N 3.09Å; R16-I58 HydrophobicContact CB-CD1 4.29Å
17K91.4Very high87.7Confident84 Ų8472.4 Ų72.437%0.36536%0.361SS..Hα-helixtrans-64.6-26176.7-71.5173.3-176.1170.50113.1E13 F14 L15 L19 D20 V25 A29E13-K17 WeakPolarHBondContact O-CG 3.49Å; E13-K17 PolarHBondContact O-N 3.49Å; F14-K17 HydrophobicContact CD1-CD 4.41Å; F14-K17 PolarHBondContact O-N 3.27Å; F14-K17 VanDerWaalsContact O-N 3.16Å; L15-K17 PolarHBondContact O-N 3.25Å; K17-L19 PolarHBondContact O-N 3.06Å; K17-D20 WeakPolarHBondContact O-CB 3.48Å; K17-D20 PolarHBondContact O-N 2.94Å; K17-V25 HydrophobicContact CB-CG1 4.07Å; K17-V25 HydrophobicContact CG-CG1 4.11Å; K17-A29 HydrophobicContact CB-CB 3.6Å
18T88.7Confident87.6Confident31 Ų3174.2 Ų74.219%0.1937%0.374CS..THydrogen-bonded Turntrans-67.4-15.9173.864.20000113.6F14 L15 R16 R26 A29 E30 L33F14-T18 WeakPolarHBondContact O-CG2 3.35Å; F14-T18 PolarHBondContact O-N 3.37Å; F14-T18 VanDerWaalsContact O-N 3.08Å; L15-T18 PolarHBondContact O-N 2.96Å; L15-T18 PolarHBondContact O-OG1 3.07Å; R16-T18 PolarHBondContact O-N 3.37Å; T18-R26 WeakPolarHBondContact O-CD 3.49Å; T18-R26 WeakPolarHBondContact O-CG 3.28Å; T18-A29 HydrophobicContact CG2-CB 4.01Å; T18-E30 HydrophobicContact CG2-CG 4.13Å; T18-L33 HydrophobicContact CG2-CD1 3.72Å
19L87.3Confident87.6Confident93 Ų9373.5 Ų73.549%0.48737%0.371SS..THydrogen-bonded Turntrans-92.10.3176.5-54.5176.4000113.2R16 K17 V57R16-L19 WeakPolarHBondContact O-CB 3.1Å; R16-L19 PolarHBondContact O-N 3.25Å; R16-L19 VanDerWaalsContact O-N 3.09Å; K17-L19 PolarHBondContact O-N 3.06Å; L19-V57 HydrophobicContact CD1-CG1 3.59Å
20D89.6Confident87.3Confident60 Ų6071 Ų7132%0.32136%0.359SS..  trans-72.6135.6-178.2-158.8-69.2000111K17 D22 V25K17-D20 WeakPolarHBondContact O-CB 3.48Å; K17-D20 PolarHBondContact O-N 2.94Å; D20-D22 PolarHBondContact O-N 3.28Å; D20-D22 VanDerWaalsContact OD1-CB 3.31Å; D20-D22 WeakPolarHBondContact OD1-CB 3.45Å; D20-D22 PolarHBondContact OD1-N 3.48Å; D20-V25 HydrophobicContact CB-CB 4.08Å; D20-V25 HydrophobicContact CB-CG1 3.85Å
21P81.3Confident87Confident117 Ų11775.8 Ų75.876%0.7638%0.376SS*.SBendtrans-67.1-21.5176.727.3-35.5000113.4P23P21-P23 WeakPolarHBondContact O-CD 3.33Å
22D84.2Confident86.9Confident68 Ų6878.8 Ų78.836%0.36439%0.389SS..  trans-79.1116.7179.3-171.9-18.1000111.6D20 T24 V25 R26D20-D22 PolarHBondContact O-N 3.28Å; D20-D22 VanDerWaalsContact OD1-CB 3.31Å; D20-D22 WeakPolarHBondContact OD1-CB 3.45Å; D20-D22 PolarHBondContact OD1-N 3.48Å; D22-T24 PolarHBondContact O-N 2.97Å; D22-T24 VanDerWaalsContact O-N 3.1Å; D22-T24 WeakPolarHBondContact OD1-CB 3.37Å; D22-T24 WeakPolarHBondContact OD1-CG2 3.33Å; D22-T24 PolarHBondContact OD1-N 3.28Å; D22-T24 PolarHBondContact OD1-OG1 3.07Å; D22-T24 PolarHBondContact OD2-OG1 3.22Å; D22-V25 HydrophobicContact CB-CB 4.47Å; D22-V25 HydrophobicContact CB-CG2 4.2Å; D22-V25 PolarHBondContact O-N 3.14Å; D22-R26 PolarHBondContact O-N 2.96Å
23P75.8Confident86.7Confident60 Ų6077.5 Ų77.539%0.3938%0.381SS..Hα-helixtrans-58-25.3176.7-23.534.6000114.1P21 V25 R27P21-P23 WeakPolarHBondContact O-CD 3.33Å; P23-V25 VanDerWaalsContact C-N 3.29Å; P23-R27 WeakPolarHBondContact O-CB 3.43Å; P23-R27 WeakPolarHBondContact O-CG 3.26Å; P23-R27 PolarHBondContact O-N 2.92Å
24T85.9Confident86.4Confident103 Ų10377.7 Ų77.763%0.63238%0.381SS*.Hα-helixtrans-73.5-20.9178.8720000112.8D22 P28D22-T24 PolarHBondContact O-N 2.97Å; D22-T24 VanDerWaalsContact O-N 3.1Å; D22-T24 WeakPolarHBondContact OD1-CB 3.37Å; D22-T24 WeakPolarHBondContact OD1-CG2 3.33Å; D22-T24 PolarHBondContact OD1-N 3.28Å; D22-T24 PolarHBondContact OD1-OG1 3.07Å; D22-T24 PolarHBondContact OD2-OG1 3.22Å; T24-P28 WeakPolarHBondContact O-CD 3.23Å; T24-P28 WeakPolarHBondContact O-CG 3.47Å
25V85.7Confident86Confident49 Ų4979.9 Ų79.930%0.29740%0.402SS..Hα-helixtrans-94.4-42.5173.21790000110.6K17 D20 D22 P23 P28 A29K17-V25 HydrophobicContact CB-CG1 4.07Å; K17-V25 HydrophobicContact CG-CG1 4.11Å; D20-V25 HydrophobicContact CB-CB 4.08Å; D20-V25 HydrophobicContact CB-CG1 3.85Å; D22-V25 HydrophobicContact CB-CB 4.47Å; D22-V25 HydrophobicContact CB-CG2 4.2Å; D22-V25 PolarHBondContact O-N 3.14Å; P23-V25 VanDerWaalsContact C-N 3.29Å; V25-P28 WeakPolarHBondContact O-CD 3.22Å; V25-A29 PolarHBondContact O-N 3.47Å
26R86.1Confident85.8Confident94 Ų9480.7 Ų80.736%0.35541%0.407SS..Hα-helixtrans-66.8-51.2-176.4-170.7175.673.9-153.71.1113.3T18 D22 A29 E30T18-R26 WeakPolarHBondContact O-CD 3.49Å; T18-R26 WeakPolarHBondContact O-CG 3.28Å; D22-R26 PolarHBondContact O-N 2.96Å; R26-A29 WeakPolarHBondContact O-CB 3.28Å; R26-A29 PolarHBondContact O-N 2.99Å; R26-E30 HydrophobicContact CG-CG 4.46Å; R26-E30 WeakPolarHBondContact CG-OE1 3.39Å; R26-E30 IonicContact NE-OE1 3.35Å; R26-E30 PolarHBondContact O-N 3.23Å
27R79.7Confident85.6Confident164 Ų16473.3 Ų73.362%0.61938%0.379SS*.Hα-helixtrans-61.3-42.8-175.7-70.5176.4173.5177.9-2.2113P23 A29 K31P23-R27 WeakPolarHBondContact O-CB 3.43Å; P23-R27 WeakPolarHBondContact O-CG 3.26Å; P23-R27 PolarHBondContact O-N 2.92Å; R27-A29 VanDerWaalsContact C-N 3.3Å; R27-A29 PolarHBondContact O-N 3.13Å; R27-K31 WeakPolarHBondContact O-CG 3.38Å; R27-K31 PolarHBondContact O-N 3.25Å; R27-K31 VanDerWaalsContact O-N 3.09Å
28P87.3Confident85.2Confident74 Ų7471.6 Ų71.648%0.48139%0.385SS..Hα-helixtrans-64.5-33.1173.7-25.937.4000113.6T24 V25 F32T24-P28 WeakPolarHBondContact O-CD 3.23Å; T24-P28 WeakPolarHBondContact O-CG 3.47Å; V25-P28 WeakPolarHBondContact O-CD 3.22Å; P28-F32 WeakPolarHBondContact O-CB 3.46Å; P28-F32 PolarHBondContact O-N 2.85Å
29A86.7Confident85.1Confident2 Ų273.3 Ų73.32%0.01739%0.393CS..Hα-helixtrans-69.2-42.6177.900000112.3F14 K17 T18 V25 R26 R27 F32 L33F14-A29 HydrophobicContact CD1-CB 4.04Å; K17-A29 HydrophobicContact CB-CB 3.6Å; T18-A29 HydrophobicContact CG2-CB 4.01Å; V25-A29 PolarHBondContact O-N 3.47Å; R26-A29 WeakPolarHBondContact O-CB 3.28Å; R26-A29 PolarHBondContact O-N 2.99Å; R27-A29 VanDerWaalsContact C-N 3.3Å; R27-A29 PolarHBondContact O-N 3.13Å; A29-F32 PolarHBondContact O-N 3.34Å; A29-L33 WeakPolarHBondContact O-CG 3.38Å; A29-L33 PolarHBondContact O-N 2.96Å
30E83.1Confident85.2Confident81 Ų8173.9 Ų73.938%0.37939%0.394SS..Hα-helixtrans-58.4-50.6172.5-69.8168.1172.700110.9T18 R26 F32 L33 E34T18-E30 HydrophobicContact CG2-CG 4.13Å; R26-E30 HydrophobicContact CG-CG 4.46Å; R26-E30 WeakPolarHBondContact CG-OE1 3.39Å; R26-E30 IonicContact NE-OE1 3.35Å; R26-E30 PolarHBondContact O-N 3.23Å; E30-F32 VanDerWaalsContact C-N 3.27Å; E30-F32 PolarHBondContact O-N 3.47Å; E30-L33 PolarHBondContact O-N 2.88Å; E30-L33 VanDerWaalsContact O-N 3.15Å; E30-E34 WeakPolarHBondContact O-CG 3.21Å; E30-E34 PolarHBondContact O-N 3.28Å
31K84.1Confident85.3Confident149 Ų14973 Ų7365%0.64839%0.389SS*.Hα-helixtrans-58.2-37.9176.5-75.7-174.6177.8-173.60112.9R27 S35R27-K31 WeakPolarHBondContact O-CG 3.38Å; R27-K31 PolarHBondContact O-N 3.25Å; R27-K31 VanDerWaalsContact O-N 3.09Å; K31-S35 WeakPolarHBondContact O-CB 3.46Å; K31-S35 PolarHBondContact O-N 2.85Å
32F89.7Confident85.8Confident63 Ų6367.5 Ų67.528%0.27635%0.353SS..Hα-helixtrans-65-49176.3175.6-94.3000111.1T10 F14 P28 A29 E30 E34 S35 V36T10-F32 HydrophobicContact CG2-CE1 4.33Å; T10-F32 HydrophobicContact CG2-CZ 4.23Å; F14-F32 HydrophobicContact CB-CD1 4.05Å; F14-F32 HydrophobicContact CB-CE1 4.43Å; F14-F32 HydrophobicContact CD1-CB 3.87Å; F14-F32 AromaticContact CD1-CD1 3.49Å; F14-F32 HydrophobicContact CD1-CD1 3.49Å; F14-F32 VanDerWaalsContact CD1-CD1 3.49Å; F14-F32 HydrophobicContact CD1-CE1 4.26Å; F14-F32 AromaticContact CD1-CG 3.81Å; F14-F32 HydrophobicContact CD1-CG 3.81Å; F14-F32 AromaticContact CD2-CD1 3.44Å; F14-F32 HydrophobicContact CD2-CD1 3.44Å; F14-F32 VanDerWaalsContact CD2-CD1 3.44Å; F14-F32 AromaticContact CD2-CE1 3.32Å; F14-F32 HydrophobicContact CD2-CE1 3.32Å; F14-F32 HydrophobicContact CD2-CG 4.26Å; F14-F32 HydrophobicContact CD2-CZ 4.07Å; F14-F32 HydrophobicContact CE1-CB 3.68Å; F14-F32 AromaticContact CE1-CD1 3.66Å; F14-F32 HydrophobicContact CE1-CD1 3.66Å; F14-F32 HydrophobicContact CE1-CD2 4.2Å; F14-F32 HydrophobicContact CE1-CE1 4.36Å; F14-F32 AromaticContact CE1-CG 3.56Å; F14-F32 HydrophobicContact CE1-CG 3.56Å; F14-F32 AromaticContact CE2-CD1 3.62Å; F14-F32 HydrophobicContact CE2-CD1 3.62Å; F14-F32 HydrophobicContact CE2-CD2 4.3Å; F14-F32 AromaticContact CE2-CE1 3.45Å; F14-F32 HydrophobicContact CE2-CE1 3.45Å; F14-F32 VanDerWaalsContact CE2-CE1 3.45Å; F14-F32 HydrophobicContact CE2-CE2 4.16Å; F14-F32 HydrophobicContact CE2-CG 4.04Å; F14-F32 AromaticContact CE2-CZ 3.74Å; F14-F32 HydrophobicContact CE2-CZ 3.74Å; F14-F32 AromaticContact CG-CD1 3.36Å; F14-F32 HydrophobicContact CG-CD1 3.36Å; F14-F32 AromaticContact CG-CE1 3.75Å; F14-F32 HydrophobicContact CG-CE1 3.75Å; F14-F32 HydrophobicContact CG-CG 4.15Å; F14-F32 HydrophobicContact CZ-CB 4.28Å; F14-F32 AromaticContact CZ-CD1 3.72Å; F14-F32 HydrophobicContact CZ-CD1 3.72Å; F14-F32 AromaticContact CZ-CD2 3.92Å; F14-F32 HydrophobicContact CZ-CD2 3.92Å; F14-F32 AromaticContact CZ-CE1 3.98Å; F14-F32 HydrophobicContact CZ-CE1 3.98Å; F14-F32 HydrophobicContact CZ-CE2 4.16Å; F14-F32 AromaticContact CZ-CG 3.68Å; F14-F32 HydrophobicContact CZ-CG 3.68Å; F14-F32 HydrophobicContact CZ-CZ 4.19Å; P28-F32 WeakPolarHBondContact O-CB 3.46Å; P28-F32 PolarHBondContact O-N 2.85Å; A29-F32 PolarHBondContact O-N 3.34Å; E30-F32 VanDerWaalsContact C-N 3.27Å; E30-F32 PolarHBondContact O-N 3.47Å; F32-E34 VanDerWaalsContact C-N 3.29Å; F32-E34 PolarHBondContact O-N 2.98Å; F32-S35 PolarHBondContact O-N 3.16Å; F32-S35 PolarHBondContact O-OG 3.19Å; F32-V36 HydrophobicContact CE1-CG1 4.15Å; F32-V36 HydrophobicContact CE1-CG2 4.28Å; F32-V36 HydrophobicContact CE2-CG1 4Å; F32-V36 HydrophobicContact CZ-CG1 3.8Å; F32-V36 PolarHBondContact O-N 2.88Å; F32-V36 VanDerWaalsContact O-N 3.17Å
33L87.9Confident86.2Confident14 Ų1464.3 Ų64.37%0.07334%0.336CS..Hα-helixtrans-59.1-41.2178.5-69.5174.5000111.5L11 F14 L15 T18 A29 E30 V36 E37L11-L33 HydrophobicContact CD2-CD2 3.85Å; F14-L33 HydrophobicContact CB-CD2 3.99Å; F14-L33 HydrophobicContact CB-CG 4.26Å; L15-L33 HydrophobicContact CD2-CD1 3.98Å; T18-L33 HydrophobicContact CG2-CD1 3.72Å; A29-L33 WeakPolarHBondContact O-CG 3.38Å; A29-L33 PolarHBondContact O-N 2.96Å; E30-L33 PolarHBondContact O-N 2.88Å; E30-L33 VanDerWaalsContact O-N 3.15Å; L33-V36 WeakPolarHBondContact O-CG2 3.45Å; L33-V36 PolarHBondContact O-N 3.4Å; L33-E37 PolarHBondContact O-N 3.08Å; L33-E37 VanDerWaalsContact O-N 3.14Å
34E84.3Confident87Confident117 Ų11762.6 Ų62.655%0.54732%0.324SS..Hα-helixtrans-63.3-38.4173.4-71.1175.6170.100112.4E30 F32 V36 E37E30-E34 WeakPolarHBondContact O-CG 3.21Å; E30-E34 PolarHBondContact O-N 3.28Å; F32-E34 VanDerWaalsContact C-N 3.29Å; F32-E34 PolarHBondContact O-N 2.98Å; E34-V36 VanDerWaalsContact C-N 3.26Å; E34-V36 PolarHBondContact O-N 2.52Å; E34-E37 WeakPolarHBondContact O-CG 3.15Å
35S84.6Confident87.4Confident86 Ų8657.7 Ų57.760%0.60129%0.293SS*.Hα-helixtrans-67.8-26.2179.675.90000113.5K31 F32K31-S35 WeakPolarHBondContact O-CB 3.46Å; K31-S35 PolarHBondContact O-N 2.85Å; F32-S35 PolarHBondContact O-N 3.16Å; F32-S35 PolarHBondContact O-OG 3.19Å
36V87.6Confident87.8Confident17 Ų1755.4 Ų55.410%0.10328%0.279CS..Hα-helixtrans-101.2-9.6-177-58.70000113.7M1 F32 L33 E34 G38 N39 Y42M1-V36 HydrophobicContact SD-CB 4.2Å; F32-V36 HydrophobicContact CE1-CG1 4.15Å; F32-V36 HydrophobicContact CE1-CG2 4.28Å; F32-V36 HydrophobicContact CE2-CG1 4Å; F32-V36 HydrophobicContact CZ-CG1 3.8Å; F32-V36 PolarHBondContact O-N 2.88Å; F32-V36 VanDerWaalsContact O-N 3.17Å; L33-V36 WeakPolarHBondContact O-CG2 3.45Å; L33-V36 PolarHBondContact O-N 3.4Å; E34-V36 VanDerWaalsContact C-N 3.26Å; E34-V36 PolarHBondContact O-N 2.52Å; V36-G38 PolarHBondContact O-N 3.21Å; V36-N39 WeakPolarHBondContact CA-ND2 3.33Å; V36-N39 WeakPolarHBondContact O-CB 3.25Å; V36-N39 PolarHBondContact O-N 3.31Å; V36-N39 VanDerWaalsContact O-N 3.14Å; V36-N39 PolarHBondContact O-ND2 2.79Å; V36-Y42 HydrophobicContact CG2-CD2 4.24Å; V36-Y42 HydrophobicContact CG2-CE2 3.94Å
37E86.6Confident88.1Confident13 Ų1351.4 Ų51.46%0.06127%0.265CS..THydrogen-bonded Turntrans-66-21.9-174.282.8175.2-169.600113.5L33 E34 N39 Y42 Y69 R72 N73 K83L33-E37 PolarHBondContact O-N 3.08Å; L33-E37 VanDerWaalsContact O-N 3.14Å; E34-E37 WeakPolarHBondContact O-CG 3.15Å; E37-N39 PolarHBondContact O-N 3.13Å; E37-Y42 HydrophobicContact CB-CD1 4.15Å; E37-Y42 HydrophobicContact CB-CE1 3.9Å; E37-Y69 HydrophobicContact CB-CD2 3.86Å; E37-Y69 HydrophobicContact CB-CE2 3.68Å; E37-Y69 HydrophobicContact CG-CD2 4.23Å; E37-Y69 HydrophobicContact CG-CE2 3.97Å; E37-Y69 WeakPolarHBondContact O-CE2 3.41Å; E37-Y69 PolarHBondContact O-OH 3.35Å; E37-R72 IonicContact OE1-NE 3.81Å; E37-R72 IonicContact OE2-CZ 3.23Å; E37-R72 IonicContact OE2-NE 2.81Å; E37-R72 IonicContact OE2-NH2 3.96Å; E37-R72 PolarHBondContact OE2-NH2 3.25Å; E37-N73 PolarHBondContact OE1-ND2 2.94Å; E37-K83 IonicContact OE1-NZ 3.48Å
38G82.9Confident88.7Confident48 Ų4844.3 Ų44.350%0.49524%0.24SC..THydrogen-bonded Turntrans-77.1-2.2176.300000114.8V36V36-G38 PolarHBondContact O-N 3.21Å
39N87.6Confident88.9Confident67 Ų6741.2 Ų41.236%0.35822%0.22SC..SBendtrans-82.3137.3179.6-69.3-55.3000112M1 V36 E37 Y42M1-N39 HydrophobicContact CB-CB 4.33Å; M1-N39 HydrophobicContact CG-CB 3.77Å; M1-N39 HydrophobicContact SD-CB 4.28Å; V36-N39 WeakPolarHBondContact CA-ND2 3.33Å; V36-N39 WeakPolarHBondContact O-CB 3.25Å; V36-N39 PolarHBondContact O-N 3.31Å; V36-N39 VanDerWaalsContact O-N 3.14Å; V36-N39 PolarHBondContact O-ND2 2.79Å; E37-N39 PolarHBondContact O-N 3.13Å; N39-Y42 WeakPolarHBondContact O-CB 3.36Å; N39-Y42 PolarHBondContact O-N 2.8Å
40Q88.1Confident89Confident106 Ų10641.1 Ų41.150%0.49522%0.219SC..THydrogen-bonded Turntrans-52.6144.4172-169.6176.5600112.1M1 Y42 D88M1-Q40 PolarHBondContact N-O 3.06Å; M1-Q40 VanDerWaalsContact O-O 3.09Å; Q40-Y42 PolarHBondContact O-N 3.27Å; Q40-D88 WeakPolarHBondContact CG-OD2 3.42Å
41N91.8Very high89.2Confident42 Ų4243.8 Ų43.823%0.22523%0.231CC..THydrogen-bonded Turntrans65-0.1-174.2-42.7-56.9000116.7M1 L44 L45 D88M1-N41 WeakPolarHBondContact O-CB 3.47Å; M1-N41 PolarHBondContact O-ND2 2.85Å; N41-L44 HydrophobicContact CB-CB 4.41Å; N41-L44 HydrophobicContact CB-CD1 4.44Å; N41-L44 PolarHBondContact O-N 2.82Å; N41-L44 VanDerWaalsContact O-N 3.09Å; N41-L45 PolarHBondContact O-N 3.32Å; N41-D88 VanDerWaalsContact CA-OD1 3.31Å; N41-D88 WeakPolarHBondContact CA-OD1 3.22Å; N41-D88 PolarHBondContact N-OD1 3.07Å; N41-D88 PolarHBondContact N-OD2 3.16Å; N41-D88 PolarHBondContact OD1-OD1 2.99Å
42Y92.2Very high89.4Confident1 Ų143.3 Ų43.30%0.00423%0.229CC..Hα-helixtrans-49.8-50.2171.6175.7-96.5000113.3L11 V36 E37 N39 Q40 L44 L45 L46 T65 Y69L11-Y42 HydrophobicContact CD2-CD2 4.29Å; L11-Y42 HydrophobicContact CD2-CE2 3.72Å; V36-Y42 HydrophobicContact CG2-CD2 4.24Å; V36-Y42 HydrophobicContact CG2-CE2 3.94Å; E37-Y42 HydrophobicContact CB-CD1 4.15Å; E37-Y42 HydrophobicContact CB-CE1 3.9Å; N39-Y42 WeakPolarHBondContact O-CB 3.36Å; N39-Y42 PolarHBondContact O-N 2.8Å; Q40-Y42 PolarHBondContact O-N 3.27Å; Y42-L44 VanDerWaalsContact C-N 3.29Å; Y42-L44 PolarHBondContact O-N 3.46Å; Y42-L45 WeakPolarHBondContact O-CB 3.41Å; Y42-L45 PolarHBondContact O-N 3Å; Y42-L46 HydrophobicContact CD1-CD1 4.27Å; Y42-L46 HydrophobicContact CE1-CD1 3.63Å; Y42-L46 HydrophobicContact CE1-CG 4.38Å; Y42-L46 PolarHBondContact O-N 2.97Å; Y42-T65 WeakPolarHBondContact OH-CG2 3.33Å; Y42-Y69 HydrophobicContact CD1-CD2 4.02Å; Y42-Y69 HydrophobicContact CD1-CE1 4.44Å; Y42-Y69 AromaticContact CD1-CE2 3.87Å; Y42-Y69 HydrophobicContact CD1-CE2 3.87Å; Y42-Y69 HydrophobicContact CD1-CG 4.36Å; Y42-Y69 AromaticContact CE1-CD2 3.84Å; Y42-Y69 HydrophobicContact CE1-CD2 3.84Å; Y42-Y69 HydrophobicContact CE1-CE2 4.15Å; Y42-Y69 HydrophobicContact CE1-CG 4.14Å
43P92.8Very high89.1Confident0 Ų041.6 Ų41.60%023%0.225CC..Hα-helixtrans-64.8-32.3177.324.3-34.7000113.1L46 L47 F66 Y69 D88 I92P43-L46 WeakPolarHBondContact O-CB 3.17Å; P43-L46 PolarHBondContact O-N 3.39Å; P43-L47 WeakPolarHBondContact O-CG 3.4Å; P43-L47 PolarHBondContact O-N 2.98Å; P43-F66 HydrophobicContact CB-CD2 4.19Å; P43-F66 HydrophobicContact CB-CE2 3.9Å; P43-Y69 HydrophobicContact CB-CD1 4.09Å; P43-Y69 HydrophobicContact CB-CE1 3.78Å; P43-Y69 HydrophobicContact CG-CE1 3.84Å; P43-D88 HydrophobicContact CG-CB 4.21Å; P43-I92 HydrophobicContact CB-CD1 3.73Å; P43-I92 HydrophobicContact CB-CG1 4.43Å; P43-I92 HydrophobicContact CG-CD1 3.81Å
44L93.2Very high88.8Confident25 Ų2550.4 Ų50.413%0.13127%0.266CS..Hα-helixtrans-70.4-33.8177.4-60.2-178.2000112.1L3 N41 Y42 L46 L47 T48 D88 A91 I92L3-L44 HydrophobicContact CD1-CB 3.72Å; N41-L44 HydrophobicContact CB-CB 4.41Å; N41-L44 HydrophobicContact CB-CD1 4.44Å; N41-L44 PolarHBondContact O-N 2.82Å; N41-L44 VanDerWaalsContact O-N 3.09Å; Y42-L44 VanDerWaalsContact C-N 3.29Å; Y42-L44 PolarHBondContact O-N 3.46Å; L44-L46 VanDerWaalsContact C-N 3.33Å; L44-L47 HydrophobicContact CD2-CD1 4.4Å; L44-L47 PolarHBondContact O-N 3.45Å; L44-T48 WeakPolarHBondContact O-CB 3.3Å; L44-T48 PolarHBondContact O-N 3.4Å; L44-T48 PolarHBondContact O-OG1 3.31Å; L44-D88 WeakPolarHBondContact CD1-OD1 3.18Å; L44-A91 HydrophobicContact CD1-CB 3.96Å; L44-A91 HydrophobicContact CD2-CB 3.75Å; L44-A91 HydrophobicContact CG-CB 4.49Å; L44-I92 HydrophobicContact CD2-CG1 3.96Å
45L92.8Very high88.9Confident0 Ų047.8 Ų47.80%026%0.256CS..Hα-helixtrans-61.9-42170.9-76.2164.8000111.1M1 L3 N7 L8 L11 N41 Y42 T48 L49M1-L45 HydrophobicContact CB-CD1 3.91Å; M1-L45 HydrophobicContact CE-CD1 3.89Å; M1-L45 HydrophobicContact SD-CD1 4.45Å; L3-L45 HydrophobicContact CG-CD2 4.09Å; N7-L45 HydrophobicContact CB-CD1 4.1Å; N7-L45 HydrophobicContact CB-CD2 4.2Å; L8-L45 HydrophobicContact CD2-CB 4.34Å; L8-L45 HydrophobicContact CD2-CD2 3.55Å; L8-L45 HydrophobicContact CG-CD2 3.79Å; L11-L45 HydrophobicContact CD1-CB 3.62Å; L11-L45 HydrophobicContact CD1-CD1 3.87Å; L11-L45 HydrophobicContact CD1-CG 4.29Å; N41-L45 PolarHBondContact O-N 3.32Å; Y42-L45 WeakPolarHBondContact O-CB 3.41Å; Y42-L45 PolarHBondContact O-N 3Å; L45-T48 PolarHBondContact O-N 2.85Å; L45-L49 WeakPolarHBondContact O-CG 3.48Å; L45-L49 PolarHBondContact O-N 3.49Å
46L93.9Very high89Confident0 Ų048.4 Ų48.40%025%0.252CS..Hα-helixtrans-63-45.2175.1-64.3176000111.7L15 Y42 P43 L44 T48 L49 L50 A62 T65 F66L15-L46 HydrophobicContact CD1-CD2 4.32Å; Y42-L46 HydrophobicContact CD1-CD1 4.27Å; Y42-L46 HydrophobicContact CE1-CD1 3.63Å; Y42-L46 HydrophobicContact CE1-CG 4.38Å; Y42-L46 PolarHBondContact O-N 2.97Å; P43-L46 WeakPolarHBondContact O-CB 3.17Å; P43-L46 PolarHBondContact O-N 3.39Å; L44-L46 VanDerWaalsContact C-N 3.33Å; L46-T48 VanDerWaalsContact C-N 3.31Å; L46-T48 PolarHBondContact O-N 2.75Å; L46-L49 PolarHBondContact O-N 3.38Å; L46-L50 WeakPolarHBondContact O-CG 3.42Å; L46-L50 PolarHBondContact O-N 2.9Å; L46-L50 VanDerWaalsContact O-N 3.1Å; L46-A62 HydrophobicContact CD2-CB 4.41Å; L46-T65 HydrophobicContact CD1-CG2 3.96Å; L46-T65 HydrophobicContact CD2-CG2 4.35Å; L46-F66 HydrophobicContact CB-CB 4.18Å; L46-F66 HydrophobicContact CB-CD2 4.29Å; L46-F66 HydrophobicContact CD1-CB 4.01Å; L46-F66 HydrophobicContact CD1-CD2 4.48Å
47L93.6Very high89.1Confident10 Ų1051.4 Ų51.45%0.05227%0.27CS..Hα-helixtrans-62.2-37.8174.9-65.5-176.3000112.3P43 L44 L50 E51 F66 I92 L99 L111P43-L47 WeakPolarHBondContact O-CG 3.4Å; P43-L47 PolarHBondContact O-N 2.98Å; L44-L47 HydrophobicContact CD2-CD1 4.4Å; L44-L47 PolarHBondContact O-N 3.45Å; L47-L50 HydrophobicContact CD2-CD1 4Å; L47-L50 WeakPolarHBondContact O-CB 3.39Å; L47-L50 PolarHBondContact O-N 3.15Å; L47-E51 PolarHBondContact O-N 3.13Å; L47-F66 HydrophobicContact CD1-CE2 4.06Å; L47-F66 HydrophobicContact CD1-CZ 4.21Å; L47-F66 HydrophobicContact CD2-CD1 4.14Å; L47-F66 HydrophobicContact CD2-CD2 3.9Å; L47-F66 HydrophobicContact CD2-CE1 3.97Å; L47-F66 HydrophobicContact CD2-CE2 3.71Å; L47-F66 HydrophobicContact CD2-CG 4.12Å; L47-F66 HydrophobicContact CD2-CZ 3.76Å; L47-F66 HydrophobicContact CG-CD2 4.1Å; L47-F66 HydrophobicContact CG-CE2 3.75Å; L47-F66 HydrophobicContact CG-CZ 4.17Å; L47-I92 HydrophobicContact CD1-CG1 4.16Å; L47-L99 HydrophobicContact CB-CD2 4.35Å; L47-L99 HydrophobicContact CD2-CD2 3.94Å; L47-L111 HydrophobicContact CD2-CD2 4.33Å
48T91.9Very high89.2Confident16 Ų1651 Ų5110%0.09827%0.268CS..Hα-helixtrans-67.5-37.8176.5-55.70000111.6L3 L8 L44 L45 L46 L50 E51 K52L3-T48 HydrophobicContact CD2-CG2 4.33Å; L8-T48 HydrophobicContact CD1-CG2 4.12Å; L8-T48 HydrophobicContact CD2-CG2 4.18Å; L44-T48 WeakPolarHBondContact O-CB 3.3Å; L44-T48 PolarHBondContact O-N 3.4Å; L44-T48 PolarHBondContact O-OG1 3.31Å; L45-T48 PolarHBondContact O-N 2.85Å; L46-T48 VanDerWaalsContact C-N 3.31Å; L46-T48 PolarHBondContact O-N 2.75Å; T48-L50 VanDerWaalsContact C-N 3.29Å; T48-L50 PolarHBondContact O-N 3.45Å; T48-E51 PolarHBondContact O-N 3.11Å; T48-K52 HydrophobicContact CG2-CD 3.76Å; T48-K52 HydrophobicContact CG2-CG 4.17Å; T48-K52 WeakPolarHBondContact O-CB 3.1Å; T48-K52 PolarHBondContact O-N 3.34Å
49L91.9Very high89.7Confident9 Ų950.6 Ų50.65%0.04725%0.252CS..Hα-helixtrans-63-36.9173.7-74.7174000111.7L8 L11 T12 L15 L45 L46 E51 S53 A62L8-L49 HydrophobicContact CB-CD2 4.07Å; L8-L49 HydrophobicContact CD2-CD2 3.71Å; L8-L49 HydrophobicContact CD2-CG 3.66Å; L8-L49 HydrophobicContact CG-CD2 4.47Å; L11-L49 HydrophobicContact CB-CD1 4.02Å; T12-L49 WeakPolarHBondContact OG1-CD2 3.43Å; L15-L49 HydrophobicContact CD1-CD1 4.15Å; L45-L49 WeakPolarHBondContact O-CG 3.48Å; L45-L49 PolarHBondContact O-N 3.49Å; L46-L49 PolarHBondContact O-N 3.38Å; L49-E51 VanDerWaalsContact C-N 3.29Å; L49-E51 PolarHBondContact O-N 3.06Å; L49-S53 WeakPolarHBondContact O-CB 3.28Å; L49-S53 PolarHBondContact O-N 3.23Å; L49-A62 HydrophobicContact CB-CB 4.19Å
50L89.4Confident89.8Confident0 Ų048.7 Ų48.70%024%0.243CC..Hα-helixtrans-62.4-37.1175.6-69.6174.1000113.2L46 L47 T48 R59 A62 A63 L99 I107 L111L46-L50 WeakPolarHBondContact O-CG 3.42Å; L46-L50 PolarHBondContact O-N 2.9Å; L46-L50 VanDerWaalsContact O-N 3.1Å; L47-L50 HydrophobicContact CD2-CD1 4Å; L47-L50 WeakPolarHBondContact O-CB 3.39Å; L47-L50 PolarHBondContact O-N 3.15Å; T48-L50 VanDerWaalsContact C-N 3.29Å; T48-L50 PolarHBondContact O-N 3.45Å; L50-R59 HydrophobicContact CD2-CB 4.2Å; L50-R59 WeakPolarHBondContact CD2-O 3.31Å; L50-R59 PolarHBondContact O-NE 3.29Å; L50-R59 PolarHBondContact O-NH2 3.08Å; L50-A62 HydrophobicContact CD2-CB 4Å; L50-A62 HydrophobicContact CG-CB 4.15Å; L50-A63 HydrophobicContact CD1-CB 4.3Å; L50-A63 HydrophobicContact CD2-CB 3.71Å; L50-L99 HydrophobicContact CB-CD2 4Å; L50-L99 HydrophobicContact CD1-CD2 4Å; L50-I107 HydrophobicContact CD2-CG2 4.14Å; L50-L111 HydrophobicContact CD1-CD1 4.47Å; L50-L111 HydrophobicContact CD1-CD2 3.89Å
51E87.1Confident89.9Confident137 Ų13744.5 Ų44.564%0.6423%0.225SC*.Hα-helixtrans-81.2-45.1-178.6-169.4-178.3-172.700112.2L47 T48 L49 L99L47-E51 PolarHBondContact O-N 3.13Å; T48-E51 PolarHBondContact O-N 3.11Å; L49-E51 VanDerWaalsContact C-N 3.29Å; L49-E51 PolarHBondContact O-N 3.06Å; E51-L99 HydrophobicContact CB-CD1 3.98Å; E51-L99 HydrophobicContact CG-CD1 4.33Å
52K86.8Confident90Very high138 Ų13842.5 Ų42.560%0.621%0.214SC*.Hα-helixtrans-97.2-22.8-168.7-64.7-171-179.9177.70115.5T48T48-K52 HydrophobicContact CG2-CD 3.76Å; T48-K52 HydrophobicContact CG2-CG 4.17Å; T48-K52 WeakPolarHBondContact O-CB 3.1Å; T48-K52 PolarHBondContact O-N 3.34Å
53S83.8Confident90Very high27 Ų2742.5 Ų42.519%0.18921%0.214CC..  trans-67.3136.1-177.3-179.20000111L49 D55 R59L49-S53 WeakPolarHBondContact O-CB 3.28Å; L49-S53 PolarHBondContact O-N 3.23Å; S53-D55 PolarHBondContact OG-N 3.44Å; S53-D55 VanDerWaalsContact OG-N 3.14Å; S53-D55 PolarHBondContact OG-O 2.88Å; S53-R59 WeakPolarHBondContact O-CD 3.39Å
54Q82.2Confident89.9Confident200 Ų20044.8 Ų44.894%0.93523%0.228SC*.SBendtrans-84.1-14.5171.4-62.5-166.2-1.600112.7
55D87.1Confident89.9Confident62 Ų6244.8 Ų44.833%0.33223%0.229SC..  trans-90.2110.6178.9-173.1-19.5000110.5S53 V57 I58 R59S53-D55 PolarHBondContact OG-N 3.44Å; S53-D55 VanDerWaalsContact OG-N 3.14Å; S53-D55 PolarHBondContact OG-O 2.88Å; D55-V57 VanDerWaalsContact C-N 3.26Å; D55-V57 PolarHBondContact O-N 3.29Å; D55-V57 WeakPolarHBondContact OD1-CB 3.29Å; D55-V57 PolarHBondContact OD1-N 2.89Å; D55-I58 HydrophobicContact CB-CB 4.15Å; D55-I58 HydrophobicContact CB-CG1 3.96Å; D55-I58 PolarHBondContact O-N 3.33Å; D55-R59 WeakPolarHBondContact O-CG 3.35Å; D55-R59 PolarHBondContact O-N 3.14Å
56N85.8Confident90Very high99 Ų9944.8 Ų44.853%0.52923%0.229SC..Hα-helixtrans-60.8-31.2178.3-83.8-20.4000113.3R59 V60N56-R59 PolarHBondContact O-N 3.43Å; N56-R59 PolarHBondContact OD1-NH1 3.24Å; N56-R59 VanDerWaalsContact OD1-NH1 3.09Å; N56-V60 WeakPolarHBondContact O-CG2 3.3Å; N56-V60 PolarHBondContact O-N 3.38Å
57V88.9Confident89.9Confident80 Ų8046.8 Ų46.849%0.48524%0.238SC..Hα-helixtrans-65.5-45.1177.51790000109.7L19 D55 R59 V60 C61L19-V57 HydrophobicContact CD1-CG1 3.59Å; D55-V57 VanDerWaalsContact C-N 3.26Å; D55-V57 PolarHBondContact O-N 3.29Å; D55-V57 WeakPolarHBondContact OD1-CB 3.29Å; D55-V57 PolarHBondContact OD1-N 2.89Å; V57-R59 VanDerWaalsContact C-N 3.34Å; V57-R59 PolarHBondContact O-N 3.39Å; V57-V60 PolarHBondContact O-N 3.11Å; V57-C61 PolarHBondContact O-N 3.48Å; V57-C61 PolarHBondContact O-SG 3.36Å
58I90.6Very high89.7Confident4 Ų448.7 Ų48.72%0.02125%0.248CC..Hα-helixtrans-64.9-39.4176.7-62.3-60.2000111.1T12 R16 D55 C61 A62T12-I58 HydrophobicContact CG2-CD1 4.07Å; T12-I58 HydrophobicContact CG2-CG1 4.07Å; T12-I58 HydrophobicContact CG2-CG2 4.08Å; R16-I58 HydrophobicContact CB-CD1 4.29Å; D55-I58 HydrophobicContact CB-CB 4.15Å; D55-I58 HydrophobicContact CB-CG1 3.96Å; D55-I58 PolarHBondContact O-N 3.33Å; I58-C61 PolarHBondContact O-N 2.95Å; I58-A62 WeakPolarHBondContact O-CB 3.1Å; I58-A62 PolarHBondContact O-N 2.94Å
59R92.6Very high89.6Confident39 Ų3947.9 Ų47.915%0.14724%0.243CC..Hα-helixtrans-59.7-49.2174.5-64.2172.374.6-160.55.7110.7L50 S53 D55 N56 V57 C61 A62 A63 I107L50-R59 HydrophobicContact CD2-CB 4.2Å; L50-R59 WeakPolarHBondContact CD2-O 3.31Å; L50-R59 PolarHBondContact O-NE 3.29Å; L50-R59 PolarHBondContact O-NH2 3.08Å; S53-R59 WeakPolarHBondContact O-CD 3.39Å; D55-R59 WeakPolarHBondContact O-CG 3.35Å; D55-R59 PolarHBondContact O-N 3.14Å; N56-R59 PolarHBondContact O-N 3.43Å; N56-R59 PolarHBondContact OD1-NH1 3.24Å; N56-R59 VanDerWaalsContact OD1-NH1 3.09Å; V57-R59 VanDerWaalsContact C-N 3.34Å; V57-R59 PolarHBondContact O-N 3.39Å; R59-C61 VanDerWaalsContact C-N 3.34Å; R59-C61 PolarHBondContact O-N 3.26Å; R59-A62 PolarHBondContact O-N 2.94Å; R59-A63 PolarHBondContact O-N 3.39Å; R59-I107 HydrophobicContact CB-CD1 3.63Å
60V89.6Confident89.7Confident28 Ų2847.5 Ų47.517%0.1724%0.241CC..Hα-helixtrans-60.9-43.3177.9174.10000111.5N56 V57 A62 A63 V64 Q106 I107N56-V60 WeakPolarHBondContact O-CG2 3.3Å; N56-V60 PolarHBondContact O-N 3.38Å; V57-V60 PolarHBondContact O-N 3.11Å; V60-A62 PolarHBondContact O-N 3.46Å; V60-A63 PolarHBondContact O-N 3.35Å; V60-V64 HydrophobicContact CG1-CG2 4.44Å; V60-V64 WeakPolarHBondContact O-CG2 3.33Å; V60-V64 PolarHBondContact O-N 3.31Å; V60-Q106 HydrophobicContact CG2-CG 4.15Å; V60-I107 HydrophobicContact CG2-CG1 4.21Å
61C90.1Very high89.5Confident18 Ų1852.1 Ų52.112%0.12226%0.261CS..Hα-helixtrans-61.5-44.5176.9-65.70000112.1L15 V57 I58 R59 A63 V64 T65L15-C61 HydrophobicContact CD2-CB 4.49Å; V57-C61 PolarHBondContact O-N 3.48Å; V57-C61 PolarHBondContact O-SG 3.36Å; I58-C61 PolarHBondContact O-N 2.95Å; R59-C61 VanDerWaalsContact C-N 3.34Å; R59-C61 PolarHBondContact O-N 3.26Å; C61-A63 VanDerWaalsContact C-N 3.29Å; C61-A63 PolarHBondContact O-N 2.96Å; C61-V64 PolarHBondContact O-N 3.28Å; C61-T65 WeakPolarHBondContact O-CB 3.39Å; C61-T65 PolarHBondContact O-N 3.28Å; C61-T65 PolarHBondContact O-OG1 3.12Å
62A93.2Very high89.4Confident0 Ų051.2 Ų51.20%025%0.252CS..Hα-helixtrans-60.7-39.1175.900000111.5L15 L46 L49 L50 I58 R59 V60 F66L15-A62 HydrophobicContact CD1-CB 4.32Å; L46-A62 HydrophobicContact CD2-CB 4.41Å; L49-A62 HydrophobicContact CB-CB 4.19Å; L50-A62 HydrophobicContact CD2-CB 4Å; L50-A62 HydrophobicContact CG-CB 4.15Å; I58-A62 WeakPolarHBondContact O-CB 3.1Å; I58-A62 PolarHBondContact O-N 2.94Å; R59-A62 PolarHBondContact O-N 2.94Å; V60-A62 PolarHBondContact O-N 3.46Å; A62-F66 WeakPolarHBondContact O-CB 3.47Å; A62-F66 PolarHBondContact O-N 2.95Å
63A92.9Very high89.4Confident0 Ų045.1 Ų45.10%023%0.226CC..Hα-helixtrans-66.8-43.3178.300000111.7L50 R59 V60 C61 F66 K67 I107 Q110L50-A63 HydrophobicContact CD1-CB 4.3Å; L50-A63 HydrophobicContact CD2-CB 3.71Å; R59-A63 PolarHBondContact O-N 3.39Å; V60-A63 PolarHBondContact O-N 3.35Å; C61-A63 VanDerWaalsContact C-N 3.29Å; C61-A63 PolarHBondContact O-N 2.96Å; A63-F66 PolarHBondContact O-N 3.41Å; A63-K67 WeakPolarHBondContact O-CB 3.41Å; A63-K67 PolarHBondContact O-N 3.12Å; A63-I107 HydrophobicContact CB-CG2 4.36Å; A63-Q110 HydrophobicContact CB-CB 3.75Å; A63-Q110 HydrophobicContact CB-CG 4.11Å
64V91.4Very high89.7Confident48 Ų4844 Ų4429%0.29122%0.218SC..Hα-helixtrans-65.8-46.6177.7173.40000110.7V60 C61 F66 K67 N68 Q110V60-V64 HydrophobicContact CG1-CG2 4.44Å; V60-V64 WeakPolarHBondContact O-CG2 3.33Å; V60-V64 PolarHBondContact O-N 3.31Å; C61-V64 PolarHBondContact O-N 3.28Å; V64-F66 VanDerWaalsContact C-N 3.34Å; V64-F66 PolarHBondContact O-N 3.49Å; V64-K67 PolarHBondContact O-N 3.36Å; V64-N68 WeakPolarHBondContact O-CB 3.49Å; V64-N68 VanDerWaalsContact O-CG 3.26Å; V64-N68 PolarHBondContact O-N 3Å; V64-N68 PolarHBondContact O-ND2 3.05Å; V64-Q110 HydrophobicContact CG2-CG 4.18Å
65T92.1Very high89.8Confident26 Ų2638.7 Ų38.716%0.1619%0.189CC..Hα-helixtrans-61.4-43.6176.4-60.80000111.1L15 Y42 L46 C61 N68 Y69L15-T65 HydrophobicContact CD2-CG2 4.29Å; L15-T65 WeakPolarHBondContact CD2-OG1 3.23Å; Y42-T65 WeakPolarHBondContact OH-CG2 3.33Å; L46-T65 HydrophobicContact CD1-CG2 3.96Å; L46-T65 HydrophobicContact CD2-CG2 4.35Å; C61-T65 WeakPolarHBondContact O-CB 3.39Å; C61-T65 PolarHBondContact O-N 3.28Å; C61-T65 PolarHBondContact O-OG1 3.12Å; T65-N68 PolarHBondContact O-N 3.3Å; T65-Y69 VanDerWaalsContact O-CB 3.28Å; T65-Y69 WeakPolarHBondContact O-CB 3.21Å; T65-Y69 PolarHBondContact O-N 3.24Å
66F94.6Very high89.5Confident0 Ų040.4 Ų40.40%020%0.197CC..Hα-helixtrans-60.6-50.5176.2176.5-95.6000111.5P43 L46 L47 A62 A63 V64 N68 Y69 I70 I92 I96 L111 A114P43-F66 HydrophobicContact CB-CD2 4.19Å; P43-F66 HydrophobicContact CB-CE2 3.9Å; L46-F66 HydrophobicContact CB-CB 4.18Å; L46-F66 HydrophobicContact CB-CD2 4.29Å; L46-F66 HydrophobicContact CD1-CB 4.01Å; L46-F66 HydrophobicContact CD1-CD2 4.48Å; L47-F66 HydrophobicContact CD1-CE2 4.06Å; L47-F66 HydrophobicContact CD1-CZ 4.21Å; L47-F66 HydrophobicContact CD2-CD1 4.14Å; L47-F66 HydrophobicContact CD2-CD2 3.9Å; L47-F66 HydrophobicContact CD2-CE1 3.97Å; L47-F66 HydrophobicContact CD2-CE2 3.71Å; L47-F66 HydrophobicContact CD2-CG 4.12Å; L47-F66 HydrophobicContact CD2-CZ 3.76Å; L47-F66 HydrophobicContact CG-CD2 4.1Å; L47-F66 HydrophobicContact CG-CE2 3.75Å; L47-F66 HydrophobicContact CG-CZ 4.17Å; A62-F66 WeakPolarHBondContact O-CB 3.47Å; A62-F66 PolarHBondContact O-N 2.95Å; A63-F66 PolarHBondContact O-N 3.41Å; V64-F66 VanDerWaalsContact C-N 3.34Å; V64-F66 PolarHBondContact O-N 3.49Å; F66-N68 VanDerWaalsContact C-N 3.33Å; F66-N68 PolarHBondContact O-N 3.37Å; F66-Y69 WeakPolarHBondContact O-CB 3.37Å; F66-Y69 PolarHBondContact O-N 3.11Å; F66-I70 HydrophobicContact CD1-CG1 4.16Å; F66-I70 HydrophobicContact CD2-CG1 4.45Å; F66-I70 HydrophobicContact CE1-CD1 4.33Å; F66-I70 HydrophobicContact CE1-CG1 3.72Å; F66-I70 HydrophobicContact CE2-CD1 4Å; F66-I70 HydrophobicContact CE2-CG1 4.05Å; F66-I70 HydrophobicContact CG-CG1 4.49Å; F66-I70 HydrophobicContact CZ-CD1 3.75Å; F66-I70 HydrophobicContact CZ-CG1 3.65Å; F66-I70 VanDerWaalsContact O-CG1 3.31Å; F66-I70 WeakPolarHBondContact O-CG1 3.32Å; F66-I70 PolarHBondContact O-N 2.96Å; F66-I92 HydrophobicContact CE2-CD1 4.4Å; F66-I92 HydrophobicContact CE2-CG1 4.36Å; F66-I92 HydrophobicContact CZ-CG1 4.5Å; F66-I92 HydrophobicContact CZ-CG2 3.83Å; F66-I96 HydrophobicContact CE1-CD1 3.65Å; F66-I96 HydrophobicContact CZ-CD1 4.04Å; F66-L111 HydrophobicContact CD1-CD2 4.16Å; F66-L111 HydrophobicContact CE1-CD2 4.36Å; F66-A114 HydrophobicContact CD1-CB 4.1Å; F66-A114 HydrophobicContact CE1-CB 3.81Å
67K93.1Very high88.8Confident41 Ų4138 Ų3818%0.17819%0.186CC..Hα-helixtrans-55.8-47.2176.3179.8-162.770.5-173.40111.7A63 V64 Y69 I70 K71 D113 A114 I117A63-K67 WeakPolarHBondContact O-CB 3.41Å; A63-K67 PolarHBondContact O-N 3.12Å; V64-K67 PolarHBondContact O-N 3.36Å; K67-Y69 VanDerWaalsContact C-N 3.33Å; K67-Y69 PolarHBondContact O-N 3.29Å; K67-I70 PolarHBondContact O-N 3.23Å; K67-K71 WeakPolarHBondContact O-CB 3.33Å; K67-K71 PolarHBondContact O-N 2.89Å; K67-D113 HydrophobicContact CD-CB 3.88Å; K67-D113 HydrophobicContact CG-CB 4.29Å; K67-A114 HydrophobicContact CB-CB 4.39Å; K67-A114 HydrophobicContact CG-CB 4.47Å; K67-I117 HydrophobicContact CG-CD1 4.44Å
68N87.9Confident87.4Confident50 Ų5041.9 Ų41.927%0.26720%0.199SC..Hα-helixtrans-66.1-36.6-179.8-70.6-17.5000112V64 T65 F66 K71 R72V64-N68 WeakPolarHBondContact O-CB 3.49Å; V64-N68 VanDerWaalsContact O-CG 3.26Å; V64-N68 PolarHBondContact O-N 3Å; V64-N68 PolarHBondContact O-ND2 3.05Å; T65-N68 PolarHBondContact O-N 3.3Å; F66-N68 VanDerWaalsContact C-N 3.33Å; F66-N68 PolarHBondContact O-N 3.37Å; N68-K71 PolarHBondContact O-N 2.95Å; N68-R72 WeakPolarHBondContact O-CG 3.41Å; N68-R72 PolarHBondContact O-N 3.14Å; N68-R72 VanDerWaalsContact O-N 3.11Å
69Y91.3Very high85.9Confident0 Ų048.1 Ų48.10%023%0.233CC..Hα-helixtrans-63.3-47.9173.7176.3-99.3000111.9E37 Y42 P43 T65 F66 K67 K71 R72 N73 K83 I84E37-Y69 HydrophobicContact CB-CD2 3.86Å; E37-Y69 HydrophobicContact CB-CE2 3.68Å; E37-Y69 HydrophobicContact CG-CD2 4.23Å; E37-Y69 HydrophobicContact CG-CE2 3.97Å; E37-Y69 WeakPolarHBondContact O-CE2 3.41Å; E37-Y69 PolarHBondContact O-OH 3.35Å; Y42-Y69 HydrophobicContact CD1-CD2 4.02Å; Y42-Y69 HydrophobicContact CD1-CE1 4.44Å; Y42-Y69 AromaticContact CD1-CE2 3.87Å; Y42-Y69 HydrophobicContact CD1-CE2 3.87Å; Y42-Y69 HydrophobicContact CD1-CG 4.36Å; Y42-Y69 AromaticContact CE1-CD2 3.84Å; Y42-Y69 HydrophobicContact CE1-CD2 3.84Å; Y42-Y69 HydrophobicContact CE1-CE2 4.15Å; Y42-Y69 HydrophobicContact CE1-CG 4.14Å; P43-Y69 HydrophobicContact CB-CD1 4.09Å; P43-Y69 HydrophobicContact CB-CE1 3.78Å; P43-Y69 HydrophobicContact CG-CE1 3.84Å; T65-Y69 VanDerWaalsContact O-CB 3.28Å; T65-Y69 WeakPolarHBondContact O-CB 3.21Å; T65-Y69 PolarHBondContact O-N 3.24Å; F66-Y69 WeakPolarHBondContact O-CB 3.37Å; F66-Y69 PolarHBondContact O-N 3.11Å; K67-Y69 VanDerWaalsContact C-N 3.33Å; K67-Y69 PolarHBondContact O-N 3.29Å; Y69-K71 VanDerWaalsContact C-N 3.32Å; Y69-K71 PolarHBondContact O-N 3.19Å; Y69-R72 PolarHBondContact O-N 2.94Å; Y69-N73 WeakPolarHBondContact CD2-ND2 3.27Å; Y69-N73 HydrophobicContact CE2-CB 4.33Å; Y69-N73 WeakPolarHBondContact CE2-ND2 3.39Å; Y69-N73 WeakPolarHBondContact O-CB 3.3Å; Y69-N73 PolarHBondContact O-N 2.63Å; Y69-N73 PolarHBondContact O-ND2 3.24Å; Y69-K83 PolarHBondContact OH-O 3.28Å; Y69-I84 HydrophobicContact CD1-CD1 4.41Å; Y69-I84 HydrophobicContact CE1-CD1 3.72Å; Y69-I84 HydrophobicContact CE1-CG1 3.89Å
70I92.6Very high84.6Confident0 Ų052.4 Ų52.40%025%0.254CS..Hα-helixtrans-58.9-45.5174.9-64.8-64.1000110.3F66 K67 R72 N73 W74 I84 I92 I117 I118F66-I70 HydrophobicContact CD1-CG1 4.16Å; F66-I70 HydrophobicContact CD2-CG1 4.45Å; F66-I70 HydrophobicContact CE1-CD1 4.33Å; F66-I70 HydrophobicContact CE1-CG1 3.72Å; F66-I70 HydrophobicContact CE2-CD1 4Å; F66-I70 HydrophobicContact CE2-CG1 4.05Å; F66-I70 HydrophobicContact CG-CG1 4.49Å; F66-I70 HydrophobicContact CZ-CD1 3.75Å; F66-I70 HydrophobicContact CZ-CG1 3.65Å; F66-I70 VanDerWaalsContact O-CG1 3.31Å; F66-I70 WeakPolarHBondContact O-CG1 3.32Å; F66-I70 PolarHBondContact O-N 2.96Å; K67-I70 PolarHBondContact O-N 3.23Å; I70-R72 VanDerWaalsContact C-N 3.28Å; I70-R72 PolarHBondContact O-N 3.45Å; I70-N73 PolarHBondContact O-N 3.3Å; I70-W74 HydrophobicContact CD1-CE3 3.48Å; I70-W74 VanDerWaalsContact CD1-CE3 3.48Å; I70-W74 HydrophobicContact CD1-CZ3 3.78Å; I70-W74 HydrophobicContact CG2-CB 3.99Å; I70-W74 HydrophobicContact CG2-CD2 4.49Å; I70-W74 HydrophobicContact CG2-CE3 4.38Å; I70-W74 HydrophobicContact CG2-CG 4.35Å; I70-W74 WeakPolarHBondContact O-CB 2.9Å; I70-W74 PolarHBondContact O-N 3.03Å; I70-I84 HydrophobicContact CD1-CD1 4.47Å; I70-I92 HydrophobicContact CD1-CD1 4.26Å; I70-I117 HydrophobicContact CG2-CB 4.13Å; I70-I117 HydrophobicContact CG2-CG2 3.86Å; I70-I118 HydrophobicContact CD1-CD1 4.4Å; I70-I118 HydrophobicContact CG2-CD1 4.24Å; I70-I118 HydrophobicContact CG2-CG1 3.67Å
71K86.4Confident83.6Confident98 Ų9856.1 Ų56.143%0.42628%0.279SS..Hα-helixtrans-55.8-40.7177.4-169.2-178.4172.3-1690113K67 N68 Y69 I117 P897K67-K71 WeakPolarHBondContact O-CB 3.33Å; K67-K71 PolarHBondContact O-N 2.89Å; N68-K71 PolarHBondContact O-N 2.95Å; Y69-K71 VanDerWaalsContact C-N 3.32Å; Y69-K71 PolarHBondContact O-N 3.19Å; K71-I117 HydrophobicContact CB-CD1 3.9Å; K71-I117 HydrophobicContact CG-CD1 4.22Å; K71-P897 PolarHBondContact NZ-O 3.37Å
72R84.4Confident83Confident117 Ų11758.9 Ų58.944%0.44229%0.292SS..Hα-helixtrans-80.3-36.6-178.3-70.4-172.4-59.7-99.23113.6E37 N68 Y69 I70E37-R72 IonicContact OE1-NE 3.81Å; E37-R72 IonicContact OE2-CZ 3.23Å; E37-R72 IonicContact OE2-NE 2.81Å; E37-R72 IonicContact OE2-NH2 3.96Å; E37-R72 PolarHBondContact OE2-NH2 3.25Å; N68-R72 WeakPolarHBondContact O-CG 3.41Å; N68-R72 PolarHBondContact O-N 3.14Å; N68-R72 VanDerWaalsContact O-N 3.11Å; Y69-R72 PolarHBondContact O-N 2.94Å; I70-R72 VanDerWaalsContact C-N 3.28Å; I70-R72 PolarHBondContact O-N 3.45Å
73N87.3Confident82.4Confident11 Ų1163.4 Ų63.46%0.05931%0.312CS..Hα-helixtrans-120.7-5.4-160-60.2-49.6000114.1E37 Y69 I70 K83 I84E37-N73 PolarHBondContact OE1-ND2 2.94Å; Y69-N73 WeakPolarHBondContact CD2-ND2 3.27Å; Y69-N73 HydrophobicContact CE2-CB 4.33Å; Y69-N73 WeakPolarHBondContact CE2-ND2 3.39Å; Y69-N73 WeakPolarHBondContact O-CB 3.3Å; Y69-N73 PolarHBondContact O-N 2.63Å; Y69-N73 PolarHBondContact O-ND2 3.24Å; I70-N73 PolarHBondContact O-N 3.3Å; N73-K83 HydrophobicContact CB-CB 4.26Å; N73-K83 WeakPolarHBondContact OD1-CD 3.26Å; N73-I84 HydrophobicContact CB-CD1 3.91Å; N73-I84 HydrophobicContact CB-CG1 3.91Å; N73-I84 WeakPolarHBondContact O-CD1 3.13Å
74W89.9Confident82.2Confident2 Ų263.4 Ų63.41%0.00831%0.312CS..SBendtrans-75-37-179.3-164.1-91.6000113.3I70 I84 R89 I92 K93 I118 D122I70-W74 HydrophobicContact CD1-CE3 3.48Å; I70-W74 VanDerWaalsContact CD1-CE3 3.48Å; I70-W74 HydrophobicContact CD1-CZ3 3.78Å; I70-W74 HydrophobicContact CG2-CB 3.99Å; I70-W74 HydrophobicContact CG2-CD2 4.49Å; I70-W74 HydrophobicContact CG2-CE3 4.38Å; I70-W74 HydrophobicContact CG2-CG 4.35Å; I70-W74 WeakPolarHBondContact O-CB 2.9Å; I70-W74 PolarHBondContact O-N 3.03Å; W74-I84 HydrophobicContact CE3-CD1 3.77Å; W74-I84 HydrophobicContact CZ3-CD1 4.44Å; W74-R89 HydrophobicContact CH2-CB 3.82Å; W74-R89 HydrophobicContact CH2-CG 3.86Å; W74-R89 HydrophobicContact CZ2-CB 4.25Å; W74-R89 HydrophobicContact CZ2-CG 4.21Å; W74-R89 HydrophobicContact CZ3-CB 4.38Å; W74-R89 HydrophobicContact CZ3-CG 4.02Å; W74-R89 PolarHBondContact O-NH1 3.03Å; W74-R89 PolarHBondContact O-NH2 2.85Å; W74-I92 HydrophobicContact CH2-CB 4.34Å; W74-I92 HydrophobicContact CH2-CG2 4.22Å; W74-I92 HydrophobicContact CZ3-CB 4.32Å; W74-I92 HydrophobicContact CZ3-CD1 3.79Å; W74-I92 HydrophobicContact CZ3-CG2 4.13Å; W74-K93 HydrophobicContact CH2-CG 4.36Å; W74-K93 HydrophobicContact CZ2-CD 4.39Å; W74-K93 HydrophobicContact CZ2-CG 4.38Å; W74-I118 HydrophobicContact CD2-CG1 3.79Å; W74-I118 HydrophobicContact CD2-CG2 4.48Å; W74-I118 HydrophobicContact CE3-CD1 4.47Å; W74-I118 HydrophobicContact CE3-CG1 4.04Å; W74-I118 HydrophobicContact CG-CG1 4.29Å; W74-I118 HydrophobicContact CH2-CD1 4.19Å; W74-I118 HydrophobicContact CH2-CG1 4.16Å; W74-I118 HydrophobicContact CH2-CG2 4.12Å; W74-I118 HydrophobicContact CZ2-CB 4.25Å; W74-I118 HydrophobicContact CZ2-CD1 4.45Å; W74-I118 HydrophobicContact CZ2-CG1 3.99Å; W74-I118 HydrophobicContact CZ2-CG2 3.4Å; W74-I118 VanDerWaalsContact CZ2-CG2 3.4Å; W74-I118 HydrophobicContact CZ3-CD1 4.22Å; W74-I118 HydrophobicContact CZ3-CG1 4.2Å; W74-D122 PolarHBondContact NE1-OD1 3.46Å
75R84.2Confident82.1Confident90 Ų9062.8 Ų62.834%0.3431%0.31SS..SBendtrans-72.2134.9175.6-173.5173.2-178.4-171.73.6110.1
76I80Confident81.9Confident98 Ų9867 Ų6750%0.50333%0.331SS..  trans-91.4114.7174.2-57.7175.3000107.3
77V71.7Confident81.7Confident49 Ų4969.8 Ų69.830%0.29736%0.355SS..  trans-97.9131.3177.3-176.70000108.6E80V77-E80 HydrophobicContact CB-CB 4.26Å; V77-E80 HydrophobicContact CB-CG 4.26Å; V77-E80 HydrophobicContact CG1-CG 4.26Å; V77-E80 PolarHBondContact O-N 3.4Å
78E59.9Low81.7Confident160 Ų16068 Ų6875%0.74835%0.347SS*.THydrogen-bonded Turntrans-58.6141.4175.8-70.1-171.5169.400110.7E80E78-E80 PolarHBondContact O-N 3.39Å
79D58.2Low81.9Confident136 Ų13666.3 Ų66.373%0.72734%0.337SS*.THydrogen-bonded Turntrans68.72.1-176.8-53.4-44.8000115.8K741D79-K741 IonicContact OD2-NZ 2.68Å; D79-K741 PolarHBondContact OD2-NZ 3.02Å
80E65.9Low82Confident128 Ų12870.6 Ų70.660%0.59836%0.363SS*.SBendtrans-104.7145.1169.8-67.6-163.6173.500113V77 E78 N82V77-E80 HydrophobicContact CB-CB 4.26Å; V77-E80 HydrophobicContact CB-CG 4.26Å; V77-E80 HydrophobicContact CG1-CG 4.26Å; V77-E80 PolarHBondContact O-N 3.4Å; E78-E80 PolarHBondContact O-N 3.39Å; E80-N82 PolarHBondContact O-N 3.36Å
81P68.3Low81.9Confident107 Ų10772 Ų7270%0.69537%0.374SS*.  trans-68.412617627.4-32.3000110.9K83P81-K83 PolarHBondContact O-N 2.99Å
82N77.1Confident82.3Confident75 Ų7567.3 Ų67.340%0.40135%0.354SS..  trans-63.4118.3175.1-177.413.1000110.5E80 I84 R89E80-N82 PolarHBondContact O-N 3.36Å; N82-I84 PolarHBondContact ND2-O 3.14Å; N82-I84 VanDerWaalsContact ND2-O 3.07Å; N82-I84 PolarHBondContact OD1-N 3.23Å; N82-I84 PolarHBondContact OD1-O 2.64Å; N82-I84 VanDerWaalsContact OD1-O 3.08Å; N82-R89 PolarHBondContact OD1-NH2 3.08Å
83K81.2Confident82.7Confident95 Ų9563.1 Ų63.141%0.41334%0.339SS..  trans-88.7-13.8-176.7-71173.5174.8-177.90114.1E37 Y69 N73 P81E37-K83 IonicContact OE1-NZ 3.48Å; Y69-K83 PolarHBondContact OH-O 3.28Å; N73-K83 HydrophobicContact CB-CB 4.26Å; N73-K83 WeakPolarHBondContact OD1-CD 3.26Å; P81-K83 PolarHBondContact O-N 2.99Å
84I88.2Confident82.8Confident1 Ų165.6 Ų65.61%0.00536%0.361CS..SBendtrans-115.1118.6178-49.1-176.1000109.4Y69 I70 N73 W74 N82 D88 R89Y69-I84 HydrophobicContact CD1-CD1 4.41Å; Y69-I84 HydrophobicContact CE1-CD1 3.72Å; Y69-I84 HydrophobicContact CE1-CG1 3.89Å; I70-I84 HydrophobicContact CD1-CD1 4.47Å; N73-I84 HydrophobicContact CB-CD1 3.91Å; N73-I84 HydrophobicContact CB-CG1 3.91Å; N73-I84 WeakPolarHBondContact O-CD1 3.13Å; W74-I84 HydrophobicContact CE3-CD1 3.77Å; W74-I84 HydrophobicContact CZ3-CD1 4.44Å; N82-I84 PolarHBondContact ND2-O 3.14Å; N82-I84 VanDerWaalsContact ND2-O 3.07Å; N82-I84 PolarHBondContact OD1-N 3.23Å; N82-I84 PolarHBondContact OD1-O 2.64Å; N82-I84 VanDerWaalsContact OD1-O 3.08Å; I84-D88 HydrophobicContact CG2-CB 3.89Å; I84-R89 HydrophobicContact CB-CG 4.33Å; I84-R89 HydrophobicContact CG2-CG 3.69Å; I84-R89 PolarHBondContact O-NE 3.43Å
85S89.2Confident82.8Confident34 Ų3469.8 Ų69.824%0.23838%0.383CS..  trans-64.2149.7177.976.20000112A87 D88 R89S85-A87 PolarHBondContact O-N 3.45Å; S85-D88 PolarHBondContact O-N 3.38Å; S85-D88 VanDerWaalsContact O-N 3.08Å; S85-D88 WeakPolarHBondContact OG-CB 3.33Å; S85-D88 PolarHBondContact OG-N 3.1Å; S85-D88 VanDerWaalsContact OG-N 3.13Å; S85-D88 PolarHBondContact OG-OD2 3.46Å; S85-R89 WeakPolarHBondContact O-CG 3.45Å; S85-R89 PolarHBondContact O-N 3.05Å
86D87.9Confident83.1Confident115 Ų11565.5 Ų65.562%0.61537%0.367SS*.Hα-helixtrans-61.4-31.4178.2-66.1-34.6000112.7R89 T90D86-R89 PolarHBondContact O-N 2.88Å; D86-T90 PolarHBondContact O-N 3.34Å; D86-T90 VanDerWaalsContact O-N 3.07Å; D86-T90 PolarHBondContact O-OG1 2.99Å
87A90.8Very high83.3Confident59 Ų5961 Ų6149%0.48835%0.345SS..Hα-helixtrans-63.8-46.317300000111.6S85 T90 A91S85-A87 PolarHBondContact O-N 3.45Å; A87-T90 PolarHBondContact O-N 3.25Å; A87-A91 WeakPolarHBondContact O-CB 3.49Å; A87-A91 PolarHBondContact O-N 3.48Å
88D93.2Very high83.9Confident2 Ų261.8 Ų61.81%0.01135%0.347CS..Hα-helixtrans-63.7-42.6176.4-70.5-40.8000111Q40 N41 P43 L44 I84 S85 T90 A91 I92Q40-D88 WeakPolarHBondContact CG-OD2 3.42Å; N41-D88 VanDerWaalsContact CA-OD1 3.31Å; N41-D88 WeakPolarHBondContact CA-OD1 3.22Å; N41-D88 PolarHBondContact N-OD1 3.07Å; N41-D88 PolarHBondContact N-OD2 3.16Å; N41-D88 PolarHBondContact OD1-OD1 2.99Å; P43-D88 HydrophobicContact CG-CB 4.21Å; L44-D88 WeakPolarHBondContact CD1-OD1 3.18Å; I84-D88 HydrophobicContact CG2-CB 3.89Å; S85-D88 PolarHBondContact O-N 3.38Å; S85-D88 VanDerWaalsContact O-N 3.08Å; S85-D88 WeakPolarHBondContact OG-CB 3.33Å; S85-D88 PolarHBondContact OG-N 3.1Å; S85-D88 VanDerWaalsContact OG-N 3.13Å; S85-D88 PolarHBondContact OG-OD2 3.46Å; D88-T90 VanDerWaalsContact C-N 3.31Å; D88-T90 PolarHBondContact O-N 2.81Å; D88-A91 PolarHBondContact O-N 3.43Å; D88-I92 HydrophobicContact CB-CD1 4.48Å; D88-I92 WeakPolarHBondContact O-CB 3.36Å; D88-I92 VanDerWaalsContact O-CD1 3.3Å; D88-I92 WeakPolarHBondContact O-CD1 3.45Å; D88-I92 WeakPolarHBondContact O-CG1 3.47Å; D88-I92 PolarHBondContact O-N 3.37Å
89R93.1Very high85.3Confident15 Ų1555 Ų556%0.05732%0.316CS..Hα-helixtrans-57.3-45.3177-70.5177.3177.3-94.1-0112W74 N82 I84 S85 D86 K93W74-R89 HydrophobicContact CH2-CB 3.82Å; W74-R89 HydrophobicContact CH2-CG 3.86Å; W74-R89 HydrophobicContact CZ2-CB 4.25Å; W74-R89 HydrophobicContact CZ2-CG 4.21Å; W74-R89 HydrophobicContact CZ3-CB 4.38Å; W74-R89 HydrophobicContact CZ3-CG 4.02Å; W74-R89 PolarHBondContact O-NH1 3.03Å; W74-R89 PolarHBondContact O-NH2 2.85Å; N82-R89 PolarHBondContact OD1-NH2 3.08Å; I84-R89 HydrophobicContact CB-CG 4.33Å; I84-R89 HydrophobicContact CG2-CG 3.69Å; I84-R89 PolarHBondContact O-NE 3.43Å; S85-R89 WeakPolarHBondContact O-CG 3.45Å; S85-R89 PolarHBondContact O-N 3.05Å; D86-R89 PolarHBondContact O-N 2.88Å; R89-K93 WeakPolarHBondContact O-CE 3.3Å; R89-K93 WeakPolarHBondContact O-CG 3.42Å; R89-K93 PolarHBondContact O-N 3.11Å; R89-K93 VanDerWaalsContact O-N 3.15Å
90T91.9Very high86.6Confident91 Ų9148.6 Ų48.656%0.55828%0.282SS*.Hα-helixtrans-65.9-46.4179.1-55.70000111.1D86 A87 D88 I92 K93 A94D86-T90 PolarHBondContact O-N 3.34Å; D86-T90 VanDerWaalsContact O-N 3.07Å; D86-T90 PolarHBondContact O-OG1 2.99Å; A87-T90 PolarHBondContact O-N 3.25Å; D88-T90 VanDerWaalsContact C-N 3.31Å; D88-T90 PolarHBondContact O-N 2.81Å; T90-I92 PolarHBondContact O-N 3.29Å; T90-K93 PolarHBondContact O-N 3.44Å; T90-A94 PolarHBondContact O-N 3.17Å; T90-A94 VanDerWaalsContact O-N 3.07Å
91A92.1Very high87.4Confident28 Ų2843.3 Ų43.323%0.23126%0.257CS..Hα-helixtrans-64.6-37.4178.900000112.6L44 A87 D88 A94 N95L44-A91 HydrophobicContact CD1-CB 3.96Å; L44-A91 HydrophobicContact CD2-CB 3.75Å; L44-A91 HydrophobicContact CG-CB 4.49Å; A87-A91 WeakPolarHBondContact O-CB 3.49Å; A87-A91 PolarHBondContact O-N 3.48Å; D88-A91 PolarHBondContact O-N 3.43Å; A91-A94 PolarHBondContact O-N 3.34Å; A91-N95 PolarHBondContact O-N 3.31Å; A91-N95 PolarHBondContact O-ND2 2.97Å
92I94.4Very high88.1Confident0 Ų042.6 Ų42.60%026%0.255CS..Hα-helixtrans-62-51.3175-71.2159.7000110.1P43 L44 L47 F66 I70 W74 D88 T90 A94 N95 I96 I118P43-I92 HydrophobicContact CB-CD1 3.73Å; P43-I92 HydrophobicContact CB-CG1 4.43Å; P43-I92 HydrophobicContact CG-CD1 3.81Å; L44-I92 HydrophobicContact CD2-CG1 3.96Å; L47-I92 HydrophobicContact CD1-CG1 4.16Å; F66-I92 HydrophobicContact CE2-CD1 4.4Å; F66-I92 HydrophobicContact CE2-CG1 4.36Å; F66-I92 HydrophobicContact CZ-CG1 4.5Å; F66-I92 HydrophobicContact CZ-CG2 3.83Å; I70-I92 HydrophobicContact CD1-CD1 4.26Å; W74-I92 HydrophobicContact CH2-CB 4.34Å; W74-I92 HydrophobicContact CH2-CG2 4.22Å; W74-I92 HydrophobicContact CZ3-CB 4.32Å; W74-I92 HydrophobicContact CZ3-CD1 3.79Å; W74-I92 HydrophobicContact CZ3-CG2 4.13Å; D88-I92 HydrophobicContact CB-CD1 4.48Å; D88-I92 WeakPolarHBondContact O-CB 3.36Å; D88-I92 VanDerWaalsContact O-CD1 3.3Å; D88-I92 WeakPolarHBondContact O-CD1 3.45Å; D88-I92 WeakPolarHBondContact O-CG1 3.47Å; D88-I92 PolarHBondContact O-N 3.37Å; T90-I92 PolarHBondContact O-N 3.29Å; I92-A94 VanDerWaalsContact C-N 3.27Å; I92-A94 PolarHBondContact O-N 3.05Å; I92-N95 PolarHBondContact O-N 2.75Å; I92-N95 VanDerWaalsContact O-N 3.14Å; I92-I96 HydrophobicContact CG2-CB 4.47Å; I92-I96 HydrophobicContact CG2-CD1 4.42Å; I92-I96 VanDerWaalsContact O-CB 3.28Å; I92-I96 WeakPolarHBondContact O-CB 3.36Å; I92-I96 VanDerWaalsContact O-CG2 3.25Å; I92-I96 WeakPolarHBondContact O-CG2 3.49Å; I92-I96 PolarHBondContact O-N 3.16Å; I92-I118 HydrophobicContact CG2-CD1 3.79Å
93K92.1Very high88.5Confident29 Ų2939.2 Ų39.213%0.12624%0.237CC..Hα-helixtrans-58.9-36.7179.9-74.5-174.9-70.2-166.30112.8W74 R89 T90 I118 D122 K126 W127W74-K93 HydrophobicContact CH2-CG 4.36Å; W74-K93 HydrophobicContact CZ2-CD 4.39Å; W74-K93 HydrophobicContact CZ2-CG 4.38Å; R89-K93 WeakPolarHBondContact O-CE 3.3Å; R89-K93 WeakPolarHBondContact O-CG 3.42Å; R89-K93 PolarHBondContact O-N 3.11Å; R89-K93 VanDerWaalsContact O-N 3.15Å; T90-K93 PolarHBondContact O-N 3.44Å; K93-I118 HydrophobicContact CD-CG2 4.39Å; K93-I118 HydrophobicContact CG-CG2 4.21Å; K93-D122 IonicContact NZ-OD2 3.42Å; K93-D122 PolarHBondContact NZ-OD2 3.45Å; K93-K126 PolarHBondContact NZ-O 2.98Å; K93-W127 HydrophobicContact CB-CD2 4.28Å; K93-W127 HydrophobicContact CB-CZ2 3.95Å; K93-W127 HydrophobicContact CD-CB 4.07Å; K93-W127 HydrophobicContact CD-CD2 3.7Å; K93-W127 HydrophobicContact CD-CE3 4.08Å; K93-W127 HydrophobicContact CD-CG 3.72Å; K93-W127 HydrophobicContact CG-CD2 3.83Å; K93-W127 HydrophobicContact CG-CE3 4.11Å; K93-W127 HydrophobicContact CG-CG 4.31Å; K93-W127 HydrophobicContact CG-CH2 4.27Å; K93-W127 HydrophobicContact CG-CZ2 4.01Å; K93-W127 HydrophobicContact CG-CZ3 4.34Å; K93-W127 WeakPolarHBondContact O-CZ2 3.46Å
94A89.3Confident88.6Confident63 Ų6337.7 Ų37.752%0.52124%0.237SC..Hα-helixtrans-70-29178.300000114.3T90 A91 I92T90-A94 PolarHBondContact O-N 3.17Å; T90-A94 VanDerWaalsContact O-N 3.07Å; A91-A94 PolarHBondContact O-N 3.34Å; I92-A94 VanDerWaalsContact C-N 3.27Å; I92-A94 PolarHBondContact O-N 3.05Å
95N89.4Confident88.1Confident90 Ų9042.6 Ų42.648%0.48126%0.26SS..Hα-helixtrans-106.9-31.7-170.8-68.5-59.1000114.1A91 I92 V97 N98 L99A91-N95 PolarHBondContact O-N 3.31Å; A91-N95 PolarHBondContact O-ND2 2.97Å; I92-N95 PolarHBondContact O-N 2.75Å; I92-N95 VanDerWaalsContact O-N 3.14Å; N95-V97 VanDerWaalsContact C-N 3.35Å; N95-V97 PolarHBondContact O-N 2.95Å; N95-N98 PolarHBondContact O-N 3.37Å; N95-L99 WeakPolarHBondContact O-CB 3.19Å; N95-L99 PolarHBondContact O-N 3.18Å
96I90.8Very high87.8Confident0 Ų047 Ų470%028%0.277CS..Hα-helixtrans-62.2-37.6-167-167.5172.2000113.5F66 I92 M100 L111 A114 I115 I118 W127F66-I96 HydrophobicContact CE1-CD1 3.65Å; F66-I96 HydrophobicContact CZ-CD1 4.04Å; I92-I96 HydrophobicContact CG2-CB 4.47Å; I92-I96 HydrophobicContact CG2-CD1 4.42Å; I92-I96 VanDerWaalsContact O-CB 3.28Å; I92-I96 WeakPolarHBondContact O-CB 3.36Å; I92-I96 VanDerWaalsContact O-CG2 3.25Å; I92-I96 WeakPolarHBondContact O-CG2 3.49Å; I92-I96 PolarHBondContact O-N 3.16Å; I96-M100 WeakPolarHBondContact O-CB 3.29Å; I96-M100 PolarHBondContact O-N 3.44Å; I96-L111 HydrophobicContact CG1-CD2 4.36Å; I96-A114 HydrophobicContact CD1-CB 4.12Å; I96-I115 HydrophobicContact CB-CG1 4.47Å; I96-I115 HydrophobicContact CD1-CG1 3.64Å; I96-I115 HydrophobicContact CG1-CD1 4.16Å; I96-I115 HydrophobicContact CG1-CG1 3.77Å; I96-I115 HydrophobicContact CG2-CD1 4.41Å; I96-I115 HydrophobicContact CG2-CG1 3.93Å; I96-I118 HydrophobicContact CD1-CD1 3.96Å; I96-W127 HydrophobicContact CG2-CH2 3.8Å; I96-W127 HydrophobicContact CG2-CZ2 4.07Å
97V84.9Confident87.8Confident5 Ų541.7 Ų41.73%0.0325%0.248CC..Hα-helixtrans-67.1-49.6-178.6178.70000110.4N95 L99 M100 L101 I115 W127 L130N95-V97 VanDerWaalsContact C-N 3.35Å; N95-V97 PolarHBondContact O-N 2.95Å; V97-L99 PolarHBondContact O-N 3.03Å; V97-M100 HydrophobicContact CG1-CE 4.42Å; V97-M100 WeakPolarHBondContact O-CB 3.29Å; V97-M100 PolarHBondContact O-N 2.89Å; V97-L101 HydrophobicContact CG1-CD1 4.24Å; V97-L101 WeakPolarHBondContact O-CG 3.37Å; V97-L101 PolarHBondContact O-N 3.15Å; V97-I115 HydrophobicContact CG2-CD1 4.33Å; V97-W127 HydrophobicContact CG2-CH2 4.36Å; V97-W127 HydrophobicContact CG2-CZ2 3.95Å; V97-L130 HydrophobicContact CG2-CD1 3.96Å
98N84.6Confident87.5Confident64 Ų6439.5 Ų39.534%0.34223%0.228SC..Hα-helixtrans-63.5-42.5179.1-70.4-55.1000111.7N95 M100 L101 S102 E133 R137N95-N98 PolarHBondContact O-N 3.37Å; N98-M100 VanDerWaalsContact C-N 3.31Å; N98-M100 PolarHBondContact O-N 3.21Å; N98-L101 PolarHBondContact O-N 2.79Å; N98-S102 PolarHBondContact O-N 3.37Å; N98-S102 PolarHBondContact O-OG 3.21Å; N98-E133 PolarHBondContact ND2-OE1 3.35Å; N98-R137 PolarHBondContact OD1-NH2 3.11Å
99L88.1Confident87Confident19 Ų1944.3 Ų44.310%0.09925%0.249CC..Hα-helixtrans-62.5-38.7176.5-173.467.8000111.9L47 L50 E51 N95 V97 S102 S103 L111L47-L99 HydrophobicContact CB-CD2 4.35Å; L47-L99 HydrophobicContact CD2-CD2 3.94Å; L50-L99 HydrophobicContact CB-CD2 4Å; L50-L99 HydrophobicContact CD1-CD2 4Å; E51-L99 HydrophobicContact CB-CD1 3.98Å; E51-L99 HydrophobicContact CG-CD1 4.33Å; N95-L99 WeakPolarHBondContact O-CB 3.19Å; N95-L99 PolarHBondContact O-N 3.18Å; V97-L99 PolarHBondContact O-N 3.03Å; L99-S102 PolarHBondContact O-N 2.86Å; L99-S102 PolarHBondContact O-OG 3.05Å; L99-S103 WeakPolarHBondContact O-CB 3.49Å; L99-S103 PolarHBondContact O-N 3.16Å; L99-S103 PolarHBondContact O-OG 3.23Å; L99-L111 HydrophobicContact CB-CD1 4.38Å; L99-L111 HydrophobicContact CD2-CD1 4.05Å; L99-L111 HydrophobicContact CG-CD1 3.97Å
100M87.1Confident86.9Confident1 Ų145.4 Ų45.41%0.00526%0.255CS..Hα-helixtrans-64.5-40.1176.2177.6-84.4-61.100111.9I96 V97 N98 S103 Q108 L111 I115 T152I96-M100 WeakPolarHBondContact O-CB 3.29Å; I96-M100 PolarHBondContact O-N 3.44Å; V97-M100 HydrophobicContact CG1-CE 4.42Å; V97-M100 WeakPolarHBondContact O-CB 3.29Å; V97-M100 PolarHBondContact O-N 2.89Å; N98-M100 VanDerWaalsContact C-N 3.31Å; N98-M100 PolarHBondContact O-N 3.21Å; M100-S103 PolarHBondContact O-N 2.9Å; M100-Q108 HydrophobicContact CG-CG 3.88Å; M100-Q108 WeakPolarHBondContact O-CG 3.48Å; M100-Q108 PolarHBondContact O-NE2 2.87Å; M100-Q108 HydrophobicContact SD-CG 3.69Å; M100-L111 HydrophobicContact CB-CB 3.82Å; M100-L111 HydrophobicContact CB-CD1 4.05Å; M100-L111 HydrophobicContact CG-CB 3.91Å; M100-I115 HydrophobicContact CB-CD1 4.14Å; M100-I115 HydrophobicContact CE-CD1 3.93Å; M100-I115 HydrophobicContact CG-CD1 4.14Å; M100-T152 HydrophobicContact CE-CG2 4.41Å; M100-T152 WeakPolarHBondContact CE-OG1 3.44Å
101L81.6Confident86.8Confident17 Ų1741.1 Ų41.19%0.08923%0.228CC..Hα-helixtrans-72.1-30.8178.6-65.8174.3000113.4V97 N98 R137 V145 V149V97-L101 HydrophobicContact CG1-CD1 4.24Å; V97-L101 WeakPolarHBondContact O-CG 3.37Å; V97-L101 PolarHBondContact O-N 3.15Å; N98-L101 PolarHBondContact O-N 2.79Å; L101-R137 HydrophobicContact CD1-CG 4.24Å; L101-V145 HydrophobicContact CD1-CG1 4.36Å; L101-V145 HydrophobicContact CD2-CG1 4.4Å; L101-V149 HydrophobicContact CD1-CG2 4.35Å; L101-V149 HydrophobicContact CD2-CG2 3.86Å
102S83.4Confident86.4Confident92 Ų9240.1 Ų40.164%0.64322%0.22SC*.THydrogen-bonded Turntrans-89.5-1.1177.567.10000114N98 L99N98-S102 PolarHBondContact O-N 3.37Å; N98-S102 PolarHBondContact O-OG 3.21Å; L99-S102 PolarHBondContact O-N 2.86Å; L99-S102 PolarHBondContact O-OG 3.05Å
103S85.7Confident85.9Confident4 Ų443.1 Ų43.13%0.02824%0.236CC..SBendtrans-93.5149.6-174.7-760000113L99 M100L99-S103 WeakPolarHBondContact O-CB 3.49Å; L99-S103 PolarHBondContact O-N 3.16Å; L99-S103 PolarHBondContact O-OG 3.23Å; M100-S103 PolarHBondContact O-N 2.9Å
104P82.8Confident85.8Confident63 Ų6341.8 Ų41.841%0.40923%0.23SC..  trans-56.6155.8167.7-21.831.3000112.6Q106 I107 Q108P104-Q106 VanDerWaalsContact C-N 3.3Å; P104-Q106 PolarHBondContact O-N 3.43Å; P104-Q106 VanDerWaalsContact O-N 3.1Å; P104-I107 PolarHBondContact O-N 3.24Å; P104-Q108 PolarHBondContact O-N 3.44Å
105E78.4Confident85.8Confident104 Ų10438.8 Ų38.849%0.48621%0.205SC..Hα-helixtrans-51-42-171.8-167.2-17215900114.3I107 Q108 K109E105-I107 VanDerWaalsContact C-N 3.35Å; E105-I107 PolarHBondContact O-N 3.21Å; E105-Q108 PolarHBondContact O-N 3.1Å; E105-K109 WeakPolarHBondContact O-CG 3.47Å; E105-K109 PolarHBondContact O-N 3.34Å; E105-K109 WeakPolarHBondContact OE1-CE 3.29Å; E105-K109 IonicContact OE1-NZ 3.62Å; E105-K109 PolarHBondContact OE1-NZ 2.85Å
106Q82.2Confident85.5Confident126 Ų12635.5 Ų35.559%0.58919%0.189SC*.Hα-helixtrans-64.1-38.3-178.8-168.7176.911.900112.7V60 P104V60-Q106 HydrophobicContact CG2-CG 4.15Å; P104-Q106 VanDerWaalsContact C-N 3.3Å; P104-Q106 PolarHBondContact O-N 3.43Å; P104-Q106 VanDerWaalsContact O-N 3.1Å
107I88.5Confident85.3Confident4 Ų437.7 Ų37.72%0.02120%0.2CC..Hα-helixtrans-78.2-41.2177.5-65.7167.1000109.7L50 R59 V60 A63 P104 E105 K109 Q110 L111L50-I107 HydrophobicContact CD2-CG2 4.14Å; R59-I107 HydrophobicContact CB-CD1 3.63Å; V60-I107 HydrophobicContact CG2-CG1 4.21Å; A63-I107 HydrophobicContact CB-CG2 4.36Å; P104-I107 PolarHBondContact O-N 3.24Å; E105-I107 VanDerWaalsContact C-N 3.35Å; E105-I107 PolarHBondContact O-N 3.21Å; I107-K109 VanDerWaalsContact C-N 3.26Å; I107-K109 PolarHBondContact O-N 2.86Å; I107-Q110 PolarHBondContact O-N 3.47Å; I107-Q110 VanDerWaalsContact O-N 3.12Å; I107-L111 HydrophobicContact CG2-CD1 3.9Å; I107-L111 HydrophobicContact CG2-CG 4.19Å; I107-L111 PolarHBondContact O-N 2.83Å
108Q84.7Confident85.6Confident12 Ų1237.5 Ų37.56%0.05620%0.199CC..Hα-helixtrans-53.7-43.2176-176.3179.465.800111.5M100 P104 E105 L111 S112M100-Q108 HydrophobicContact CG-CG 3.88Å; M100-Q108 WeakPolarHBondContact O-CG 3.48Å; M100-Q108 PolarHBondContact O-NE2 2.87Å; M100-Q108 HydrophobicContact SD-CG 3.69Å; P104-Q108 PolarHBondContact O-N 3.44Å; E105-Q108 PolarHBondContact O-N 3.1Å; Q108-L111 PolarHBondContact O-N 3.43Å; Q108-S112 WeakPolarHBondContact O-CB 3.27Å; Q108-S112 PolarHBondContact O-N 3.23Å
109K82.8Confident85.7Confident103 Ų10334.4 Ų34.445%0.44818%0.183SC..Hα-helixtrans-58.6-49.6175.2-75.6174.3-1771670112.4E105 I107 L111 S112 D113E105-K109 WeakPolarHBondContact O-CG 3.47Å; E105-K109 PolarHBondContact O-N 3.34Å; E105-K109 WeakPolarHBondContact OE1-CE 3.29Å; E105-K109 IonicContact OE1-NZ 3.62Å; E105-K109 PolarHBondContact OE1-NZ 2.85Å; I107-K109 VanDerWaalsContact C-N 3.26Å; I107-K109 PolarHBondContact O-N 2.86Å; K109-L111 PolarHBondContact O-N 3.36Å; K109-S112 PolarHBondContact O-N 3.44Å; K109-D113 PolarHBondContact O-N 2.88Å; K109-D113 VanDerWaalsContact O-N 3.11Å
110Q89.2Confident85.5Confident39 Ų3941.2 Ų41.218%0.18221%0.207CC..Hα-helixtrans-63.9-39.5-180-60.3-55.9-46.200112.5A63 V64 I107 D113 A114A63-Q110 HydrophobicContact CB-CB 3.75Å; A63-Q110 HydrophobicContact CB-CG 4.11Å; V64-Q110 HydrophobicContact CG2-CG 4.18Å; I107-Q110 PolarHBondContact O-N 3.47Å; I107-Q110 VanDerWaalsContact O-N 3.12Å; Q110-D113 PolarHBondContact O-N 3.36Å; Q110-A114 PolarHBondContact O-N 2.72Å; Q110-A114 VanDerWaalsContact O-N 3.13Å
111L90Very high85.5Confident0 Ų044.5 Ų44.50%022%0.222CC..Hα-helixtrans-70.7-36.9177.4-66.9-180000112.1L47 L50 F66 I96 L99 M100 I107 Q108 K109 D113 A114 I115L47-L111 HydrophobicContact CD2-CD2 4.33Å; L50-L111 HydrophobicContact CD1-CD1 4.47Å; L50-L111 HydrophobicContact CD1-CD2 3.89Å; F66-L111 HydrophobicContact CD1-CD2 4.16Å; F66-L111 HydrophobicContact CE1-CD2 4.36Å; I96-L111 HydrophobicContact CG1-CD2 4.36Å; L99-L111 HydrophobicContact CB-CD1 4.38Å; L99-L111 HydrophobicContact CD2-CD1 4.05Å; L99-L111 HydrophobicContact CG-CD1 3.97Å; M100-L111 HydrophobicContact CB-CB 3.82Å; M100-L111 HydrophobicContact CB-CD1 4.05Å; M100-L111 HydrophobicContact CG-CB 3.91Å; I107-L111 HydrophobicContact CG2-CD1 3.9Å; I107-L111 HydrophobicContact CG2-CG 4.19Å; I107-L111 PolarHBondContact O-N 2.83Å; Q108-L111 PolarHBondContact O-N 3.43Å; K109-L111 PolarHBondContact O-N 3.36Å; L111-D113 VanDerWaalsContact C-N 3.32Å; L111-D113 PolarHBondContact O-N 3.4Å; L111-A114 PolarHBondContact O-N 2.88Å; L111-I115 VanDerWaalsContact O-CG1 3.27Å; L111-I115 WeakPolarHBondContact O-CG1 3.45Å; L111-I115 PolarHBondContact O-N 3.4Å
112S84.2Confident85.9Confident8 Ų844 Ų446%0.05622%0.219CC..Hα-helixtrans-61.5-40.2174.3-167.50000111.9Q108 K109 I115 S116 T152Q108-S112 WeakPolarHBondContact O-CB 3.27Å; Q108-S112 PolarHBondContact O-N 3.23Å; K109-S112 PolarHBondContact O-N 3.44Å; S112-I115 PolarHBondContact O-N 2.76Å; S112-S116 PolarHBondContact O-N 2.95Å; S112-S116 PolarHBondContact O-OG 3.22Å; S112-T152 PolarHBondContact OG-OG1 3.3Å
113D83.8Confident86.1Confident63 Ų6339.8 Ų39.834%0.33719%0.19SC..Hα-helixtrans-63.3-44.1173.2-73.8-11.4000111.6K67 K109 Q110 L111 S116 I117K67-D113 HydrophobicContact CD-CB 3.88Å; K67-D113 HydrophobicContact CG-CB 4.29Å; K109-D113 PolarHBondContact O-N 2.88Å; K109-D113 VanDerWaalsContact O-N 3.11Å; Q110-D113 PolarHBondContact O-N 3.36Å; L111-D113 VanDerWaalsContact C-N 3.32Å; L111-D113 PolarHBondContact O-N 3.4Å; D113-S116 WeakPolarHBondContact O-CB 3.44Å; D113-S116 PolarHBondContact O-N 3.14Å; D113-S116 VanDerWaalsContact O-N 3.16Å; D113-I117 WeakPolarHBondContact O-CG1 3.37Å; D113-I117 PolarHBondContact O-N 3.36Å
114A90.5Very high86.1Confident0 Ų040.1 Ų40.10%019%0.192CC..Hα-helixtrans-62.4-42.7176.200000112.2F66 K67 I96 Q110 L111 S116 I117 I118F66-A114 HydrophobicContact CD1-CB 4.1Å; F66-A114 HydrophobicContact CE1-CB 3.81Å; K67-A114 HydrophobicContact CB-CB 4.39Å; K67-A114 HydrophobicContact CG-CB 4.47Å; I96-A114 HydrophobicContact CD1-CB 4.12Å; Q110-A114 PolarHBondContact O-N 2.72Å; Q110-A114 VanDerWaalsContact O-N 3.13Å; L111-A114 PolarHBondContact O-N 2.88Å; A114-S116 PolarHBondContact O-N 2.95Å; A114-I117 PolarHBondContact O-N 3.37Å; A114-I118 VanDerWaalsContact O-CG1 3.31Å; A114-I118 WeakPolarHBondContact O-CG1 3.36Å; A114-I118 PolarHBondContact O-N 2.85Å
115I88.6Confident86.3Confident1 Ų143.5 Ų43.51%0.00520%0.202CC..Hα-helixtrans-59.1-39.1173.5-67.9164.8000110.6I96 V97 M100 L111 S112 I118 G119 W127 T152I96-I115 HydrophobicContact CB-CG1 4.47Å; I96-I115 HydrophobicContact CD1-CG1 3.64Å; I96-I115 HydrophobicContact CG1-CD1 4.16Å; I96-I115 HydrophobicContact CG1-CG1 3.77Å; I96-I115 HydrophobicContact CG2-CD1 4.41Å; I96-I115 HydrophobicContact CG2-CG1 3.93Å; V97-I115 HydrophobicContact CG2-CD1 4.33Å; M100-I115 HydrophobicContact CB-CD1 4.14Å; M100-I115 HydrophobicContact CE-CD1 3.93Å; M100-I115 HydrophobicContact CG-CD1 4.14Å; L111-I115 VanDerWaalsContact O-CG1 3.27Å; L111-I115 WeakPolarHBondContact O-CG1 3.45Å; L111-I115 PolarHBondContact O-N 3.4Å; S112-I115 PolarHBondContact O-N 2.76Å; I115-I118 PolarHBondContact O-N 3.11Å; I115-G119 PolarHBondContact O-N 3.26Å; I115-W127 HydrophobicContact CG1-CH2 4.48Å; I115-W127 HydrophobicContact CG2-CH2 4.04Å; I115-W127 HydrophobicContact CG2-CZ3 4.13Å; I115-T152 HydrophobicContact CB-CG2 4.17Å; I115-T152 HydrophobicContact CD1-CG2 4.13Å; I115-T152 HydrophobicContact CG2-CG2 3.52Å
116S84.1Confident86.7Confident21 Ų2144.8 Ų44.815%0.14721%0.206CC..Hα-helixtrans-66.4-39.5179.2-53.60000112S112 D113 A114 G119 R120 S155S112-S116 PolarHBondContact O-N 2.95Å; S112-S116 PolarHBondContact O-OG 3.22Å; D113-S116 WeakPolarHBondContact O-CB 3.44Å; D113-S116 PolarHBondContact O-N 3.14Å; D113-S116 VanDerWaalsContact O-N 3.16Å; A114-S116 PolarHBondContact O-N 2.95Å; S116-G119 PolarHBondContact O-N 3.43Å; S116-R120 PolarHBondContact O-N 2.96Å; S116-S155 WeakPolarHBondContact OG-CB 3.32Å
117I87.1Confident87.1Confident46 Ų4639.4 Ų39.424%0.23618%0.181CC..Hα-helixtrans-65.3-45.8174.8-63.9164.6000110.5K67 I70 K71 D113 A114 R120K67-I117 HydrophobicContact CG-CD1 4.44Å; I70-I117 HydrophobicContact CG2-CB 4.13Å; I70-I117 HydrophobicContact CG2-CG2 3.86Å; K71-I117 HydrophobicContact CB-CD1 3.9Å; K71-I117 HydrophobicContact CG-CD1 4.22Å; D113-I117 WeakPolarHBondContact O-CG1 3.37Å; D113-I117 PolarHBondContact O-N 3.36Å; A114-I117 PolarHBondContact O-N 3.37Å; I117-R120 WeakPolarHBondContact O-CB 3.41Å; I117-R120 PolarHBondContact O-N 3.49Å
118I91.3Very high87Confident0 Ų043 Ų430%020%0.204CC..Hα-helixtrans-61.6-47.7176.8-66166.1000110.1I70 W74 I92 K93 I96 A114 I115 R120 E121 D122 W127I70-I118 HydrophobicContact CD1-CD1 4.4Å; I70-I118 HydrophobicContact CG2-CD1 4.24Å; I70-I118 HydrophobicContact CG2-CG1 3.67Å; W74-I118 HydrophobicContact CD2-CG1 3.79Å; W74-I118 HydrophobicContact CD2-CG2 4.48Å; W74-I118 HydrophobicContact CE3-CD1 4.47Å; W74-I118 HydrophobicContact CE3-CG1 4.04Å; W74-I118 HydrophobicContact CG-CG1 4.29Å; W74-I118 HydrophobicContact CH2-CD1 4.19Å; W74-I118 HydrophobicContact CH2-CG1 4.16Å; W74-I118 HydrophobicContact CH2-CG2 4.12Å; W74-I118 HydrophobicContact CZ2-CB 4.25Å; W74-I118 HydrophobicContact CZ2-CD1 4.45Å; W74-I118 HydrophobicContact CZ2-CG1 3.99Å; W74-I118 HydrophobicContact CZ2-CG2 3.4Å; W74-I118 VanDerWaalsContact CZ2-CG2 3.4Å; W74-I118 HydrophobicContact CZ3-CD1 4.22Å; W74-I118 HydrophobicContact CZ3-CG1 4.2Å; I92-I118 HydrophobicContact CG2-CD1 3.79Å; K93-I118 HydrophobicContact CD-CG2 4.39Å; K93-I118 HydrophobicContact CG-CG2 4.21Å; I96-I118 HydrophobicContact CD1-CD1 3.96Å; A114-I118 VanDerWaalsContact O-CG1 3.31Å; A114-I118 WeakPolarHBondContact O-CG1 3.36Å; A114-I118 PolarHBondContact O-N 2.85Å; I115-I118 PolarHBondContact O-N 3.11Å; I118-R120 PolarHBondContact O-N 2.87Å; I118-E121 PolarHBondContact O-N 2.98Å; I118-E121 VanDerWaalsContact O-N 3.14Å; I118-D122 HydrophobicContact CG2-CB 4.31Å; I118-D122 WeakPolarHBondContact O-CB 3.38Å; I118-D122 PolarHBondContact O-N 2.89Å; I118-W127 HydrophobicContact CB-CE3 4.48Å; I118-W127 HydrophobicContact CB-CZ3 3.88Å; I118-W127 HydrophobicContact CG2-CE3 3.55Å; I118-W127 HydrophobicContact CG2-CH2 4.25Å; I118-W127 HydrophobicContact CG2-CZ3 3.32Å
119G86.6Confident87Confident0 Ų047.8 Ų47.80%023%0.23CC..Hα-helixtrans-58.2-36.217900000112I115 S116 E121 F123I115-G119 PolarHBondContact O-N 3.26Å; S116-G119 PolarHBondContact O-N 3.43Å; G119-E121 PolarHBondContact O-N 3.33Å; G119-F123 WeakPolarHBondContact O-CA 3.21Å; G119-F123 WeakPolarHBondContact O-CB 3.13Å; G119-F123 PolarHBondContact O-N 2.94Å
120R83.1Confident87.2Confident162 Ų16242.9 Ų42.961%0.61121%0.208SC*.Hα-helixtrans-56.4-37.9177.5-169.8179.8-177.5-177.1-1.2113.4S116 I117 I118 R159S116-R120 PolarHBondContact O-N 2.96Å; I117-R120 WeakPolarHBondContact O-CB 3.41Å; I117-R120 PolarHBondContact O-N 3.49Å; I118-R120 PolarHBondContact O-N 2.87Å; R120-R159 PolarHBondContact O-NH1 3.28Å
121E86.9Confident87.1Confident70 Ų7041.1 Ų41.133%0.32720%0.2SC..Hα-helixtrans-97.4-31.9-174.4-60.2-66148.200113.2I118 G119I118-E121 PolarHBondContact O-N 2.98Å; I118-E121 VanDerWaalsContact O-N 3.14Å; G119-E121 PolarHBondContact O-N 3.33Å
122D89.7Confident87Confident5 Ų545 Ų453%0.02722%0.224CC..Hα-helixtrans-109-24.4-170.1-80.336.7000113.6W74 K93 I118 P124 Q125 K126 W127W74-D122 PolarHBondContact NE1-OD1 3.46Å; K93-D122 IonicContact NZ-OD2 3.42Å; K93-D122 PolarHBondContact NZ-OD2 3.45Å; I118-D122 HydrophobicContact CG2-CB 4.31Å; I118-D122 WeakPolarHBondContact O-CB 3.38Å; I118-D122 PolarHBondContact O-N 2.89Å; D122-P124 CarbonylContact O-C 3.57Å; D122-Q125 PolarHBondContact O-N 2.65Å; D122-K126 HydrophobicContact CB-CB 3.85Å; D122-K126 CarbonylContact O-C 3.41Å; D122-K126 VanDerWaalsContact O-CA 3.28Å; D122-K126 WeakPolarHBondContact O-CA 3.48Å; D122-K126 WeakPolarHBondContact O-CB 3.27Å; D122-K126 PolarHBondContact O-N 3.01Å; D122-W127 HydrophobicContact CB-CB 4.29Å; D122-W127 PolarHBondContact O-N 3.32Å
123F88.3Confident87Confident4 Ų446.9 Ų46.92%0.01823%0.232CC..THydrogen-bonded Turntrans-88.6134.7179.9176.5-97.9000110.5G119 L130 L131 L156 F157 E172 V176G119-F123 WeakPolarHBondContact O-CA 3.21Å; G119-F123 WeakPolarHBondContact O-CB 3.13Å; G119-F123 PolarHBondContact O-N 2.94Å; F123-L130 HydrophobicContact CD2-CB 4.38Å; F123-L130 HydrophobicContact CD2-CD2 4.09Å; F123-L131 HydrophobicContact CE2-CD1 3.99Å; F123-L131 HydrophobicContact CE2-CD2 4.17Å; F123-L131 HydrophobicContact CE2-CG 3.7Å; F123-L131 HydrophobicContact CZ-CD1 3.81Å; F123-L131 HydrophobicContact CZ-CD2 3.96Å; F123-L131 HydrophobicContact CZ-CG 3.83Å; F123-L156 HydrophobicContact CD1-CD1 4.25Å; F123-L156 HydrophobicContact CD1-CD2 3.9Å; F123-L156 HydrophobicContact CD1-CG 4.34Å; F123-L156 HydrophobicContact CE1-CD2 4.07Å; F123-L156 HydrophobicContact CG-CD2 4.13Å; F123-L156 HydrophobicContact CZ-CD2 4.49Å; F123-F157 HydrophobicContact CE1-CE1 4.43Å; F123-E172 HydrophobicContact CD1-CG 4.06Å; F123-E172 WeakPolarHBondContact CD1-OE1 3.16Å; F123-E172 HydrophobicContact CE1-CG 3.56Å; F123-E172 VanDerWaalsContact CE1-OE1 3.31Å; F123-E172 WeakPolarHBondContact CE1-OE1 3.43Å; F123-E172 HydrophobicContact CZ-CG 4.39Å; F123-V176 HydrophobicContact CE1-CG2 3.86Å; F123-V176 HydrophobicContact CZ-CG2 3.69Å
124P85.1Confident87.1Confident11 Ų1144.1 Ų44.17%0.07122%0.217CC..THydrogen-bonded Turncis-92.3-20.72.733.6-34.8000115.6D122 K126 W127 P128 E172 L175D122-P124 CarbonylContact O-C 3.57Å; P124-K126 PolarHBondContact O-N 3.36Å; P124-W127 CarbonylContact O-C 3.51Å; P124-W127 PolarHBondContact O-N 3.31Å; P124-P128 WeakPolarHBondContact O-CA 3.43Å; P124-E172 WeakPolarHBondContact CD-OE2 3.35Å; P124-E172 HydrophobicContact CG-CB 4.21Å; P124-E172 HydrophobicContact CG-CG 4.05Å; P124-L175 HydrophobicContact CB-CD2 3.45Å; P124-L175 VanDerWaalsContact CB-CD2 3.45Å; P124-L175 HydrophobicContact CG-CD2 4.07Å
125Q87Confident87Confident135 Ų13544.9 Ų44.963%0.63122%0.222SC*.THydrogen-bonded Turntrans-71.5-37-163.1-57.483.31.800114D122D122-Q125 PolarHBondContact O-N 2.65Å
126K87.2Confident87Confident130 Ų13049 Ų4957%0.56525%0.247SC*.THydrogen-bonded Turntrans-96.8-2.7-179.3-58.1175-176.4165.60112.7K93 D122 P124K93-K126 PolarHBondContact NZ-O 2.98Å; D122-K126 HydrophobicContact CB-CB 3.85Å; D122-K126 CarbonylContact O-C 3.41Å; D122-K126 VanDerWaalsContact O-CA 3.28Å; D122-K126 WeakPolarHBondContact O-CA 3.48Å; D122-K126 WeakPolarHBondContact O-CB 3.27Å; D122-K126 PolarHBondContact O-N 3.01Å; P124-K126 PolarHBondContact O-N 3.36Å
127W90Very high87.1Confident14 Ų1452.3 Ų52.35%0.05326%0.256CS..  trans-141.362.2175.8-158.5-1.9000111.9K93 I96 V97 I115 I118 D122 P124 D129 L130K93-W127 HydrophobicContact CB-CD2 4.28Å; K93-W127 HydrophobicContact CB-CZ2 3.95Å; K93-W127 HydrophobicContact CD-CB 4.07Å; K93-W127 HydrophobicContact CD-CD2 3.7Å; K93-W127 HydrophobicContact CD-CE3 4.08Å; K93-W127 HydrophobicContact CD-CG 3.72Å; K93-W127 HydrophobicContact CG-CD2 3.83Å; K93-W127 HydrophobicContact CG-CE3 4.11Å; K93-W127 HydrophobicContact CG-CG 4.31Å; K93-W127 HydrophobicContact CG-CH2 4.27Å; K93-W127 HydrophobicContact CG-CZ2 4.01Å; K93-W127 HydrophobicContact CG-CZ3 4.34Å; K93-W127 WeakPolarHBondContact O-CZ2 3.46Å; I96-W127 HydrophobicContact CG2-CH2 3.8Å; I96-W127 HydrophobicContact CG2-CZ2 4.07Å; V97-W127 HydrophobicContact CG2-CH2 4.36Å; V97-W127 HydrophobicContact CG2-CZ2 3.95Å; I115-W127 HydrophobicContact CG1-CH2 4.48Å; I115-W127 HydrophobicContact CG2-CH2 4.04Å; I115-W127 HydrophobicContact CG2-CZ3 4.13Å; I118-W127 HydrophobicContact CB-CE3 4.48Å; I118-W127 HydrophobicContact CB-CZ3 3.88Å; I118-W127 HydrophobicContact CG2-CE3 3.55Å; I118-W127 HydrophobicContact CG2-CH2 4.25Å; I118-W127 HydrophobicContact CG2-CZ3 3.32Å; D122-W127 HydrophobicContact CB-CB 4.29Å; D122-W127 PolarHBondContact O-N 3.32Å; P124-W127 CarbonylContact O-C 3.51Å; P124-W127 PolarHBondContact O-N 3.31Å; W127-D129 PolarHBondContact O-N 3.04Å; W127-L130 HydrophobicContact CD2-CB 4.3Å; W127-L130 HydrophobicContact CD2-CD1 4.37Å; W127-L130 HydrophobicContact CD2-CD2 4.19Å; W127-L130 HydrophobicContact CE3-CD2 4.05Å; W127-L130 HydrophobicContact CG-CB 4.18Å; W127-L130 HydrophobicContact CH2-CD1 4.21Å; W127-L130 HydrophobicContact CZ2-CD1 3.86Å; W127-L130 HydrophobicContact CZ3-CD2 4.32Å
128P86.1Confident87Confident78 Ų7850.9 Ų50.951%0.50625%0.249SC..THydrogen-bonded Turntrans-68.4-31.1-170.727-35.7000113.8P124 L130P124-P128 WeakPolarHBondContact O-CA 3.43Å; P128-L130 VanDerWaalsContact C-N 3.25Å; P128-L130 PolarHBondContact O-N 2.68Å
129D85.9Confident86.6Confident113 Ų11361 Ų6160%0.60429%0.286SS*.THydrogen-bonded Turntrans-77-9.1-173.2-59.2-50.4000114.2W127 L131 T132 E133W127-D129 PolarHBondContact O-N 3.04Å; D129-L131 PolarHBondContact O-N 3.2Å; D129-T132 PolarHBondContact O-N 3.19Å; D129-E133 PolarHBondContact O-N 3.49Å
130L86.6Confident86.5Confident0 Ų063.7 Ų63.70%031%0.305CS..Hα-helixtrans-58.2-46.9-172.5-175.662.6000112.6V97 F123 W127 P128 E133 M134 L156V97-L130 HydrophobicContact CG2-CD1 3.96Å; F123-L130 HydrophobicContact CD2-CB 4.38Å; F123-L130 HydrophobicContact CD2-CD2 4.09Å; W127-L130 HydrophobicContact CD2-CB 4.3Å; W127-L130 HydrophobicContact CD2-CD1 4.37Å; W127-L130 HydrophobicContact CD2-CD2 4.19Å; W127-L130 HydrophobicContact CE3-CD2 4.05Å; W127-L130 HydrophobicContact CG-CB 4.18Å; W127-L130 HydrophobicContact CH2-CD1 4.21Å; W127-L130 HydrophobicContact CZ2-CD1 3.86Å; W127-L130 HydrophobicContact CZ3-CD2 4.32Å; P128-L130 VanDerWaalsContact C-N 3.25Å; P128-L130 PolarHBondContact O-N 2.68Å; L130-E133 PolarHBondContact O-N 2.93Å; L130-M134 HydrophobicContact CD1-CE 3.71Å; L130-M134 HydrophobicContact CD2-CE 4.18Å; L130-M134 HydrophobicContact CG-CE 3.79Å; L130-M134 HydrophobicContact CG-SD 4.5Å; L130-M134 VanDerWaalsContact O-CG 3.29Å; L130-M134 WeakPolarHBondContact O-CG 3.49Å; L130-M134 PolarHBondContact O-N 3.24Å; L130-L156 HydrophobicContact CD2-CD2 3.92Å
131L87.4Confident86.3Confident3 Ų359 Ų592%0.01631%0.307CS..Hα-helixtrans-65.1-44.9-179.8-67.7176.7000111.7F123 D129 E133 M134 V135 F157 L175 V176 T179 F180F123-L131 HydrophobicContact CE2-CD1 3.99Å; F123-L131 HydrophobicContact CE2-CD2 4.17Å; F123-L131 HydrophobicContact CE2-CG 3.7Å; F123-L131 HydrophobicContact CZ-CD1 3.81Å; F123-L131 HydrophobicContact CZ-CD2 3.96Å; F123-L131 HydrophobicContact CZ-CG 3.83Å; D129-L131 PolarHBondContact O-N 3.2Å; L131-E133 VanDerWaalsContact C-N 3.31Å; L131-E133 PolarHBondContact O-N 3.49Å; L131-M134 PolarHBondContact O-N 2.99Å; L131-V135 WeakPolarHBondContact O-CG2 3.18Å; L131-V135 PolarHBondContact O-N 3.19Å; L131-F157 HydrophobicContact CD2-CE1 4.32Å; L131-F157 HydrophobicContact CD2-CZ 3.77Å; L131-L175 HydrophobicContact CD1-CG 4.2Å; L131-V176 HydrophobicContact CD1-CG2 4.08Å; L131-V176 HydrophobicContact CD2-CG2 4.26Å; L131-T179 HydrophobicContact CB-CG2 3.94Å; L131-T179 HydrophobicContact CD1-CG2 4.47Å; L131-F180 HydrophobicContact CD2-CD2 4.18Å
132T86.9Confident86.3Confident81 Ų8159.4 Ų59.450%0.49731%0.312SS..Hα-helixtrans-62.5-41.4-179.5-540000111D129 T136D129-T132 PolarHBondContact O-N 3.19Å; T132-T136 WeakPolarHBondContact O-CB 3.46Å; T132-T136 PolarHBondContact O-N 2.72Å; T132-T136 PolarHBondContact O-OG1 2.8Å
133E85.1Confident86.1Confident48 Ų4860.7 Ų60.722%0.22432%0.317CS..Hα-helixtrans-62.5-47.7175-169.6174.5-171.300110.8N98 D129 L130 L131 V135 T136 R137N98-E133 PolarHBondContact ND2-OE1 3.35Å; D129-E133 PolarHBondContact O-N 3.49Å; L130-E133 PolarHBondContact O-N 2.93Å; L131-E133 VanDerWaalsContact C-N 3.31Å; L131-E133 PolarHBondContact O-N 3.49Å; E133-V135 PolarHBondContact O-N 3.4Å; E133-T136 PolarHBondContact O-N 3.5Å; E133-R137 WeakPolarHBondContact O-CG 3.5Å; E133-R137 PolarHBondContact O-N 3.01Å
134M86.1Confident85.8Confident4 Ų465.4 Ų65.42%0.0234%0.339CS..Hα-helixtrans-58.3-49.5177-72-176.918000112.6L130 L131 T136 R137 F138 V149 T152 A153 F180L130-M134 HydrophobicContact CD1-CE 3.71Å; L130-M134 HydrophobicContact CD2-CE 4.18Å; L130-M134 HydrophobicContact CG-CE 3.79Å; L130-M134 HydrophobicContact CG-SD 4.5Å; L130-M134 VanDerWaalsContact O-CG 3.29Å; L130-M134 WeakPolarHBondContact O-CG 3.49Å; L130-M134 PolarHBondContact O-N 3.24Å; L131-M134 PolarHBondContact O-N 2.99Å; M134-T136 VanDerWaalsContact C-N 3.31Å; M134-T136 PolarHBondContact O-N 3.39Å; M134-R137 WeakPolarHBondContact O-CB 3.31Å; M134-R137 PolarHBondContact O-N 2.85Å; M134-R137 VanDerWaalsContact O-N 3.13Å; M134-F138 PolarHBondContact O-N 3.14Å; M134-V149 HydrophobicContact CB-CG1 3.6Å; M134-V149 HydrophobicContact CG-CG1 3.85Å; M134-T152 HydrophobicContact CE-CG2 3.46Å; M134-T152 VanDerWaalsContact CE-CG2 3.46Å; M134-A153 HydrophobicContact SD-CB 4.18Å; M134-F180 HydrophobicContact CB-CE2 3.95Å; M134-F180 HydrophobicContact SD-CE2 4.48Å
135V87.9Confident85.8Confident17 Ų1766.2 Ų66.210%0.10334%0.344CS..Hα-helixtrans-63-38.4-179.3170.80000111.5L131 E133 R137 F138 T179 F180 P183L131-V135 WeakPolarHBondContact O-CG2 3.18Å; L131-V135 PolarHBondContact O-N 3.19Å; E133-V135 PolarHBondContact O-N 3.4Å; V135-R137 PolarHBondContact O-N 2.88Å; V135-F138 WeakPolarHBondContact O-CB 3.13Å; V135-F138 PolarHBondContact O-N 2.94Å; V135-F138 VanDerWaalsContact O-N 3.14Å; V135-T179 HydrophobicContact CG2-CG2 4.4Å; V135-F180 HydrophobicContact CG2-CD2 3.49Å; V135-F180 VanDerWaalsContact CG2-CD2 3.49Å; V135-F180 HydrophobicContact CG2-CE2 3.84Å; V135-F180 HydrophobicContact CG2-CG 4.41Å; V135-P183 HydrophobicContact CG1-CB 3.91Å; V135-P183 HydrophobicContact CG1-CG 3.73Å; V135-P183 HydrophobicContact CG2-CG 4.38Å
136T88.2Confident85.8Confident86 Ų8659.9 Ų59.953%0.52831%0.314SS..Hα-helixtrans-60.7-36.3177.2-58.70000111.3T132 E133 M134 F138 R139T132-T136 WeakPolarHBondContact O-CB 3.46Å; T132-T136 PolarHBondContact O-N 2.72Å; T132-T136 PolarHBondContact O-OG1 2.8Å; E133-T136 PolarHBondContact O-N 3.5Å; M134-T136 VanDerWaalsContact C-N 3.31Å; M134-T136 PolarHBondContact O-N 3.39Å; T136-F138 VanDerWaalsContact C-N 3.33Å; T136-F138 PolarHBondContact O-N 3.37Å; T136-R139 PolarHBondContact O-N 3.2Å
137R86.6Confident85.8Confident92 Ų9254.4 Ų54.435%0.34729%0.291SS..Hα-helixtrans-72.4-20.2178.7-62.3-61-179.2-171.52.3113.7N98 L101 E133 M134 V135 R139 S140 V145 V149N98-R137 PolarHBondContact OD1-NH2 3.11Å; L101-R137 HydrophobicContact CD1-CG 4.24Å; E133-R137 WeakPolarHBondContact O-CG 3.5Å; E133-R137 PolarHBondContact O-N 3.01Å; M134-R137 WeakPolarHBondContact O-CB 3.31Å; M134-R137 PolarHBondContact O-N 2.85Å; M134-R137 VanDerWaalsContact O-N 3.13Å; V135-R137 PolarHBondContact O-N 2.88Å; R137-R139 PolarHBondContact O-N 2.96Å; R137-S140 VanDerWaalsContact O-CB 3.28Å; R137-S140 WeakPolarHBondContact O-CB 3.31Å; R137-S140 PolarHBondContact O-N 2.59Å; R137-S140 VanDerWaalsContact O-N 3.16Å; R137-S140 PolarHBondContact O-OG 3.45Å; R137-V145 HydrophobicContact CB-CG1 4.17Å; R137-V149 HydrophobicContact CB-CG2 3.66Å; R137-V149 HydrophobicContact CG-CG2 4.2Å
138F85.1Confident85.4Confident16 Ų1653.8 Ų53.87%0.0729%0.289CS..Hα-helixtrans-61.9-26.2171.7-68.3-20.9000113M134 V135 T136 S140 I146 V149 L150 F180 P183 L187M134-F138 PolarHBondContact O-N 3.14Å; V135-F138 WeakPolarHBondContact O-CB 3.13Å; V135-F138 PolarHBondContact O-N 2.94Å; V135-F138 VanDerWaalsContact O-N 3.14Å; T136-F138 VanDerWaalsContact C-N 3.33Å; T136-F138 PolarHBondContact O-N 3.37Å; F138-S140 VanDerWaalsContact C-N 3.27Å; F138-S140 PolarHBondContact O-N 2.92Å; F138-I146 HydrophobicContact CD1-CG2 4.22Å; F138-V149 HydrophobicContact CD1-CG1 4.1Å; F138-V149 HydrophobicContact CE1-CB 4.07Å; F138-V149 HydrophobicContact CE1-CG1 3.5Å; F138-V149 HydrophobicContact CZ-CG1 4.15Å; F138-L150 HydrophobicContact CE1-CD2 3.72Å; F138-L150 HydrophobicContact CE1-CG 4Å; F138-L150 HydrophobicContact CZ-CD2 3.68Å; F138-L150 HydrophobicContact CZ-CG 4.45Å; F138-F180 HydrophobicContact CE1-CZ 4.45Å; F138-F180 AromaticContact CE2-CE1 3.88Å; F138-F180 HydrophobicContact CE2-CE1 3.88Å; F138-F180 AromaticContact CE2-CE2 3.96Å; F138-F180 HydrophobicContact CE2-CE2 3.96Å; F138-F180 AromaticContact CE2-CZ 3.56Å; F138-F180 HydrophobicContact CE2-CZ 3.56Å; F138-F180 AromaticContact CZ-CE1 3.78Å; F138-F180 HydrophobicContact CZ-CE1 3.78Å; F138-F180 HydrophobicContact CZ-CE2 4.05Å; F138-F180 AromaticContact CZ-CZ 3.32Å; F138-F180 HydrophobicContact CZ-CZ 3.32Å; F138-P183 HydrophobicContact CD2-CB 4.21Å; F138-L187 HydrophobicContact CD1-CD2 3.93Å; F138-L187 HydrophobicContact CD2-CD2 4.32Å; F138-L187 HydrophobicContact CE1-CD2 4.11Å; F138-L187 HydrophobicContact CE2-CD2 4.49Å; F138-L187 HydrophobicContact CG-CD2 4.04Å; F138-L187 HydrophobicContact CZ-CD2 4.37Å
139R83.1Confident85.5Confident211 Ų21150.2 Ų50.280%0.79627%0.266SS*.THydrogen-bonded Turntrans-84.34.3179.2-59.2-179.1179172.4-0.1113.6T136 R137 G141T136-R139 PolarHBondContact O-N 3.2Å; R137-R139 PolarHBondContact O-N 2.96Å; R139-G141 VanDerWaalsContact C-N 3.27Å; R139-G141 PolarHBondContact O-N 3.48Å
140S83.9Confident85.7Confident57 Ų5744.9 Ų44.940%0.39924%0.237SC..THydrogen-bonded Turntrans-67.9-25.8-177.768.50000113.5R137 F138 D142R137-S140 VanDerWaalsContact O-CB 3.28Å; R137-S140 WeakPolarHBondContact O-CB 3.31Å; R137-S140 PolarHBondContact O-N 2.59Å; R137-S140 VanDerWaalsContact O-N 3.16Å; R137-S140 PolarHBondContact O-OG 3.45Å; F138-S140 VanDerWaalsContact C-N 3.27Å; F138-S140 PolarHBondContact O-N 2.92Å; S140-D142 PolarHBondContact O-N 3.44Å; S140-D142 PolarHBondContact OG-N 2.85Å; S140-D142 VanDerWaalsContact OG-N 3.11Å; S140-D142 PolarHBondContact OG-O 2.9Å
141G79.8Confident85.7Confident63 Ų6348.9 Ų48.965%0.64925%0.253SS*.  trans71.5-4-169.600000114.2R139R139-G141 VanDerWaalsContact C-N 3.27Å; R139-G141 PolarHBondContact O-N 3.48Å
142D85.9Confident85.5Confident80 Ų8048.8 Ų48.843%0.42825%0.252SS..  trans-96.5105.7177.9-176.9-11.5000109.9S140 H144 V145 I146S140-D142 PolarHBondContact O-N 3.44Å; S140-D142 PolarHBondContact OG-N 2.85Å; S140-D142 VanDerWaalsContact OG-N 3.11Å; S140-D142 PolarHBondContact OG-O 2.9Å; D142-H144 PolarHBondContact O-N 3.16Å; D142-H144 VanDerWaalsContact OD1-CB 3.24Å; D142-H144 WeakPolarHBondContact OD1-CB 3.37Å; D142-H144 PolarHBondContact OD1-N 3.45Å; D142-V145 HydrophobicContact CB-CB 4.27Å; D142-V145 HydrophobicContact CB-CG2 4.1Å; D142-V145 WeakPolarHBondContact O-CB 3.43Å; D142-V145 PolarHBondContact O-N 2.94Å; D142-V145 VanDerWaalsContact O-N 3.08Å; D142-I146 VanDerWaalsContact O-CG1 3.32Å; D142-I146 WeakPolarHBondContact O-CG1 3.43Å; D142-I146 PolarHBondContact O-N 3.02Å
143F85.4Confident85.6Confident31 Ų3145 Ų4514%0.13623%0.228CC..Hα-helixtrans-66.9-17.2-178.7-83.3-89.1000114.5I146 N147 T191 L194 V207 L208 S211F143-I146 HydrophobicContact CD1-CD1 4.33Å; F143-I146 HydrophobicContact CD2-CD1 4.47Å; F143-I146 HydrophobicContact CE1-CD1 4.46Å; F143-I146 HydrophobicContact CG-CD1 4.35Å; F143-N147 WeakPolarHBondContact O-CB 3.15Å; F143-N147 VanDerWaalsContact O-CG 3.26Å; F143-N147 PolarHBondContact O-N 3.43Å; F143-N147 PolarHBondContact O-ND2 3.13Å; F143-N147 VanDerWaalsContact O-ND2 3.11Å; F143-T191 HydrophobicContact CE1-CG2 3.98Å; F143-T191 HydrophobicContact CZ-CG2 4.36Å; F143-L194 HydrophobicContact CE2-CD1 3.62Å; F143-L194 HydrophobicContact CZ-CD1 3.68Å; F143-V207 HydrophobicContact CB-CG1 3.33Å; F143-V207 HydrophobicContact CG-CG1 4.19Å; F143-L208 HydrophobicContact CD1-CD2 3.92Å; F143-L208 HydrophobicContact CD2-CD2 3.98Å; F143-L208 HydrophobicContact CE1-CD2 3.51Å; F143-L208 HydrophobicContact CE2-CD2 3.58Å; F143-L208 HydrophobicContact CG-CD2 4.14Å; F143-L208 HydrophobicContact CZ-CD2 3.32Å; F143-S211 VanDerWaalsContact CD1-OG 3.29Å; F143-S211 WeakPolarHBondContact CD1-OG 3.05Å
144H82.6Confident85.9Confident103 Ų10344 Ų4448%0.47722%0.224SC..Hα-helixtrans-67-47.2169.6-173.671.2000110.4D142 N147 G148D142-H144 PolarHBondContact O-N 3.16Å; D142-H144 VanDerWaalsContact OD1-CB 3.24Å; D142-H144 WeakPolarHBondContact OD1-CB 3.37Å; D142-H144 PolarHBondContact OD1-N 3.45Å; H144-N147 PolarHBondContact O-N 2.95Å; H144-G148 PolarHBondContact O-N 3.3Å; H144-G148 VanDerWaalsContact O-N 3.1Å
145V83.9Confident85.8Confident28 Ų2844.7 Ų44.717%0.1723%0.229CC..Hα-helixtrans-65.2-46.4176.1176.60000110.7L101 R137 D142 N147 G148 V149L101-V145 HydrophobicContact CD1-CG1 4.36Å; L101-V145 HydrophobicContact CD2-CG1 4.4Å; R137-V145 HydrophobicContact CB-CG1 4.17Å; D142-V145 HydrophobicContact CB-CB 4.27Å; D142-V145 HydrophobicContact CB-CG2 4.1Å; D142-V145 WeakPolarHBondContact O-CB 3.43Å; D142-V145 PolarHBondContact O-N 2.94Å; D142-V145 VanDerWaalsContact O-N 3.08Å; V145-N147 VanDerWaalsContact C-N 3.34Å; V145-N147 PolarHBondContact O-N 3.06Å; V145-G148 PolarHBondContact O-N 3.24Å; V145-G148 VanDerWaalsContact O-N 3.17Å; V145-V149 WeakPolarHBondContact O-CG2 3.46Å; V145-V149 PolarHBondContact O-N 3.08Å
146I88.7Confident85.7Confident3 Ų344 Ų442%0.01523%0.225CC..Hα-helixtrans-59.1-45.8179.2-64.3167.3000110.5F138 D142 F143 G148 V149 L150 L187F138-I146 HydrophobicContact CD1-CG2 4.22Å; D142-I146 VanDerWaalsContact O-CG1 3.32Å; D142-I146 WeakPolarHBondContact O-CG1 3.43Å; D142-I146 PolarHBondContact O-N 3.02Å; F143-I146 HydrophobicContact CD1-CD1 4.33Å; F143-I146 HydrophobicContact CD2-CD1 4.47Å; F143-I146 HydrophobicContact CE1-CD1 4.46Å; F143-I146 HydrophobicContact CG-CD1 4.35Å; I146-G148 VanDerWaalsContact C-N 3.34Å; I146-G148 PolarHBondContact O-N 2.91Å; I146-V149 PolarHBondContact O-N 3.31Å; I146-L150 HydrophobicContact CG2-CD1 3.8Å; I146-L150 HydrophobicContact CG2-CG 4.17Å; I146-L150 VanDerWaalsContact O-CG 3.29Å; I146-L150 WeakPolarHBondContact O-CG 3.43Å; I146-L150 PolarHBondContact O-N 3.36Å; I146-L187 HydrophobicContact CD1-CD1 4.38Å; I146-L187 HydrophobicContact CG2-CD1 4.31Å; I146-L187 HydrophobicContact CG2-CD2 3.75Å
147N86.2Confident85.8Confident15 Ų1539.9 Ų39.98%0.0820%0.2CC..Hα-helixtrans-62.8-38.6177.3-81.3-32.3000112.7F143 H144 V145 L150 R151 V207 S211 L214F143-N147 WeakPolarHBondContact O-CB 3.15Å; F143-N147 VanDerWaalsContact O-CG 3.26Å; F143-N147 PolarHBondContact O-N 3.43Å; F143-N147 PolarHBondContact O-ND2 3.13Å; F143-N147 VanDerWaalsContact O-ND2 3.11Å; H144-N147 PolarHBondContact O-N 2.95Å; V145-N147 VanDerWaalsContact C-N 3.34Å; V145-N147 PolarHBondContact O-N 3.06Å; N147-L150 PolarHBondContact O-N 3.06Å; N147-R151 WeakPolarHBondContact O-CB 3.12Å; N147-R151 VanDerWaalsContact O-CG 3.27Å; N147-R151 WeakPolarHBondContact O-CG 3.43Å; N147-R151 PolarHBondContact O-N 2.88Å; N147-V207 PolarHBondContact ND2-O 3.32Å; N147-S211 VanDerWaalsContact CG-OG 3.25Å; N147-S211 PolarHBondContact ND2-OG 2.97Å; N147-S211 WeakPolarHBondContact OD1-CA 2.78Å; N147-S211 WeakPolarHBondContact OD1-CB 3.17Å; N147-S211 PolarHBondContact OD1-N 3.13Å; N147-S211 PolarHBondContact OD1-OG 2.93Å; N147-L214 HydrophobicContact CB-CD1 4.4Å
148G82.6Confident85.9Confident1 Ų139.6 Ų39.61%0.0120%0.201CC..Hα-helixtrans-57.5-48.417300000112H144 V145 I146 R151 T152H144-G148 PolarHBondContact O-N 3.3Å; H144-G148 VanDerWaalsContact O-N 3.1Å; V145-G148 PolarHBondContact O-N 3.24Å; V145-G148 VanDerWaalsContact O-N 3.17Å; I146-G148 VanDerWaalsContact C-N 3.34Å; I146-G148 PolarHBondContact O-N 2.91Å; G148-R151 PolarHBondContact O-N 3.18Å; G148-T152 PolarHBondContact O-N 2.88Å; G148-T152 VanDerWaalsContact O-N 3.13Å; G148-T152 PolarHBondContact O-OG1 3.37Å
149V87.7Confident86Confident3 Ų340.6 Ų40.62%0.01820%0.204CC..Hα-helixtrans-62.8-47.3177.9176.40000112L101 M134 R137 F138 V145 I146 R151 T152 A153L101-V149 HydrophobicContact CD1-CG2 4.35Å; L101-V149 HydrophobicContact CD2-CG2 3.86Å; M134-V149 HydrophobicContact CB-CG1 3.6Å; M134-V149 HydrophobicContact CG-CG1 3.85Å; R137-V149 HydrophobicContact CB-CG2 3.66Å; R137-V149 HydrophobicContact CG-CG2 4.2Å; F138-V149 HydrophobicContact CD1-CG1 4.1Å; F138-V149 HydrophobicContact CE1-CB 4.07Å; F138-V149 HydrophobicContact CE1-CG1 3.5Å; F138-V149 HydrophobicContact CZ-CG1 4.15Å; V145-V149 WeakPolarHBondContact O-CG2 3.46Å; V145-V149 PolarHBondContact O-N 3.08Å; I146-V149 PolarHBondContact O-N 3.31Å; V149-R151 VanDerWaalsContact C-N 3.28Å; V149-R151 PolarHBondContact O-N 3.42Å; V149-T152 PolarHBondContact O-N 2.82Å; V149-T152 VanDerWaalsContact O-N 3.17Å; V149-A153 WeakPolarHBondContact O-CB 3.45Å; V149-A153 PolarHBondContact O-N 2.86Å
150L90.9Very high86.4Confident0 Ų030.5 Ų30.50%017%0.166CC..Hα-helixtrans-60.7-37.4178.9-69.8171000111.8F138 I146 N147 H154 L184 L187 L214 I215 L218F138-L150 HydrophobicContact CE1-CD2 3.72Å; F138-L150 HydrophobicContact CE1-CG 4Å; F138-L150 HydrophobicContact CZ-CD2 3.68Å; F138-L150 HydrophobicContact CZ-CG 4.45Å; I146-L150 HydrophobicContact CG2-CD1 3.8Å; I146-L150 HydrophobicContact CG2-CG 4.17Å; I146-L150 VanDerWaalsContact O-CG 3.29Å; I146-L150 WeakPolarHBondContact O-CG 3.43Å; I146-L150 PolarHBondContact O-N 3.36Å; N147-L150 PolarHBondContact O-N 3.06Å; L150-H154 VanDerWaalsContact O-CB 3.27Å; L150-H154 WeakPolarHBondContact O-CB 3.39Å; L150-H154 PolarHBondContact O-N 2.68Å; L150-L184 HydrophobicContact CD2-CD1 3.95Å; L150-L187 HydrophobicContact CD1-CD2 4.42Å; L150-L187 HydrophobicContact CD2-CD2 4.23Å; L150-L214 HydrophobicContact CB-CB 3.83Å; L150-L214 HydrophobicContact CB-CD1 3.9Å; L150-L214 HydrophobicContact CB-CG 4.44Å; L150-L214 HydrophobicContact CD1-CB 4.19Å; L150-I215 HydrophobicContact CD1-CD1 4.38Å; L150-I215 HydrophobicContact CD1-CG1 3.92Å; L150-I215 HydrophobicContact CD2-CG1 3.96Å; L150-L218 HydrophobicContact CB-CD1 4.33Å; L150-L218 HydrophobicContact CD2-CD1 3.45Å; L150-L218 VanDerWaalsContact CD2-CD1 3.45Å; L150-L218 HydrophobicContact CG-CD1 4.5Å
151R85.6Confident86.7Confident85 Ų8530.3 Ų30.332%0.32116%0.157SC..Hα-helixtrans-63.8-44.8174.4-74.3175.2-169.9-77.91.2111.7N147 G148 V149 H154 S155 L214N147-R151 WeakPolarHBondContact O-CB 3.12Å; N147-R151 VanDerWaalsContact O-CG 3.27Å; N147-R151 WeakPolarHBondContact O-CG 3.43Å; N147-R151 PolarHBondContact O-N 2.88Å; G148-R151 PolarHBondContact O-N 3.18Å; V149-R151 VanDerWaalsContact C-N 3.28Å; V149-R151 PolarHBondContact O-N 3.42Å; R151-H154 PolarHBondContact O-N 3.09Å; R151-S155 PolarHBondContact O-N 3.12Å; R151-S155 PolarHBondContact O-OG 2.66Å; R151-L214 HydrophobicContact CG-CD1 3.72Å; R151-L214 HydrophobicContact CG-CD2 3.85Å; R151-L214 HydrophobicContact CG-CG 4.47Å
152T83.4Confident86.9Confident1 Ų134.8 Ų34.81%0.00616%0.16CC..Hα-helixtrans-65.6-45178-55.20000111.5M100 S112 I115 M134 G148 V149 H154 S155 L156M100-T152 HydrophobicContact CE-CG2 4.41Å; M100-T152 WeakPolarHBondContact CE-OG1 3.44Å; S112-T152 PolarHBondContact OG-OG1 3.3Å; I115-T152 HydrophobicContact CB-CG2 4.17Å; I115-T152 HydrophobicContact CD1-CG2 4.13Å; I115-T152 HydrophobicContact CG2-CG2 3.52Å; M134-T152 HydrophobicContact CE-CG2 3.46Å; M134-T152 VanDerWaalsContact CE-CG2 3.46Å; G148-T152 PolarHBondContact O-N 2.88Å; G148-T152 VanDerWaalsContact O-N 3.13Å; G148-T152 PolarHBondContact O-OG1 3.37Å; V149-T152 PolarHBondContact O-N 2.82Å; V149-T152 VanDerWaalsContact O-N 3.17Å; T152-H154 VanDerWaalsContact C-N 3.3Å; T152-H154 PolarHBondContact O-N 3.5Å; T152-S155 PolarHBondContact O-N 3.43Å; T152-L156 PolarHBondContact O-N 3.06Å
153A89.4Confident86.8Confident0 Ų033.8 Ų33.80%015%0.153CC..Hα-helixtrans-58.9-42.8174.100000111.3M134 V149 S155 L156 F157 F180 L218M134-A153 HydrophobicContact SD-CB 4.18Å; V149-A153 WeakPolarHBondContact O-CB 3.45Å; V149-A153 PolarHBondContact O-N 2.86Å; A153-S155 PolarHBondContact O-N 3.36Å; A153-L156 PolarHBondContact O-N 2.81Å; A153-F157 HydrophobicContact CB-CD2 4.33Å; A153-F157 HydrophobicContact CB-CE2 3.94Å; A153-F157 WeakPolarHBondContact O-CB 3.49Å; A153-F157 VanDerWaalsContact O-CD2 3.32Å; A153-F157 WeakPolarHBondContact O-CD2 3.32Å; A153-F157 VanDerWaalsContact O-CG 3.27Å; A153-F157 WeakPolarHBondContact O-CG 3.49Å; A153-F157 PolarHBondContact O-N 2.73Å; A153-F180 HydrophobicContact CB-CE1 4.18Å; A153-F180 HydrophobicContact CB-CZ 3.79Å; A153-L218 HydrophobicContact CB-CD1 4.35Å; A153-L218 HydrophobicContact CB-CD2 3.81Å
154H89.9Confident86.5Confident29 Ų2941.4 Ų41.413%0.13419%0.187CC..Hα-helixtrans-62.5-44.3177.6173.557.7000111.4L150 R151 T152 L156 F157 K158 L218L150-H154 VanDerWaalsContact O-CB 3.27Å; L150-H154 WeakPolarHBondContact O-CB 3.39Å; L150-H154 PolarHBondContact O-N 2.68Å; R151-H154 PolarHBondContact O-N 3.09Å; T152-H154 VanDerWaalsContact C-N 3.3Å; T152-H154 PolarHBondContact O-N 3.5Å; H154-L156 VanDerWaalsContact C-N 3.29Å; H154-L156 PolarHBondContact O-N 3.46Å; H154-F157 PolarHBondContact O-N 2.9Å; H154-K158 WeakPolarHBondContact O-CB 3.33Å; H154-K158 WeakPolarHBondContact O-CG 3.44Å; H154-K158 PolarHBondContact O-N 3.35Å; H154-L218 HydrophobicContact CB-CD2 4.2Å; H154-L218 HydrophobicContact CB-CG 4.37Å
155S84.1Confident86.6Confident18 Ų1842.5 Ų42.513%0.12619%0.19CC..Hα-helixtrans-66.4-30.1178.1-63.90000113.4S116 R151 T152 A153S116-S155 WeakPolarHBondContact OG-CB 3.32Å; R151-S155 PolarHBondContact O-N 3.12Å; R151-S155 PolarHBondContact O-OG 2.66Å; T152-S155 PolarHBondContact O-N 3.43Å; A153-S155 PolarHBondContact O-N 3.36Å
156L86.4Confident86.6Confident2 Ų243.2 Ų43.21%0.0120%0.196CC..Hα-helixtrans-73.2-46.9173.8-173.961.9000111.8F123 L130 T152 A153 H154 R159F123-L156 HydrophobicContact CD1-CD1 4.25Å; F123-L156 HydrophobicContact CD1-CD2 3.9Å; F123-L156 HydrophobicContact CD1-CG 4.34Å; F123-L156 HydrophobicContact CE1-CD2 4.07Å; F123-L156 HydrophobicContact CG-CD2 4.13Å; F123-L156 HydrophobicContact CZ-CD2 4.49Å; L130-L156 HydrophobicContact CD2-CD2 3.92Å; T152-L156 PolarHBondContact O-N 3.06Å; A153-L156 PolarHBondContact O-N 2.81Å; H154-L156 VanDerWaalsContact C-N 3.29Å; H154-L156 PolarHBondContact O-N 3.46Å; L156-R159 VanDerWaalsContact O-CD 3.27Å; L156-R159 WeakPolarHBondContact O-CD 3.35Å; L156-R159 VanDerWaalsContact O-CG 3.23Å; L156-R159 WeakPolarHBondContact O-CG 3.28Å; L156-R159 PolarHBondContact O-NE 3.48Å
157F91.2Very high86.4Confident0 Ų049 Ų490%023%0.227CC..Hα-helixtrans-88-17.4-172.4-53.3-28.4000114F123 L131 A153 H154 R159 Y160 V176 F180 L218 L222F123-F157 HydrophobicContact CE1-CE1 4.43Å; L131-F157 HydrophobicContact CD2-CE1 4.32Å; L131-F157 HydrophobicContact CD2-CZ 3.77Å; A153-F157 HydrophobicContact CB-CD2 4.33Å; A153-F157 HydrophobicContact CB-CE2 3.94Å; A153-F157 WeakPolarHBondContact O-CB 3.49Å; A153-F157 VanDerWaalsContact O-CD2 3.32Å; A153-F157 WeakPolarHBondContact O-CD2 3.32Å; A153-F157 VanDerWaalsContact O-CG 3.27Å; A153-F157 WeakPolarHBondContact O-CG 3.49Å; A153-F157 PolarHBondContact O-N 2.73Å; H154-F157 PolarHBondContact O-N 2.9Å; F157-R159 PolarHBondContact O-N 3.49Å; F157-R159 VanDerWaalsContact O-N 3.13Å; F157-Y160 HydrophobicContact CB-CD2 3.88Å; F157-Y160 HydrophobicContact CB-CE2 3.69Å; F157-Y160 AromaticContact CD1-CE2 3.59Å; F157-Y160 HydrophobicContact CD1-CE2 3.59Å; F157-Y160 AromaticContact CD1-CZ 3.72Å; F157-Y160 WeakPolarHBondContact CD1-OH 3.4Å; F157-Y160 HydrophobicContact CG-CD2 4.5Å; F157-Y160 AromaticContact CG-CE2 3.83Å; F157-Y160 HydrophobicContact CG-CE2 3.83Å; F157-Y160 VanDerWaalsContact O-CB 3.31Å; F157-Y160 WeakPolarHBondContact O-CB 3.39Å; F157-Y160 WeakPolarHBondContact O-CD2 3.23Å; F157-Y160 VanDerWaalsContact O-CG 3.26Å; F157-Y160 PolarHBondContact O-N 2.94Å; F157-V176 HydrophobicContact CD1-CG1 4.41Å; F157-V176 HydrophobicContact CD1-CG2 4.44Å; F157-V176 HydrophobicContact CD2-CG1 4.35Å; F157-V176 HydrophobicContact CE1-CB 4.45Å; F157-V176 HydrophobicContact CE1-CG1 3.82Å; F157-V176 HydrophobicContact CE1-CG2 3.7Å; F157-V176 HydrophobicContact CE2-CG1 3.77Å; F157-V176 HydrophobicContact CZ-CB 4.46Å; F157-V176 HydrophobicContact CZ-CG1 3.48Å; F157-V176 VanDerWaalsContact CZ-CG1 3.48Å; F157-V176 HydrophobicContact CZ-CG2 4.05Å; F157-F180 HydrophobicContact CE2-CD1 4.14Å; F157-F180 HydrophobicContact CE2-CE1 4.13Å; F157-F180 HydrophobicContact CE2-CG 4.48Å; F157-F180 HydrophobicContact CE2-CZ 4.47Å; F157-L218 HydrophobicContact CD2-CD2 3.6Å; F157-L218 HydrophobicContact CE2-CD2 4.22Å; F157-L222 HydrophobicContact CD2-CD2 4.05Å; F157-L222 HydrophobicContact CG-CD2 4.37Å
158K89.2Confident86.4Confident85 Ų8554.3 Ų54.337%0.3725%0.252SS..G310 helixtrans-59.8-23.8175.970.1-177-179-174.60112.8H154 Y160 R161H154-K158 WeakPolarHBondContact O-CB 3.33Å; H154-K158 WeakPolarHBondContact O-CG 3.44Å; H154-K158 PolarHBondContact O-N 3.35Å; K158-Y160 PolarHBondContact O-N 3.38Å; K158-R161 VanDerWaalsContact O-CB 3.3Å; K158-R161 WeakPolarHBondContact O-CB 3.49Å; K158-R161 WeakPolarHBondContact O-CD 3.47Å; K158-R161 VanDerWaalsContact O-CG 3.28Å; K158-R161 WeakPolarHBondContact O-CG 3.33Å; K158-R161 PolarHBondContact O-N 3.32Å; K158-R161 VanDerWaalsContact O-N 3.12Å
159R87.1Confident86.6Confident37 Ų3754.6 Ų54.614%0.1425%0.253CS..G310 helixtrans-62-28.7175.676.5-168.7176143.1-15.7112.9R120 L156 F157 R161 H162 E163 E172R120-R159 PolarHBondContact O-NH1 3.28Å; L156-R159 VanDerWaalsContact O-CD 3.27Å; L156-R159 WeakPolarHBondContact O-CD 3.35Å; L156-R159 VanDerWaalsContact O-CG 3.23Å; L156-R159 WeakPolarHBondContact O-CG 3.28Å; L156-R159 PolarHBondContact O-NE 3.48Å; F157-R159 PolarHBondContact O-N 3.49Å; F157-R159 VanDerWaalsContact O-N 3.13Å; R159-R161 PolarHBondContact O-N 2.92Å; R159-H162 PolarHBondContact O-N 3.09Å; R159-E163 WeakPolarHBondContact CD-OE1 3.46Å; R159-E163 WeakPolarHBondContact CG-OE1 3.4Å; R159-E163 IonicContact NE-OE1 2.73Å; R159-E163 IonicContact NH1-OE1 3.58Å; R159-E163 PolarHBondContact O-N 3.04Å; R159-E163 VanDerWaalsContact O-N 3.09Å; R159-E172 IonicContact CZ-OE1 2.82Å; R159-E172 IonicContact CZ-OE2 3.96Å; R159-E172 IonicContact NE-OE1 2.79Å; R159-E172 IonicContact NH2-OE1 2.58Å; R159-E172 PolarHBondContact NH2-OE1 3.33Å; R159-E172 IonicContact NH2-OE2 3.98Å; R159-E172 PolarHBondContact NH2-OE2 3.28Å
160Y90.6Very high86.6Confident0 Ų058.7 Ų58.70%027%0.268CS..G310 helixtrans-59.9-16.8176-55-22.9000112.5F157 K158 H162 L169 E172 I173 L222 Q225F157-Y160 HydrophobicContact CB-CD2 3.88Å; F157-Y160 HydrophobicContact CB-CE2 3.69Å; F157-Y160 AromaticContact CD1-CE2 3.59Å; F157-Y160 HydrophobicContact CD1-CE2 3.59Å; F157-Y160 AromaticContact CD1-CZ 3.72Å; F157-Y160 WeakPolarHBondContact CD1-OH 3.4Å; F157-Y160 HydrophobicContact CG-CD2 4.5Å; F157-Y160 AromaticContact CG-CE2 3.83Å; F157-Y160 HydrophobicContact CG-CE2 3.83Å; F157-Y160 VanDerWaalsContact O-CB 3.31Å; F157-Y160 WeakPolarHBondContact O-CB 3.39Å; F157-Y160 WeakPolarHBondContact O-CD2 3.23Å; F157-Y160 VanDerWaalsContact O-CG 3.26Å; F157-Y160 PolarHBondContact O-N 2.94Å; K158-Y160 PolarHBondContact O-N 3.38Å; Y160-H162 VanDerWaalsContact C-N 3.29Å; Y160-L169 HydrophobicContact CD1-CD1 3.6Å; Y160-L169 HydrophobicContact CE1-CD1 3.83Å; Y160-E172 WeakPolarHBondContact CE1-OE1 3.31Å; Y160-E172 VanDerWaalsContact CZ-OE1 3.3Å; Y160-E172 PolarHBondContact OH-OE1 2.98Å; Y160-I173 HydrophobicContact CD1-CG1 4.37Å; Y160-I173 HydrophobicContact CD2-CD1 4.38Å; Y160-I173 HydrophobicContact CD2-CG1 4.04Å; Y160-I173 HydrophobicContact CE1-CG1 4.29Å; Y160-I173 HydrophobicContact CE2-CG1 3.96Å; Y160-I173 HydrophobicContact CG-CD1 4.26Å; Y160-I173 HydrophobicContact CG-CG1 4.25Å; Y160-L222 HydrophobicContact CE2-CD2 4.41Å; Y160-Q225 WeakPolarHBondContact O-CG 3.49Å; Y160-Q225 PolarHBondContact O-NE2 3.47Å
161R89.6Confident86.6Confident52 Ų5263.1 Ų63.120%0.19630%0.295CS..G310 helixtrans-74.8-19.2176.2-55.6170.5-170.1-161.3-5.1113.5K158 R159 K217 Y220 S221 F224K158-R161 VanDerWaalsContact O-CB 3.3Å; K158-R161 WeakPolarHBondContact O-CB 3.49Å; K158-R161 WeakPolarHBondContact O-CD 3.47Å; K158-R161 VanDerWaalsContact O-CG 3.28Å; K158-R161 WeakPolarHBondContact O-CG 3.33Å; K158-R161 PolarHBondContact O-N 3.32Å; K158-R161 VanDerWaalsContact O-N 3.12Å; R159-R161 PolarHBondContact O-N 2.92Å; R161-K217 PolarHBondContact NH2-O 2.92Å; R161-Y220 HydrophobicContact CG-CD1 4.42Å; R161-Y220 HydrophobicContact CG-CE1 4.29Å; R161-Y220 VanDerWaalsContact CZ-CD1 3.47Å; R161-S221 PolarHBondContact NE-OG 2.77Å; R161-S221 PolarHBondContact NH2-OG 2.95Å; R161-F224 VanDerWaalsContact CA-CD1 3.46Å; R161-F224 HydrophobicContact CB-CD1 4.2Å; R161-F224 HydrophobicContact CB-CD2 4.34Å; R161-F224 HydrophobicContact CB-CE1 4.24Å; R161-F224 HydrophobicContact CB-CE2 4.37Å; R161-F224 HydrophobicContact CB-CG 4.21Å; R161-F224 HydrophobicContact CB-CZ 4.31Å; R161-F224 HydrophobicContact CG-CB 4.28Å; R161-F224 HydrophobicContact CG-CD1 4.48Å; R161-F224 HydrophobicContact CG-CD2 4.12Å; R161-F224 HydrophobicContact CG-CG 4.03Å; R161-F224 WeakPolarHBondContact O-CE1 3.4Å; R161-F224 WeakPolarHBondContact O-CZ 3.39Å
162H85.6Confident86.8Confident158 Ų15859.7 Ų59.773%0.73128%0.283SS*.THydrogen-bonded Turntrans-125-14.6-170.2-51.6-64.6000113.2R159 Y160R159-H162 PolarHBondContact O-N 3.09Å; Y160-H162 VanDerWaalsContact C-N 3.29Å
163E82.2Confident87.3Confident58 Ų5860.1 Ų60.127%0.27129%0.285SS..SBendtrans-78.4144.2176.9-70.8-175-169.600112.1R159 L169 Q225R159-E163 WeakPolarHBondContact CD-OE1 3.46Å; R159-E163 WeakPolarHBondContact CG-OE1 3.4Å; R159-E163 IonicContact NE-OE1 2.73Å; R159-E163 IonicContact NH1-OE1 3.58Å; R159-E163 PolarHBondContact O-N 3.04Å; R159-E163 VanDerWaalsContact O-N 3.09Å; E163-L169 HydrophobicContact CB-CD2 3.94Å; E163-Q225 PolarHBondContact O-NE2 3.5Å
164F80.4Confident87.4Confident192 Ų19266.5 Ų66.584%0.84231%0.312SS*.PPolyproline II helixtrans-74.7151.8174.9-69.7-75.4000111.3S166 L169F164-S166 PolarHBondContact O-N 3.5Å; F164-L169 WeakPolarHBondContact O-CD2 3.48Å
165K83.2Confident87.6Confident125 Ų12568.5 Ų68.554%0.54332%0.324SS..PPolyproline II helixtrans-61.3123.1177.4-65.8-172.4175.9-161.70110.5W170 Q225K165-W170 HydrophobicContact CD-CZ2 4.14Å; K165-Q225 WeakPolarHBondContact CE-O 3.34Å; K165-Q225 PolarHBondContact NZ-O 3.02Å; K165-Q225 VanDerWaalsContact NZ-O 3.13Å
166S85.2Confident88Confident43 Ų4367.6 Ų67.630%0.30132%0.318SS..  trans-144.7158.1173.675.70000110.8F164 E168 L169 W170F164-S166 PolarHBondContact O-N 3.5Å; S166-E168 WeakPolarHBondContact CB-OE2 3.44Å; S166-E168 PolarHBondContact O-N 2.97Å; S166-E168 PolarHBondContact OG-OE2 3.38Å; S166-L169 PolarHBondContact O-N 3.38Å; S166-L169 WeakPolarHBondContact OG-CB 3.24Å; S166-L169 PolarHBondContact OG-N 3.18Å; S166-L169 VanDerWaalsContact OG-N 3.09Å; S166-W170 PolarHBondContact O-N 3.22Å
167N85.1Confident88.4Confident126 Ų12668.9 Ų68.967%0.67432%0.324SS*.Hα-helixtrans-61.8-34.3178.6-72.8-25.1000111.6T171N167-T171 WeakPolarHBondContact O-CB 3.22Å; N167-T171 PolarHBondContact O-N 3.1Å; N167-T171 PolarHBondContact O-OG1 3.1Å
168E84.8Confident88.5Confident126 Ų12674.8 Ų74.859%0.58936%0.356SS*.Hα-helixtrans-63.3-49.1176.3-61.270.8-152.100110.4S166 W170 T171 E172S166-E168 WeakPolarHBondContact CB-OE2 3.44Å; S166-E168 PolarHBondContact O-N 2.97Å; S166-E168 PolarHBondContact OG-OE2 3.38Å; E168-W170 PolarHBondContact O-N 3.34Å; E168-T171 PolarHBondContact O-N 3.18Å; E168-E172 PolarHBondContact O-N 2.88Å
169L87.2Confident88.6Confident6 Ų672.8 Ų72.83%0.03135%0.351CS..Hα-helixtrans-62.5-43.9177.7177.760.7000111.4Y160 E163 F164 S166 T171 E172 I173Y160-L169 HydrophobicContact CD1-CD1 3.6Å; Y160-L169 HydrophobicContact CE1-CD1 3.83Å; E163-L169 HydrophobicContact CB-CD2 3.94Å; F164-L169 WeakPolarHBondContact O-CD2 3.48Å; S166-L169 PolarHBondContact O-N 3.38Å; S166-L169 WeakPolarHBondContact OG-CB 3.24Å; S166-L169 PolarHBondContact OG-N 3.18Å; S166-L169 VanDerWaalsContact OG-N 3.09Å; L169-T171 VanDerWaalsContact C-N 3.34Å; L169-T171 PolarHBondContact O-N 2.95Å; L169-E172 PolarHBondContact O-N 3.5Å; L169-I173 HydrophobicContact CD1-CD1 3.89Å; L169-I173 HydrophobicContact CD1-CG1 4.11Å; L169-I173 HydrophobicContact CD2-CD1 4.44Å; L169-I173 HydrophobicContact CG-CD1 3.83Å; L169-I173 HydrophobicContact CG-CG1 4.42Å; L169-I173 WeakPolarHBondContact O-CG1 3.13Å; L169-I173 PolarHBondContact O-N 3.48Å
170W88.1Confident88.9Confident90 Ų9071 Ų7134%0.34134%0.344SS..Hα-helixtrans-62.7-40177.6-77.6118.2000112.9K165 S166 E168 E172 I173 K174 D226K165-W170 HydrophobicContact CD-CZ2 4.14Å; S166-W170 PolarHBondContact O-N 3.22Å; E168-W170 PolarHBondContact O-N 3.34Å; W170-E172 VanDerWaalsContact C-N 3.33Å; W170-I173 PolarHBondContact O-N 2.76Å; W170-K174 VanDerWaalsContact O-CB 3.29Å; W170-K174 WeakPolarHBondContact O-CB 3.43Å; W170-K174 PolarHBondContact O-N 3.38Å; W170-D226 HydrophobicContact CH2-CB 3.47Å; W170-D226 VanDerWaalsContact CH2-CB 3.47Å; W170-D226 WeakPolarHBondContact CH2-OD2 3.03Å; W170-D226 HydrophobicContact CZ3-CB 3.99Å
171T89.9Confident89.1Confident93 Ų9371 Ų7157%0.57134%0.344SS*.Hα-helixtrans-64.4-41.4176.7-57.70000110.8N167 E168 L169 L175N167-T171 WeakPolarHBondContact O-CB 3.22Å; N167-T171 PolarHBondContact O-N 3.1Å; N167-T171 PolarHBondContact O-OG1 3.1Å; E168-T171 PolarHBondContact O-N 3.18Å; L169-T171 VanDerWaalsContact C-N 3.34Å; L169-T171 PolarHBondContact O-N 2.95Å; T171-L175 PolarHBondContact O-N 2.88Å; T171-L175 VanDerWaalsContact O-N 3.08Å
172E91.3Very high89.3Confident13 Ų1372.9 Ų72.96%0.06136%0.358CS..Hα-helixtrans-63.8-51.6174.5-177.8-177.7138.100112F123 P124 R159 Y160 E168 L169 W170 K174 L175 V176F123-E172 HydrophobicContact CD1-CG 4.06Å; F123-E172 WeakPolarHBondContact CD1-OE1 3.16Å; F123-E172 HydrophobicContact CE1-CG 3.56Å; F123-E172 VanDerWaalsContact CE1-OE1 3.31Å; F123-E172 WeakPolarHBondContact CE1-OE1 3.43Å; F123-E172 HydrophobicContact CZ-CG 4.39Å; P124-E172 WeakPolarHBondContact CD-OE2 3.35Å; P124-E172 HydrophobicContact CG-CB 4.21Å; P124-E172 HydrophobicContact CG-CG 4.05Å; R159-E172 IonicContact CZ-OE1 2.82Å; R159-E172 IonicContact CZ-OE2 3.96Å; R159-E172 IonicContact NE-OE1 2.79Å; R159-E172 IonicContact NH2-OE1 2.58Å; R159-E172 PolarHBondContact NH2-OE1 3.33Å; R159-E172 IonicContact NH2-OE2 3.98Å; R159-E172 PolarHBondContact NH2-OE2 3.28Å; Y160-E172 WeakPolarHBondContact CE1-OE1 3.31Å; Y160-E172 VanDerWaalsContact CZ-OE1 3.3Å; Y160-E172 PolarHBondContact OH-OE1 2.98Å; E168-E172 PolarHBondContact O-N 2.88Å; L169-E172 PolarHBondContact O-N 3.5Å; W170-E172 VanDerWaalsContact C-N 3.33Å; E172-K174 VanDerWaalsContact C-N 3.25Å; E172-K174 PolarHBondContact O-N 3.09Å; E172-L175 WeakPolarHBondContact O-CB 3.22Å; E172-L175 PolarHBondContact O-N 3.42Å; E172-L175 VanDerWaalsContact O-N 3.13Å; E172-V176 WeakPolarHBondContact O-CG2 3.49Å; E172-V176 PolarHBondContact O-N 3.39Å
173I92.4Very high89.8Confident9 Ų966.5 Ų66.55%0.04633%0.33CS..Hα-helixtrans-57.3-42.8179.2-71.9172.4000110.1Y160 L169 W170 V176 L177 Q225Y160-I173 HydrophobicContact CD1-CG1 4.37Å; Y160-I173 HydrophobicContact CD2-CD1 4.38Å; Y160-I173 HydrophobicContact CD2-CG1 4.04Å; Y160-I173 HydrophobicContact CE1-CG1 4.29Å; Y160-I173 HydrophobicContact CE2-CG1 3.96Å; Y160-I173 HydrophobicContact CG-CD1 4.26Å; Y160-I173 HydrophobicContact CG-CG1 4.25Å; L169-I173 HydrophobicContact CD1-CD1 3.89Å; L169-I173 HydrophobicContact CD1-CG1 4.11Å; L169-I173 HydrophobicContact CD2-CD1 4.44Å; L169-I173 HydrophobicContact CG-CD1 3.83Å; L169-I173 HydrophobicContact CG-CG1 4.42Å; L169-I173 WeakPolarHBondContact O-CG1 3.13Å; L169-I173 PolarHBondContact O-N 3.48Å; W170-I173 PolarHBondContact O-N 2.76Å; I173-V176 WeakPolarHBondContact O-CB 3.45Å; I173-V176 PolarHBondContact O-N 2.95Å; I173-L177 HydrophobicContact CG2-CD1 3.64Å; I173-L177 HydrophobicContact CG2-CG 4.16Å; I173-L177 WeakPolarHBondContact O-CB 3.45Å; I173-L177 VanDerWaalsContact O-CG 3.22Å; I173-L177 WeakPolarHBondContact O-CG 3.3Å; I173-L177 PolarHBondContact O-N 2.85Å; I173-Q225 HydrophobicContact CD1-CB 4.18Å; I173-Q225 HydrophobicContact CD1-CG 3.91Å
174K92.6Very high90.5Very high134 Ų13463.8 Ų63.858%0.58332%0.317SS*.Hα-helixtrans-59.6-48.1176.4-174.4172.9-178174.10112.2W170 E172 V176 L177 D178W170-K174 VanDerWaalsContact O-CB 3.29Å; W170-K174 WeakPolarHBondContact O-CB 3.43Å; W170-K174 PolarHBondContact O-N 3.38Å; E172-K174 VanDerWaalsContact C-N 3.25Å; E172-K174 PolarHBondContact O-N 3.09Å; K174-V176 VanDerWaalsContact C-N 3.28Å; K174-V176 PolarHBondContact O-N 3.15Å; K174-L177 PolarHBondContact O-N 3.42Å; K174-L177 VanDerWaalsContact O-N 3.17Å; K174-D178 WeakPolarHBondContact O-CB 3.49Å; K174-D178 VanDerWaalsContact O-CG 3.25Å; K174-D178 PolarHBondContact O-N 3.38Å
175L92.8Very high91.2Very high71 Ų7154.7 Ų54.737%0.37228%0.278SS..Hα-helixtrans-58-41.8176.2178.569.3000112P124 L131 T171 E172 T179P124-L175 HydrophobicContact CB-CD2 3.45Å; P124-L175 VanDerWaalsContact CB-CD2 3.45Å; P124-L175 HydrophobicContact CG-CD2 4.07Å; L131-L175 HydrophobicContact CD1-CG 4.2Å; T171-L175 PolarHBondContact O-N 2.88Å; T171-L175 VanDerWaalsContact O-N 3.08Å; E172-L175 WeakPolarHBondContact O-CB 3.22Å; E172-L175 PolarHBondContact O-N 3.42Å; E172-L175 VanDerWaalsContact O-N 3.13Å; L175-T179 WeakPolarHBondContact O-CB 3.45Å; L175-T179 PolarHBondContact O-N 2.69Å; L175-T179 PolarHBondContact O-OG1 3.34Å
176V93.9Very high91.8Very high0 Ų053.4 Ų53.40%027%0.274CS..Hα-helixtrans-63.2-47176173.60000110.7F123 L131 F157 E172 I173 K174 T179 F180 L222F123-V176 HydrophobicContact CE1-CG2 3.86Å; F123-V176 HydrophobicContact CZ-CG2 3.69Å; L131-V176 HydrophobicContact CD1-CG2 4.08Å; L131-V176 HydrophobicContact CD2-CG2 4.26Å; F157-V176 HydrophobicContact CD1-CG1 4.41Å; F157-V176 HydrophobicContact CD1-CG2 4.44Å; F157-V176 HydrophobicContact CD2-CG1 4.35Å; F157-V176 HydrophobicContact CE1-CB 4.45Å; F157-V176 HydrophobicContact CE1-CG1 3.82Å; F157-V176 HydrophobicContact CE1-CG2 3.7Å; F157-V176 HydrophobicContact CE2-CG1 3.77Å; F157-V176 HydrophobicContact CZ-CB 4.46Å; F157-V176 HydrophobicContact CZ-CG1 3.48Å; F157-V176 VanDerWaalsContact CZ-CG1 3.48Å; F157-V176 HydrophobicContact CZ-CG2 4.05Å; E172-V176 WeakPolarHBondContact O-CG2 3.49Å; E172-V176 PolarHBondContact O-N 3.39Å; I173-V176 WeakPolarHBondContact O-CB 3.45Å; I173-V176 PolarHBondContact O-N 2.95Å; K174-V176 VanDerWaalsContact C-N 3.28Å; K174-V176 PolarHBondContact O-N 3.15Å; V176-T179 PolarHBondContact O-N 3.06Å; V176-F180 HydrophobicContact CG1-CB 4.14Å; V176-F180 WeakPolarHBondContact O-CA 3.35Å; V176-F180 WeakPolarHBondContact O-CB 3.43Å; V176-F180 PolarHBondContact O-N 3.06Å; V176-L222 HydrophobicContact CG1-CD2 3.67Å
177L93.9Very high92.3Very high29 Ų2952.2 Ų52.215%0.15226%0.264CS..Hα-helixtrans-61.7-47.8179.9-70.2164.7000111.7I173 K174 T179 F180 A181 L222 P228 F231I173-L177 HydrophobicContact CG2-CD1 3.64Å; I173-L177 HydrophobicContact CG2-CG 4.16Å; I173-L177 WeakPolarHBondContact O-CB 3.45Å; I173-L177 VanDerWaalsContact O-CG 3.22Å; I173-L177 WeakPolarHBondContact O-CG 3.3Å; I173-L177 PolarHBondContact O-N 2.85Å; K174-L177 PolarHBondContact O-N 3.42Å; K174-L177 VanDerWaalsContact O-N 3.17Å; L177-T179 PolarHBondContact O-N 2.88Å; L177-T179 VanDerWaalsContact O-N 3.16Å; L177-F180 PolarHBondContact O-N 3.32Å; L177-A181 HydrophobicContact CD2-CB 4.27Å; L177-A181 VanDerWaalsContact O-CB 3.24Å; L177-A181 WeakPolarHBondContact O-CB 3.45Å; L177-A181 PolarHBondContact O-N 3.17Å; L177-A181 VanDerWaalsContact O-N 3.13Å; L177-L222 HydrophobicContact CD2-CB 4.48Å; L177-P228 HydrophobicContact CD1-CB 3.63Å; L177-P228 HydrophobicContact CD1-CG 3.85Å; L177-P228 HydrophobicContact CD2-CB 3.83Å; L177-P228 HydrophobicContact CD2-CG 3.79Å; L177-P228 HydrophobicContact CG-CB 4.36Å; L177-P228 HydrophobicContact CG-CG 4.48Å; L177-F231 HydrophobicContact CD2-CD2 4.18Å; L177-F231 HydrophobicContact CD2-CE2 3.68Å
178D93.1Very high92.9Very high123 Ų12346.2 Ų46.266%0.65823%0.232SC*.Hα-helixtrans-58.5-29.8179.8-70.4-16.5000112.2K174K174-D178 WeakPolarHBondContact O-CB 3.49Å; K174-D178 VanDerWaalsContact O-CG 3.25Å; K174-D178 PolarHBondContact O-N 3.38Å
179T91.5Very high93.4Very high43 Ų4344.1 Ų44.126%0.26422%0.221SC..Hα-helixtrans-100.1-33.5-176.1-47.40000113.3L131 V135 L175 V176 L177 P183L131-T179 HydrophobicContact CB-CG2 3.94Å; L131-T179 HydrophobicContact CD1-CG2 4.47Å; V135-T179 HydrophobicContact CG2-CG2 4.4Å; L175-T179 WeakPolarHBondContact O-CB 3.45Å; L175-T179 PolarHBondContact O-N 2.69Å; L175-T179 PolarHBondContact O-OG1 3.34Å; V176-T179 PolarHBondContact O-N 3.06Å; L177-T179 PolarHBondContact O-N 2.88Å; L177-T179 VanDerWaalsContact O-N 3.16Å; T179-P183 WeakPolarHBondContact O-CG 3.33Å
180F92.4Very high93.7Very high0 Ų045.8 Ų45.80%024%0.236CC..Hα-helixtrans-115-26.5-161.2-146-97.1000113.9L131 M134 V135 F138 A153 F157 V176 L177 L184 L218L131-F180 HydrophobicContact CD2-CD2 4.18Å; M134-F180 HydrophobicContact CB-CE2 3.95Å; M134-F180 HydrophobicContact SD-CE2 4.48Å; V135-F180 HydrophobicContact CG2-CD2 3.49Å; V135-F180 VanDerWaalsContact CG2-CD2 3.49Å; V135-F180 HydrophobicContact CG2-CE2 3.84Å; V135-F180 HydrophobicContact CG2-CG 4.41Å; F138-F180 HydrophobicContact CE1-CZ 4.45Å; F138-F180 AromaticContact CE2-CE1 3.88Å; F138-F180 HydrophobicContact CE2-CE1 3.88Å; F138-F180 AromaticContact CE2-CE2 3.96Å; F138-F180 HydrophobicContact CE2-CE2 3.96Å; F138-F180 AromaticContact CE2-CZ 3.56Å; F138-F180 HydrophobicContact CE2-CZ 3.56Å; F138-F180 AromaticContact CZ-CE1 3.78Å; F138-F180 HydrophobicContact CZ-CE1 3.78Å; F138-F180 HydrophobicContact CZ-CE2 4.05Å; F138-F180 AromaticContact CZ-CZ 3.32Å; F138-F180 HydrophobicContact CZ-CZ 3.32Å; A153-F180 HydrophobicContact CB-CE1 4.18Å; A153-F180 HydrophobicContact CB-CZ 3.79Å; F157-F180 HydrophobicContact CE2-CD1 4.14Å; F157-F180 HydrophobicContact CE2-CE1 4.13Å; F157-F180 HydrophobicContact CE2-CG 4.48Å; F157-F180 HydrophobicContact CE2-CZ 4.47Å; V176-F180 HydrophobicContact CG1-CB 4.14Å; V176-F180 WeakPolarHBondContact O-CA 3.35Å; V176-F180 WeakPolarHBondContact O-CB 3.43Å; V176-F180 PolarHBondContact O-N 3.06Å; L177-F180 PolarHBondContact O-N 3.32Å; F180-L184 HydrophobicContact CD1-CB 4.3Å; F180-L184 HydrophobicContact CE1-CD1 4.42Å; F180-L184 WeakPolarHBondContact O-CB 3.49Å; F180-L184 PolarHBondContact O-N 3.01Å; F180-L218 HydrophobicContact CE1-CD1 4.49Å
181A94.8Very high94.1Very high0 Ų041.5 Ų41.50%022%0.219CC..Hα-helixtrans-65.9-45.2-17200000112.9L177 T185 F230 F231L177-A181 HydrophobicContact CD2-CB 4.27Å; L177-A181 VanDerWaalsContact O-CB 3.24Å; L177-A181 WeakPolarHBondContact O-CB 3.45Å; L177-A181 PolarHBondContact O-N 3.17Å; L177-A181 VanDerWaalsContact O-N 3.13Å; A181-T185 WeakPolarHBondContact O-CB 3.28Å; A181-T185 PolarHBondContact O-N 2.93Å; A181-T185 VanDerWaalsContact O-N 3.08Å; A181-T185 PolarHBondContact O-OG1 3.22Å; A181-F230 HydrophobicContact CB-CB 4.42Å; A181-F230 HydrophobicContact CB-CD1 3.52Å; A181-F230 HydrophobicContact CB-CE1 3.92Å; A181-F230 HydrophobicContact CB-CG 3.88Å; A181-F231 HydrophobicContact CB-CE2 4.28Å; A181-F231 HydrophobicContact CB-CZ 4.19Å
182L95.6Very high94.3Very high92 Ų9237.8 Ų37.848%0.48220%0.196SC..Hα-helixtrans-65.5-54.5176.8173.767.2000112.2L184 T185 E186 F230L182-L184 VanDerWaalsContact C-N 3.26Å; L182-L184 PolarHBondContact O-N 3.22Å; L182-T185 PolarHBondContact O-N 3.12Å; L182-E186 HydrophobicContact CD1-CG 4.1Å; L182-E186 WeakPolarHBondContact O-CG 3.32Å; L182-E186 PolarHBondContact O-N 3.41Å; L182-F230 HydrophobicContact CB-CE2 3.83Å; L182-F230 HydrophobicContact CB-CZ 3.88Å; L182-F230 HydrophobicContact CD1-CE2 4.17Å; L182-F230 HydrophobicContact CD1-CZ 4.06Å
183P95.1Very high94.3Very high24 Ų2443 Ų4316%0.15622%0.22CC..Hα-helixtrans-56.8-37.5177.5-27.234.9000113.9V135 F138 T179 L187V135-P183 HydrophobicContact CG1-CB 3.91Å; V135-P183 HydrophobicContact CG1-CG 3.73Å; V135-P183 HydrophobicContact CG2-CG 4.38Å; F138-P183 HydrophobicContact CD2-CB 4.21Å; T179-P183 WeakPolarHBondContact O-CG 3.33Å; P183-L187 VanDerWaalsContact O-CB 3.31Å; P183-L187 WeakPolarHBondContact O-CB 3.44Å; P183-L187 PolarHBondContact O-N 2.86Å
184L96.1Very high94.3Very high0 Ų045.4 Ų45.40%023%0.233CC..Hα-helixtrans-64.8-41.7176.6-176.168.2000111.7L150 F180 L182 L187 F188 I215 L218 L222L150-L184 HydrophobicContact CD2-CD1 3.95Å; F180-L184 HydrophobicContact CD1-CB 4.3Å; F180-L184 HydrophobicContact CE1-CD1 4.42Å; F180-L184 WeakPolarHBondContact O-CB 3.49Å; F180-L184 PolarHBondContact O-N 3.01Å; L182-L184 VanDerWaalsContact C-N 3.26Å; L182-L184 PolarHBondContact O-N 3.22Å; L184-L187 PolarHBondContact O-N 3.43Å; L184-F188 WeakPolarHBondContact O-CB 3.49Å; L184-F188 PolarHBondContact O-N 2.96Å; L184-I215 HydrophobicContact CD1-CB 4.36Å; L184-I215 HydrophobicContact CD1-CG1 3.96Å; L184-I215 HydrophobicContact CD1-CG2 4.05Å; L184-I215 HydrophobicContact CG-CG2 4.29Å; L184-L218 HydrophobicContact CD1-CD1 3.93Å; L184-L218 HydrophobicContact CD2-CB 3.91Å; L184-L222 HydrophobicContact CD2-CD1 4.03Å
185T96.4Very high94.2Very high2 Ų239.7 Ų39.71%0.01221%0.21CC..Hα-helixtrans-69.3-37.5178.9-570000111.8A181 L182 F188 K189 F230 W238A181-T185 WeakPolarHBondContact O-CB 3.28Å; A181-T185 PolarHBondContact O-N 2.93Å; A181-T185 VanDerWaalsContact O-N 3.08Å; A181-T185 PolarHBondContact O-OG1 3.22Å; L182-T185 PolarHBondContact O-N 3.12Å; T185-F188 WeakPolarHBondContact O-CB 3.26Å; T185-F188 PolarHBondContact O-N 3.36Å; T185-K189 WeakPolarHBondContact O-CG 3.42Å; T185-K189 PolarHBondContact O-N 2.97Å; T185-F230 WeakPolarHBondContact OG1-CE1 3.42Å; T185-W238 HydrophobicContact CG2-CZ2 4.2Å; T185-W238 WeakPolarHBondContact OG1-CZ2 3.46Å; T185-W238 PolarHBondContact OG1-NE1 2.81Å
186E95.6Very high94Very high98 Ų9843 Ų4346%0.45822%0.223SC..Hα-helixtrans-65.3-44.6173.1-68.9-178.7141.800111.7L182 F188 K189 A190L182-E186 HydrophobicContact CD1-CG 4.1Å; L182-E186 WeakPolarHBondContact O-CG 3.32Å; L182-E186 PolarHBondContact O-N 3.41Å; E186-F188 VanDerWaalsContact C-N 3.31Å; E186-F188 PolarHBondContact O-N 2.8Å; E186-K189 PolarHBondContact O-N 3.22Å; E186-A190 WeakPolarHBondContact O-CB 3.4Å; E186-A190 PolarHBondContact O-N 3.49Å
187L95.6Very high93.8Very high17 Ų1748.2 Ų48.29%0.08926%0.255CS..Hα-helixtrans-61-40.4175.2179.963.8000111.6F138 I146 L150 P183 L184 A190 T191 I215F138-L187 HydrophobicContact CD1-CD2 3.93Å; F138-L187 HydrophobicContact CD2-CD2 4.32Å; F138-L187 HydrophobicContact CE1-CD2 4.11Å; F138-L187 HydrophobicContact CE2-CD2 4.49Å; F138-L187 HydrophobicContact CG-CD2 4.04Å; F138-L187 HydrophobicContact CZ-CD2 4.37Å; I146-L187 HydrophobicContact CD1-CD1 4.38Å; I146-L187 HydrophobicContact CG2-CD1 4.31Å; I146-L187 HydrophobicContact CG2-CD2 3.75Å; L150-L187 HydrophobicContact CD1-CD2 4.42Å; L150-L187 HydrophobicContact CD2-CD2 4.23Å; P183-L187 VanDerWaalsContact O-CB 3.31Å; P183-L187 WeakPolarHBondContact O-CB 3.44Å; P183-L187 PolarHBondContact O-N 2.86Å; L184-L187 PolarHBondContact O-N 3.43Å; L187-A190 PolarHBondContact O-N 3.12Å; L187-T191 VanDerWaalsContact O-CB 3.3Å; L187-T191 WeakPolarHBondContact O-CB 3.37Å; L187-T191 PolarHBondContact O-N 3.06Å; L187-T191 PolarHBondContact O-OG1 3.46Å; L187-I215 HydrophobicContact CD2-CD1 4.13Å; L187-I215 HydrophobicContact CG-CD1 4.01Å
188F96.8Very high93.5Very high0 Ų050.5 Ų50.50%027%0.265CS..Hα-helixtrans-57.7-52.7176.2179.3-124.2000111.9L184 T185 E186 T191 I192 L212 I215 W238 N241 F242 L245L184-F188 WeakPolarHBondContact O-CB 3.49Å; L184-F188 PolarHBondContact O-N 2.96Å; T185-F188 WeakPolarHBondContact O-CB 3.26Å; T185-F188 PolarHBondContact O-N 3.36Å; E186-F188 VanDerWaalsContact C-N 3.31Å; E186-F188 PolarHBondContact O-N 2.8Å; F188-T191 PolarHBondContact O-N 2.7Å; F188-I192 HydrophobicContact CD1-CD1 4.33Å; F188-I192 HydrophobicContact CD2-CD1 4.16Å; F188-I192 HydrophobicContact CE1-CD1 3.88Å; F188-I192 HydrophobicContact CE2-CD1 3.7Å; F188-I192 HydrophobicContact CE2-CG1 4.35Å; F188-I192 HydrophobicContact CG-CD1 4.47Å; F188-I192 HydrophobicContact CZ-CD1 3.55Å; F188-I192 WeakPolarHBondContact O-CG1 3.37Å; F188-I192 PolarHBondContact O-N 3.43Å; F188-I192 VanDerWaalsContact O-N 3.11Å; F188-L212 HydrophobicContact CD2-CD2 3.75Å; F188-L212 HydrophobicContact CE2-CD2 3.9Å; F188-I215 HydrophobicContact CB-CG2 3.91Å; F188-I215 HydrophobicContact CD2-CG2 3.78Å; F188-I215 HydrophobicContact CG-CG2 4.12Å; F188-W238 HydrophobicContact CB-CH2 3.84Å; F188-W238 HydrophobicContact CB-CZ2 4.4Å; F188-W238 HydrophobicContact CB-CZ3 4.2Å; F188-W238 HydrophobicContact CD1-CD2 4.11Å; F188-W238 AromaticContact CD1-CE3 3.59Å; F188-W238 HydrophobicContact CD1-CE3 3.59Å; F188-W238 AromaticContact CD1-CH2 3.83Å; F188-W238 HydrophobicContact CD1-CH2 3.83Å; F188-W238 HydrophobicContact CD1-CZ2 4.3Å; F188-W238 AromaticContact CD1-CZ3 3.44Å; F188-W238 HydrophobicContact CD1-CZ3 3.44Å; F188-W238 VanDerWaalsContact CD1-CZ3 3.44Å; F188-W238 HydrophobicContact CD2-CH2 4.34Å; F188-W238 AromaticContact CD2-CZ3 3.9Å; F188-W238 HydrophobicContact CD2-CZ3 3.9Å; F188-W238 HydrophobicContact CE1-CD2 4.13Å; F188-W238 AromaticContact CE1-CE3 3.42Å; F188-W238 HydrophobicContact CE1-CE3 3.42Å; F188-W238 VanDerWaalsContact CE1-CE3 3.42Å; F188-W238 HydrophobicContact CE1-CH2 4.44Å; F188-W238 AromaticContact CE1-CZ3 3.62Å; F188-W238 HydrophobicContact CE1-CZ3 3.62Å; F188-W238 HydrophobicContact CE2-CZ3 4.06Å; F188-W238 HydrophobicContact CG-CE3 4.22Å; F188-W238 AromaticContact CG-CH2 3.76Å; F188-W238 HydrophobicContact CG-CH2 3.76Å; F188-W238 AromaticContact CG-CZ3 3.58Å; F188-W238 HydrophobicContact CG-CZ3 3.58Å; F188-W238 AromaticContact CZ-CE3 3.93Å; F188-W238 HydrophobicContact CZ-CE3 3.93Å; F188-W238 AromaticContact CZ-CZ3 3.92Å; F188-W238 HydrophobicContact CZ-CZ3 3.92Å; F188-N241 HydrophobicContact CE1-CB 3.55Å; F188-N241 HydrophobicContact CZ-CB 3.76Å; F188-F242 HydrophobicContact CE2-CD1 4.38Å; F188-F242 HydrophobicContact CE2-CE1 4.01Å; F188-F242 AromaticContact CZ-CD1 3.77Å; F188-F242 HydrophobicContact CZ-CD1 3.77Å; F188-F242 AromaticContact CZ-CE1 3.69Å; F188-F242 HydrophobicContact CZ-CE1 3.69Å; F188-L245 HydrophobicContact CE2-CD1 3.95Å; F188-L245 HydrophobicContact CZ-CD1 4.07Å
189K96.1Very high93Very high82 Ų8246.5 Ų46.536%0.35725%0.249SC..Hα-helixtrans-59-50.1177.9-68.9179.7-63.5-176.20111.7T185 E186 T191 I192 E193 T237T185-K189 WeakPolarHBondContact O-CG 3.42Å; T185-K189 PolarHBondContact O-N 2.97Å; E186-K189 PolarHBondContact O-N 3.22Å; K189-T191 VanDerWaalsContact C-N 3.29Å; K189-T191 PolarHBondContact O-N 3.31Å; K189-I192 PolarHBondContact O-N 3.14Å; K189-I192 VanDerWaalsContact O-N 3.16Å; K189-E193 PolarHBondContact O-N 3.05Å; K189-T237 HydrophobicContact CD-CG2 4.04Å; K189-T237 HydrophobicContact CG-CG2 4.26Å
190A94.7Very high92.7Very high42 Ų4251.9 Ų51.935%0.34728%0.276SS..Hα-helixtrans-60.5-39-18000000112.2E186 L187 E193 L194E186-A190 WeakPolarHBondContact O-CB 3.4Å; E186-A190 PolarHBondContact O-N 3.49Å; L187-A190 PolarHBondContact O-N 3.12Å; A190-E193 PolarHBondContact O-N 3.24Å; A190-L194 WeakPolarHBondContact O-CB 3.41Å; A190-L194 VanDerWaalsContact O-CG 3.29Å; A190-L194 WeakPolarHBondContact O-CG 3.39Å; A190-L194 PolarHBondContact O-N 3.4Å
191T94.7Very high92.6Very high0 Ų055.2 Ų55.20%029%0.294CS..Hα-helixtrans-65.6-39.1177.9-54.60000111.4F143 L187 F188 K189 L194 C195 L208 L212F143-T191 HydrophobicContact CE1-CG2 3.98Å; F143-T191 HydrophobicContact CZ-CG2 4.36Å; L187-T191 VanDerWaalsContact O-CB 3.3Å; L187-T191 WeakPolarHBondContact O-CB 3.37Å; L187-T191 PolarHBondContact O-N 3.06Å; L187-T191 PolarHBondContact O-OG1 3.46Å; F188-T191 PolarHBondContact O-N 2.7Å; K189-T191 VanDerWaalsContact C-N 3.29Å; K189-T191 PolarHBondContact O-N 3.31Å; T191-L194 PolarHBondContact O-N 3.43Å; T191-C195 PolarHBondContact O-N 2.9Å; T191-C195 PolarHBondContact O-SG 2.97Å; T191-L208 HydrophobicContact CG2-CB 4.15Å; T191-L208 HydrophobicContact CG2-CD2 4.01Å; T191-L212 HydrophobicContact CG2-CD1 4.44Å; T191-L212 HydrophobicContact CG2-CD2 3.68Å; T191-L212 HydrophobicContact CG2-CG 3.73Å
192I94.1Very high92.2Very high15 Ų1556.8 Ų56.88%0.07731%0.307CS..Hα-helixtrans-64.7-44.1175.4-67.7174.2000111.3F188 K189 L194 C195 Q196 L212 N241 L245F188-I192 HydrophobicContact CD1-CD1 4.33Å; F188-I192 HydrophobicContact CD2-CD1 4.16Å; F188-I192 HydrophobicContact CE1-CD1 3.88Å; F188-I192 HydrophobicContact CE2-CD1 3.7Å; F188-I192 HydrophobicContact CE2-CG1 4.35Å; F188-I192 HydrophobicContact CG-CD1 4.47Å; F188-I192 HydrophobicContact CZ-CD1 3.55Å; F188-I192 WeakPolarHBondContact O-CG1 3.37Å; F188-I192 PolarHBondContact O-N 3.43Å; F188-I192 VanDerWaalsContact O-N 3.11Å; K189-I192 PolarHBondContact O-N 3.14Å; K189-I192 VanDerWaalsContact O-N 3.16Å; I192-L194 VanDerWaalsContact C-N 3.31Å; I192-L194 PolarHBondContact O-N 3.22Å; I192-C195 WeakPolarHBondContact O-CB 3.38Å; I192-C195 PolarHBondContact O-N 2.75Å; I192-Q196 PolarHBondContact O-N 3.29Å; I192-L212 HydrophobicContact CG1-CD1 4.49Å; I192-L212 HydrophobicContact CG1-CD2 3.88Å; I192-N241 HydrophobicContact CD1-CB 3.64Å; I192-N241 WeakPolarHBondContact CD1-OD1 3.45Å; I192-L245 HydrophobicContact CD1-CD1 4Å; I192-L245 HydrophobicContact CD1-CG 4.49Å; I192-L245 HydrophobicContact CG1-CD1 4.37Å
193E92.9Very high91.7Very high123 Ų12358.3 Ų58.358%0.57532%0.315SS*.Hα-helixtrans-61.8-39.1176-70.2175.4-174.200111.9K189 A190 Q196 T197K189-E193 PolarHBondContact O-N 3.05Å; A190-E193 PolarHBondContact O-N 3.24Å; E193-Q196 WeakPolarHBondContact O-CB 3.26Å; E193-Q196 PolarHBondContact O-N 3.44Å; E193-T197 PolarHBondContact O-N 3.21Å; E193-T197 PolarHBondContact O-OG1 3.4Å
194L92.5Very high91.4Very high58 Ų5858.3 Ų58.330%0.30432%0.317SS..Hα-helixtrans-65.7-37.1174.2-73.6170.9000112.3F143 A190 T191 I192 Q196 T197 H198 L208F143-L194 HydrophobicContact CE2-CD1 3.62Å; F143-L194 HydrophobicContact CZ-CD1 3.68Å; A190-L194 WeakPolarHBondContact O-CB 3.41Å; A190-L194 VanDerWaalsContact O-CG 3.29Å; A190-L194 WeakPolarHBondContact O-CG 3.39Å; A190-L194 PolarHBondContact O-N 3.4Å; T191-L194 PolarHBondContact O-N 3.43Å; I192-L194 VanDerWaalsContact C-N 3.31Å; I192-L194 PolarHBondContact O-N 3.22Å; L194-Q196 VanDerWaalsContact C-N 3.26Å; L194-Q196 PolarHBondContact O-N 2.93Å; L194-T197 PolarHBondContact O-N 2.91Å; L194-T197 VanDerWaalsContact O-N 3.16Å; L194-H198 WeakPolarHBondContact O-CB 3.44Å; L194-H198 PolarHBondContact O-CD2 2.92Å; L194-H198 PolarHBondContact O-N 3.36Å; L194-L208 HydrophobicContact CB-CD1 4.05Å; L194-L208 HydrophobicContact CB-CD2 4.12Å; L194-L208 HydrophobicContact CD1-CD2 4.35Å
195C90.8Very high91.1Very high15 Ų1558.3 Ų58.310%0.10132%0.318CS..Hα-helixtrans-59.6-37.9173.3-72.20000111.8T191 I192 H198 A199 L205 L208 F209T191-C195 PolarHBondContact O-N 2.9Å; T191-C195 PolarHBondContact O-SG 2.97Å; I192-C195 WeakPolarHBondContact O-CB 3.38Å; I192-C195 PolarHBondContact O-N 2.75Å; C195-H198 CarbonylContact O-C 3.52Å; C195-A199 WeakPolarHBondContact O-CA 3.47Å; C195-A199 PolarHBondContact O-N 3.36Å; C195-A199 VanDerWaalsContact O-N 3.15Å; C195-L205 HydrophobicContact CB-CD2 4.17Å; C195-L208 VanDerWaalsContact SG-CB 3.56Å; C195-F209 HydrophobicContact CB-CE2 4.32Å
196Q87.3Confident90.7Very high141 Ų14163.5 Ų63.566%0.65934%0.34SS*.Hα-helixtrans-68.4-40.1175.4-63.9175.9-0.200111.5I192 E193 L194 A199I192-Q196 PolarHBondContact O-N 3.29Å; E193-Q196 WeakPolarHBondContact O-CB 3.26Å; E193-Q196 PolarHBondContact O-N 3.44Å; L194-Q196 VanDerWaalsContact C-N 3.26Å; L194-Q196 PolarHBondContact O-N 2.93Å; Q196-A199 WeakPolarHBondContact O-CB 3.27Å
197T89.4Confident90.4Very high109 Ų10961.8 Ų61.867%0.66934%0.336SS*.Hα-helixtrans-66.9-39.9179-55.60000112E193 L194E193-T197 PolarHBondContact O-N 3.21Å; E193-T197 PolarHBondContact O-OG1 3.4Å; L194-T197 PolarHBondContact O-N 2.91Å; L194-T197 VanDerWaalsContact O-N 3.16Å
198H88Confident90.3Very high77 Ų7761.3 Ų61.336%0.35633%0.333SS..THydrogen-bonded Turntrans-98.724.8-179.5-67.8-81.6000113.1L194 C195 N200 D201 A204 L205 L208L194-H198 WeakPolarHBondContact O-CB 3.44Å; L194-H198 PolarHBondContact O-CD2 2.92Å; L194-H198 PolarHBondContact O-N 3.36Å; C195-H198 CarbonylContact O-C 3.52Å; H198-N200 PolarHBondContact O-N 3.45Å; H198-D201 HydrophobicContact CB-CB 4.45Å; H198-D201 PolarHBondContact O-N 3.46Å; H198-A204 HydrophobicContact CB-CB 3.98Å; H198-L205 WeakPolarHBondContact O-CG 3.36Å; H198-L208 HydrophobicContact CB-CD1 4.48Å
199A82.9Confident90.2Very high38 Ų3861.4 Ų61.431%0.31433%0.334SS..THydrogen-bonded Turntrans-56.8-20.1-172.100000115.3C195 Q196 L205 L252C195-A199 WeakPolarHBondContact O-CA 3.47Å; C195-A199 PolarHBondContact O-N 3.36Å; C195-A199 VanDerWaalsContact O-N 3.15Å; Q196-A199 WeakPolarHBondContact O-CB 3.27Å; A199-L205 WeakPolarHBondContact O-CD1 3.2Å; A199-L252 WeakPolarHBondContact O-CD1 3.39Å
200N85.3Confident89.9Confident157 Ų15758.5 Ų58.584%0.8432%0.324SS*.THydrogen-bonded Turntrans-105.32179.1-61.1-49.2000114.1H198H198-N200 PolarHBondContact O-N 3.45Å
201D89.1Confident89.9Confident69 Ų6956.5 Ų56.537%0.36931%0.307SS..  trans-106.1101.1179.3-177.5-16000110.4H198 N203 A204 L205H198-D201 HydrophobicContact CB-CB 4.45Å; H198-D201 PolarHBondContact O-N 3.46Å; D201-N203 VanDerWaalsContact C-N 3.3Å; D201-N203 PolarHBondContact O-N 2.89Å; D201-N203 PolarHBondContact OD1-N 3.02Å; D201-A204 HydrophobicContact CB-CB 3.91Å; D201-A204 PolarHBondContact O-N 3.39Å; D201-A204 PolarHBondContact OD1-N 3.47Å; D201-A204 VanDerWaalsContact OD1-N 3.09Å; D201-L205 WeakPolarHBondContact O-CB 3.46Å; D201-L205 VanDerWaalsContact O-CG 3.26Å; D201-L205 WeakPolarHBondContact O-CG 3.11Å; D201-L205 PolarHBondContact O-N 3.05Å
202A86.4Confident90Very high34 Ų3456.5 Ų56.528%0.28131%0.307SS..Hα-helixtrans-60.6-35.6-177.600000113.3K206 L252A202-K206 VanDerWaalsContact O-CG 3.31Å; A202-K206 WeakPolarHBondContact O-CG 3.47Å; A202-K206 PolarHBondContact O-N 2.74Å; A202-K206 VanDerWaalsContact O-N 3.07Å; A202-L252 HydrophobicContact CB-CB 4.29Å
203N86.4Confident90.1Very high123 Ų12356.3 Ų56.366%0.65831%0.307SS*.Hα-helixtrans-73.2-44.1-178.4-72.4-32.2000110.8D201 K206 V207D201-N203 VanDerWaalsContact C-N 3.3Å; D201-N203 PolarHBondContact O-N 2.89Å; D201-N203 PolarHBondContact OD1-N 3.02Å; N203-K206 PolarHBondContact O-N 2.91Å; N203-V207 PolarHBondContact O-N 3.07Å
204A87.6Confident90.1Very high24 Ų2450.9 Ų50.920%0.19828%0.282CS..Hα-helixtrans-61.3-45.9174.600000111H198 D201 K206 V207 L208H198-A204 HydrophobicContact CB-CB 3.98Å; D201-A204 HydrophobicContact CB-CB 3.91Å; D201-A204 PolarHBondContact O-N 3.39Å; D201-A204 PolarHBondContact OD1-N 3.47Å; D201-A204 VanDerWaalsContact OD1-N 3.09Å; A204-K206 PolarHBondContact O-N 2.97Å; A204-V207 PolarHBondContact O-N 2.92Å; A204-V207 VanDerWaalsContact O-N 3.16Å; A204-L208 VanDerWaalsContact O-CG 3.28Å; A204-L208 WeakPolarHBondContact O-CG 3.28Å; A204-L208 PolarHBondContact O-N 3.01Å
205L90.3Very high90.4Very high1 Ų148.1 Ų48.11%0.00527%0.267CS..Hα-helixtrans-60.6-41.6179.1-72.8173.9000112.7C195 H198 A199 D201 V207 L208 F209 L252 L253C195-L205 HydrophobicContact CB-CD2 4.17Å; H198-L205 WeakPolarHBondContact O-CG 3.36Å; A199-L205 WeakPolarHBondContact O-CD1 3.2Å; D201-L205 WeakPolarHBondContact O-CB 3.46Å; D201-L205 VanDerWaalsContact O-CG 3.26Å; D201-L205 WeakPolarHBondContact O-CG 3.11Å; D201-L205 PolarHBondContact O-N 3.05Å; L205-V207 VanDerWaalsContact C-N 3.29Å; L205-V207 PolarHBondContact O-N 3.24Å; L205-L208 PolarHBondContact O-N 3.47Å; L205-F209 HydrophobicContact CD2-CD2 4.5Å; L205-F209 HydrophobicContact CD2-CE2 4.12Å; L205-F209 WeakPolarHBondContact O-CB 3.07Å; L205-F209 VanDerWaalsContact O-CD2 3.29Å; L205-F209 WeakPolarHBondContact O-CD2 3.18Å; L205-F209 PolarHBondContact O-N 3.35Å; L205-L252 HydrophobicContact CD1-CB 4.44Å; L205-L252 HydrophobicContact CD1-CD1 4.18Å; L205-L253 HydrophobicContact CB-CD1 4.45Å; L205-L253 HydrophobicContact CB-CD2 3.85Å; L205-L253 HydrophobicContact CB-CG 4.32Å
206K89.1Confident90.7Very high110 Ų11047.4 Ų47.448%0.47826%0.262SS..Hα-helixtrans-58.2-43175.7-76.1176.5-179.6-174.60111.8A202 N203 A204 S210 L253 L263A202-K206 VanDerWaalsContact O-CG 3.31Å; A202-K206 WeakPolarHBondContact O-CG 3.47Å; A202-K206 PolarHBondContact O-N 2.74Å; A202-K206 VanDerWaalsContact O-N 3.07Å; N203-K206 PolarHBondContact O-N 2.91Å; A204-K206 PolarHBondContact O-N 2.97Å; K206-S210 WeakPolarHBondContact O-CB 3.34Å; K206-S210 PolarHBondContact O-N 2.96Å; K206-S210 VanDerWaalsContact O-N 3.11Å; K206-L253 HydrophobicContact CG-CD2 4.1Å; K206-L263 HydrophobicContact CB-CD1 3.91Å; K206-L263 HydrophobicContact CG-CD1 4.15Å; K206-L263 WeakPolarHBondContact O-CD1 3.47Å
207V89.4Confident91.2Very high62 Ų6244 Ų4438%0.37625%0.245SC..Hα-helixtrans-66.4-44.6178.8174.30000111.3F143 N147 N203 A204 L205 S210 S211F143-V207 HydrophobicContact CB-CG1 3.33Å; F143-V207 HydrophobicContact CG-CG1 4.19Å; N147-V207 PolarHBondContact ND2-O 3.32Å; N203-V207 PolarHBondContact O-N 3.07Å; A204-V207 PolarHBondContact O-N 2.92Å; A204-V207 VanDerWaalsContact O-N 3.16Å; L205-V207 VanDerWaalsContact C-N 3.29Å; L205-V207 PolarHBondContact O-N 3.24Å; V207-S210 WeakPolarHBondContact O-CB 3.44Å; V207-S210 PolarHBondContact O-N 3Å; V207-S211 PolarHBondContact O-N 3.48Å; V207-S211 PolarHBondContact O-OG 3.19Å
208L92.8Very high91.5Very high7 Ų738.8 Ų38.84%0.03721%0.213CC..Hα-helixtrans-66.7-42.3-179.6-64.4170.2000112.3F143 T191 L194 C195 H198 A204 L205 S210 S211 L212F143-L208 HydrophobicContact CD1-CD2 3.92Å; F143-L208 HydrophobicContact CD2-CD2 3.98Å; F143-L208 HydrophobicContact CE1-CD2 3.51Å; F143-L208 HydrophobicContact CE2-CD2 3.58Å; F143-L208 HydrophobicContact CG-CD2 4.14Å; F143-L208 HydrophobicContact CZ-CD2 3.32Å; T191-L208 HydrophobicContact CG2-CB 4.15Å; T191-L208 HydrophobicContact CG2-CD2 4.01Å; L194-L208 HydrophobicContact CB-CD1 4.05Å; L194-L208 HydrophobicContact CB-CD2 4.12Å; L194-L208 HydrophobicContact CD1-CD2 4.35Å; C195-L208 VanDerWaalsContact SG-CB 3.56Å; H198-L208 HydrophobicContact CB-CD1 4.48Å; A204-L208 VanDerWaalsContact O-CG 3.28Å; A204-L208 WeakPolarHBondContact O-CG 3.28Å; A204-L208 PolarHBondContact O-N 3.01Å; L205-L208 PolarHBondContact O-N 3.47Å; L208-S210 VanDerWaalsContact C-N 3.32Å; L208-S210 PolarHBondContact O-N 3.38Å; L208-S211 WeakPolarHBondContact O-CA 3.08Å; L208-S211 VanDerWaalsContact O-CB 3.31Å; L208-S211 WeakPolarHBondContact O-CB 3.41Å; L208-S211 PolarHBondContact O-N 3.5Å; L208-S211 VanDerWaalsContact O-N 3.1Å; L208-L212 WeakPolarHBondContact O-CG 3.27Å; L208-L212 PolarHBondContact O-N 3.08Å
209F93.6Very high92Very high2 Ų235.1 Ų35.11%0.00920%0.197CC..Hα-helixtrans-69.1-30.6177.8-88-108.1000113C195 L205 S211 L212 T213 L248 L253 L263 L264 L267C195-F209 HydrophobicContact CB-CE2 4.32Å; L205-F209 HydrophobicContact CD2-CD2 4.5Å; L205-F209 HydrophobicContact CD2-CE2 4.12Å; L205-F209 WeakPolarHBondContact O-CB 3.07Å; L205-F209 VanDerWaalsContact O-CD2 3.29Å; L205-F209 WeakPolarHBondContact O-CD2 3.18Å; L205-F209 PolarHBondContact O-N 3.35Å; F209-S211 VanDerWaalsContact C-N 3.3Å; F209-L212 PolarHBondContact O-N 2.95Å; F209-T213 WeakPolarHBondContact O-CB 3.47Å; F209-T213 PolarHBondContact O-N 3.46Å; F209-T213 PolarHBondContact O-OG1 3.31Å; F209-L248 HydrophobicContact CE1-CD2 4.31Å; F209-L248 HydrophobicContact CZ-CD2 3.69Å; F209-L253 HydrophobicContact CD1-CD1 3.74Å; F209-L253 HydrophobicContact CD2-CD1 3.5Å; F209-L253 VanDerWaalsContact CD2-CD1 3.5Å; F209-L253 HydrophobicContact CE1-CD1 3.62Å; F209-L253 HydrophobicContact CE2-CD1 3.37Å; F209-L253 HydrophobicContact CG-CD1 3.68Å; F209-L253 HydrophobicContact CZ-CD1 3.42Å; F209-L253 VanDerWaalsContact CZ-CD1 3.42Å; F209-L263 HydrophobicContact CB-CB 4.04Å; F209-L263 HydrophobicContact CB-CD1 4.43Å; F209-L264 HydrophobicContact CD1-CD1 4.46Å; F209-L264 HydrophobicContact CE1-CD1 3.73Å; F209-L267 HydrophobicContact CD1-CD2 3.63Å; F209-L267 HydrophobicContact CE1-CD2 3.76Å
210S91.7Very high92.6Very high21 Ų2135.5 Ų35.515%0.14719%0.19CC..Hα-helixtrans-60.2-42.8168.5-172.90000110.9K206 V207 L208 T213 L214K206-S210 WeakPolarHBondContact O-CB 3.34Å; K206-S210 PolarHBondContact O-N 2.96Å; K206-S210 VanDerWaalsContact O-N 3.11Å; V207-S210 WeakPolarHBondContact O-CB 3.44Å; V207-S210 PolarHBondContact O-N 3Å; L208-S210 VanDerWaalsContact C-N 3.32Å; L208-S210 PolarHBondContact O-N 3.38Å; S210-T213 PolarHBondContact O-N 3.1Å; S210-L214 WeakPolarHBondContact O-CG 3.3Å; S210-L214 PolarHBondContact O-N 3.48Å; S210-L214 VanDerWaalsContact O-N 3.12Å
211S93.7Very high93.1Very high0 Ų028.1 Ų28.10%015%0.151CC..Hα-helixtrans-65-46.7174.6-52.40000112.5F143 N147 V207 L208 F209 T213 L214 I215F143-S211 VanDerWaalsContact CD1-OG 3.29Å; F143-S211 WeakPolarHBondContact CD1-OG 3.05Å; N147-S211 VanDerWaalsContact CG-OG 3.25Å; N147-S211 PolarHBondContact ND2-OG 2.97Å; N147-S211 WeakPolarHBondContact OD1-CA 2.78Å; N147-S211 WeakPolarHBondContact OD1-CB 3.17Å; N147-S211 PolarHBondContact OD1-N 3.13Å; N147-S211 PolarHBondContact OD1-OG 2.93Å; V207-S211 PolarHBondContact O-N 3.48Å; V207-S211 PolarHBondContact O-OG 3.19Å; L208-S211 WeakPolarHBondContact O-CA 3.08Å; L208-S211 VanDerWaalsContact O-CB 3.31Å; L208-S211 WeakPolarHBondContact O-CB 3.41Å; L208-S211 PolarHBondContact O-N 3.5Å; L208-S211 VanDerWaalsContact O-N 3.1Å; F209-S211 VanDerWaalsContact C-N 3.3Å; S211-T213 VanDerWaalsContact C-N 3.26Å; S211-T213 PolarHBondContact O-N 2.94Å; S211-L214 PolarHBondContact O-N 3.19Å; S211-L214 VanDerWaalsContact O-N 3.14Å; S211-I215 WeakPolarHBondContact O-CB 3.43Å; S211-I215 VanDerWaalsContact O-CG1 3.22Å; S211-I215 WeakPolarHBondContact O-CG1 3.4Å; S211-I215 PolarHBondContact O-N 3.04Å
212L96.8Very high93.5Very high0 Ų025 Ų250%013%0.134CC..Hα-helixtrans-58.6-38.7177.1-68.6175.5000112F188 T191 I192 L208 F209 I215 S216 L245 L267F188-L212 HydrophobicContact CD2-CD2 3.75Å; F188-L212 HydrophobicContact CE2-CD2 3.9Å; T191-L212 HydrophobicContact CG2-CD1 4.44Å; T191-L212 HydrophobicContact CG2-CD2 3.68Å; T191-L212 HydrophobicContact CG2-CG 3.73Å; I192-L212 HydrophobicContact CG1-CD1 4.49Å; I192-L212 HydrophobicContact CG1-CD2 3.88Å; L208-L212 WeakPolarHBondContact O-CG 3.27Å; L208-L212 PolarHBondContact O-N 3.08Å; F209-L212 PolarHBondContact O-N 2.95Å; L212-I215 PolarHBondContact O-N 3.29Å; L212-S216 WeakPolarHBondContact O-CB 3.26Å; L212-S216 PolarHBondContact O-N 3.24Å; L212-S216 PolarHBondContact O-OG 3.46Å; L212-L245 HydrophobicContact CD1-CD1 4.47Å; L212-L245 HydrophobicContact CD1-CD2 4.05Å; L212-L267 HydrophobicContact CB-CD1 4.01Å; L212-L267 HydrophobicContact CB-CD2 3.9Å; L212-L267 HydrophobicContact CD1-CD2 4.14Å
213T95.7Very high94Very high11 Ų1123.4 Ų23.47%0.06712%0.121CC..Hα-helixtrans-63.3-46175.8-58.50000111.3F209 S210 S211 S216 K217F209-T213 WeakPolarHBondContact O-CB 3.47Å; F209-T213 PolarHBondContact O-N 3.46Å; F209-T213 PolarHBondContact O-OG1 3.31Å; S210-T213 PolarHBondContact O-N 3.1Å; S211-T213 VanDerWaalsContact C-N 3.26Å; S211-T213 PolarHBondContact O-N 2.94Å; T213-S216 PolarHBondContact O-N 2.87Å; T213-K217 WeakPolarHBondContact O-CG 3.47Å; T213-K217 PolarHBondContact O-N 3.32Å
214L94.6Very high94.4Very high9 Ų919.6 Ų19.65%0.04710%0.099CC..Hα-helixtrans-67-40.2178.1-69.1166.8000112.4N147 L150 R151 S210 S211 S216 K217 L218N147-L214 HydrophobicContact CB-CD1 4.4Å; L150-L214 HydrophobicContact CB-CB 3.83Å; L150-L214 HydrophobicContact CB-CD1 3.9Å; L150-L214 HydrophobicContact CB-CG 4.44Å; L150-L214 HydrophobicContact CD1-CB 4.19Å; R151-L214 HydrophobicContact CG-CD1 3.72Å; R151-L214 HydrophobicContact CG-CD2 3.85Å; R151-L214 HydrophobicContact CG-CG 4.47Å; S210-L214 WeakPolarHBondContact O-CG 3.3Å; S210-L214 PolarHBondContact O-N 3.48Å; S210-L214 VanDerWaalsContact O-N 3.12Å; S211-L214 PolarHBondContact O-N 3.19Å; S211-L214 VanDerWaalsContact O-N 3.14Å; L214-S216 VanDerWaalsContact C-N 3.32Å; L214-S216 PolarHBondContact O-N 2.87Å; L214-K217 WeakPolarHBondContact O-CB 3.32Å; L214-K217 PolarHBondContact O-N 3.08Å; L214-L218 WeakPolarHBondContact O-CG 3.22Å; L214-L218 PolarHBondContact O-N 3.13Å
215I97.6Very high94.6Very high0 Ų019.7 Ų19.70%010%0.095CC..Hα-helixtrans-60.4-44.1174.1-69166.8000110.2L150 L184 L187 F188 S211 L212 K217 L218 F219 W238L150-I215 HydrophobicContact CD1-CD1 4.38Å; L150-I215 HydrophobicContact CD1-CG1 3.92Å; L150-I215 HydrophobicContact CD2-CG1 3.96Å; L184-I215 HydrophobicContact CD1-CB 4.36Å; L184-I215 HydrophobicContact CD1-CG1 3.96Å; L184-I215 HydrophobicContact CD1-CG2 4.05Å; L184-I215 HydrophobicContact CG-CG2 4.29Å; L187-I215 HydrophobicContact CD2-CD1 4.13Å; L187-I215 HydrophobicContact CG-CD1 4.01Å; F188-I215 HydrophobicContact CB-CG2 3.91Å; F188-I215 HydrophobicContact CD2-CG2 3.78Å; F188-I215 HydrophobicContact CG-CG2 4.12Å; S211-I215 WeakPolarHBondContact O-CB 3.43Å; S211-I215 VanDerWaalsContact O-CG1 3.22Å; S211-I215 WeakPolarHBondContact O-CG1 3.4Å; S211-I215 PolarHBondContact O-N 3.04Å; L212-I215 PolarHBondContact O-N 3.29Å; I215-K217 VanDerWaalsContact C-N 3.32Å; I215-K217 PolarHBondContact O-N 3.43Å; I215-L218 WeakPolarHBondContact O-CB 3.43Å; I215-L218 PolarHBondContact O-N 3.18Å; I215-F219 PolarHBondContact O-N 3.13Å; I215-W238 HydrophobicContact CG2-CH2 3.69Å; I215-W238 HydrophobicContact CG2-CZ3 4.04Å
216S97.8Very high94.7Very high0 Ų023.1 Ų23.10%011%0.113CC..Hα-helixtrans-64.8-35.5177.8-56.80000112.2L212 T213 L214 F219 Y220 L267 N274L212-S216 WeakPolarHBondContact O-CB 3.26Å; L212-S216 PolarHBondContact O-N 3.24Å; L212-S216 PolarHBondContact O-OG 3.46Å; T213-S216 PolarHBondContact O-N 2.87Å; L214-S216 VanDerWaalsContact C-N 3.32Å; L214-S216 PolarHBondContact O-N 2.87Å; S216-F219 WeakPolarHBondContact O-CB 3.45Å; S216-Y220 PolarHBondContact O-N 2.9Å; S216-Y220 VanDerWaalsContact O-N 3.12Å; S216-L267 WeakPolarHBondContact OG-CD1 3.46Å; S216-N274 PolarHBondContact O-ND2 3.03Å; S216-N274 PolarHBondContact O-OD1 2.95Å
217K96.4Very high95Very high69 Ų6918.8 Ų18.830%0.310%0.095SC..Hα-helixtrans-67.3-37.6172.4-79.2177178.9-171.70113.1R161 T213 L214 I215 Y220 S221 Q270R161-K217 PolarHBondContact NH2-O 2.92Å; T213-K217 WeakPolarHBondContact O-CG 3.47Å; T213-K217 PolarHBondContact O-N 3.32Å; L214-K217 WeakPolarHBondContact O-CB 3.32Å; L214-K217 PolarHBondContact O-N 3.08Å; I215-K217 VanDerWaalsContact C-N 3.32Å; I215-K217 PolarHBondContact O-N 3.43Å; K217-Y220 WeakPolarHBondContact O-CB 3.32Å; K217-Y220 PolarHBondContact O-N 3.29Å; K217-S221 PolarHBondContact O-N 3.26Å; K217-S221 VanDerWaalsContact O-N 3.13Å; K217-S221 PolarHBondContact O-OG 3.23Å; K217-Q270 HydrophobicContact CG-CG 3.95Å
218L96.6Very high95.3Very high0 Ų016.7 Ų16.70%08%0.083CC..Hα-helixtrans-67.3-44.8175.3-76.3164.3000110.9L150 A153 H154 F157 F180 L184 L214 I215 Y220 S221 L222L150-L218 HydrophobicContact CB-CD1 4.33Å; L150-L218 HydrophobicContact CD2-CD1 3.45Å; L150-L218 VanDerWaalsContact CD2-CD1 3.45Å; L150-L218 HydrophobicContact CG-CD1 4.5Å; A153-L218 HydrophobicContact CB-CD1 4.35Å; A153-L218 HydrophobicContact CB-CD2 3.81Å; H154-L218 HydrophobicContact CB-CD2 4.2Å; H154-L218 HydrophobicContact CB-CG 4.37Å; F157-L218 HydrophobicContact CD2-CD2 3.6Å; F157-L218 HydrophobicContact CE2-CD2 4.22Å; F180-L218 HydrophobicContact CE1-CD1 4.49Å; L184-L218 HydrophobicContact CD1-CD1 3.93Å; L184-L218 HydrophobicContact CD2-CB 3.91Å; L214-L218 WeakPolarHBondContact O-CG 3.22Å; L214-L218 PolarHBondContact O-N 3.13Å; I215-L218 WeakPolarHBondContact O-CB 3.43Å; I215-L218 PolarHBondContact O-N 3.18Å; L218-Y220 VanDerWaalsContact C-N 3.29Å; L218-Y220 PolarHBondContact O-N 3.17Å; L218-S221 PolarHBondContact O-N 3.35Å; L218-S221 VanDerWaalsContact O-N 3.13Å; L218-L222 WeakPolarHBondContact O-CG 3.31Å; L218-L222 PolarHBondContact O-N 3.14Å
219F97.8Very high95.4Very high1 Ų123.5 Ų23.50%0.00411%0.114CC..Hα-helixtrans-51.7-49.7172.2178.4-86.7000110.9I215 S216 S221 L222 N223 F231 W238 M239 F242 N274 Y278I215-F219 PolarHBondContact O-N 3.13Å; S216-F219 WeakPolarHBondContact O-CB 3.45Å; F219-S221 PolarHBondContact O-N 3.31Å; F219-L222 PolarHBondContact O-N 3.31Å; F219-N223 WeakPolarHBondContact O-CB 3.4Å; F219-N223 PolarHBondContact O-N 3.3Å; F219-N223 PolarHBondContact O-ND2 3.39Å; F219-F231 AromaticContact CD2-CD1 3.83Å; F219-F231 HydrophobicContact CD2-CD1 3.83Å; F219-F231 AromaticContact CD2-CE1 3.74Å; F219-F231 HydrophobicContact CD2-CE1 3.74Å; F219-F231 AromaticContact CE2-CD1 3.64Å; F219-F231 HydrophobicContact CE2-CD1 3.64Å; F219-F231 HydrophobicContact CE2-CE1 4.06Å; F219-F231 HydrophobicContact CE2-CG 4.34Å; F219-W238 HydrophobicContact CB-CH2 4.43Å; F219-W238 HydrophobicContact CB-CZ3 4.26Å; F219-W238 AromaticContact CD2-CD2 3.62Å; F219-W238 HydrophobicContact CD2-CD2 3.62Å; F219-W238 AromaticContact CD2-CE2 3.84Å; F219-W238 AromaticContact CD2-CE3 3.65Å; F219-W238 HydrophobicContact CD2-CE3 3.65Å; F219-W238 HydrophobicContact CD2-CG 4.18Å; F219-W238 HydrophobicContact CD2-CH2 4.1Å; F219-W238 HydrophobicContact CD2-CZ2 4.08Å; F219-W238 AromaticContact CD2-CZ3 3.9Å; F219-W238 HydrophobicContact CD2-CZ3 3.9Å; F219-W238 HydrophobicContact CE2-CB 4.07Å; F219-W238 AromaticContact CE2-CD2 3.65Å; F219-W238 HydrophobicContact CE2-CD2 3.65Å; F219-W238 AromaticContact CE2-CE3 3.99Å; F219-W238 HydrophobicContact CE2-CE3 3.99Å; F219-W238 AromaticContact CE2-CG 3.69Å; F219-W238 HydrophobicContact CE2-CG 3.69Å; F219-W238 HydrophobicContact CG-CE3 4.32Å; F219-W238 HydrophobicContact CG-CZ3 4.32Å; F219-M239 HydrophobicContact CE1-CE 4.45Å; F219-M239 HydrophobicContact CZ-CE 3.92Å; F219-F242 HydrophobicContact CB-CZ 4.35Å; F219-F242 AromaticContact CD1-CE2 3.82Å; F219-F242 HydrophobicContact CD1-CE2 3.82Å; F219-F242 HydrophobicContact CD1-CZ 4.06Å; F219-F242 HydrophobicContact CD2-CE2 4.36Å; F219-F242 HydrophobicContact CD2-CZ 4.4Å; F219-F242 AromaticContact CE1-CE2 3.78Å; F219-F242 HydrophobicContact CE1-CE2 3.78Å; F219-F242 HydrophobicContact CE1-CZ 4.47Å; F219-F242 HydrophobicContact CE2-CE2 4.32Å; F219-F242 HydrophobicContact CG-CE2 4.11Å; F219-F242 HydrophobicContact CG-CZ 4.01Å; F219-F242 HydrophobicContact CZ-CE2 4.03Å; F219-N274 HydrophobicContact CD1-CB 4.22Å; F219-N274 HydrophobicContact CE1-CB 4.27Å; F219-Y278 HydrophobicContact CE1-CD2 4.17Å; F219-Y278 AromaticContact CE1-CE2 3.43Å; F219-Y278 HydrophobicContact CE1-CE2 3.43Å; F219-Y278 VanDerWaalsContact CE1-CE2 3.43Å; F219-Y278 AromaticContact CE1-CZ 3.92Å; F219-Y278 HydrophobicContact CZ-CE1 4.43Å; F219-Y278 AromaticContact CZ-CE2 3.54Å; F219-Y278 HydrophobicContact CZ-CE2 3.54Å; F219-Y278 AromaticContact CZ-CZ 3.48Å; F219-Y278 VanDerWaalsContact CZ-CZ 3.48Å; F219-Y278 WeakPolarHBondContact CZ-OH 3.5Å
220Y97Very high95.6Very high46 Ų4626 Ų2618%0.1813%0.125CC..Hα-helixtrans-55.8-50.2176-170.1-87.7000112.6R161 S216 K217 L218 L222 N223 F224 D273 N274 L277R161-Y220 HydrophobicContact CG-CD1 4.42Å; R161-Y220 HydrophobicContact CG-CE1 4.29Å; R161-Y220 VanDerWaalsContact CZ-CD1 3.47Å; S216-Y220 PolarHBondContact O-N 2.9Å; S216-Y220 VanDerWaalsContact O-N 3.12Å; K217-Y220 WeakPolarHBondContact O-CB 3.32Å; K217-Y220 PolarHBondContact O-N 3.29Å; L218-Y220 VanDerWaalsContact C-N 3.29Å; L218-Y220 PolarHBondContact O-N 3.17Å; Y220-L222 PolarHBondContact O-N 3.26Å; Y220-N223 CarbonylContact O-C 2.89Å; Y220-N223 PolarHBondContact O-N 3.42Å; Y220-F224 HydrophobicContact CD1-CD2 4.2Å; Y220-F224 AromaticContact CE1-CD2 3.43Å; Y220-F224 HydrophobicContact CE1-CD2 3.43Å; Y220-F224 VanDerWaalsContact CE1-CD2 3.43Å; Y220-F224 AromaticContact CE1-CE2 3.87Å; Y220-F224 HydrophobicContact CE1-CE2 3.87Å; Y220-F224 HydrophobicContact CE1-CG 4.49Å; Y220-F224 AromaticContact CZ-CD2 3.84Å; Y220-F224 WeakPolarHBondContact O-CB 3.36Å; Y220-F224 PolarHBondContact O-N 3.16Å; Y220-F224 VanDerWaalsContact O-N 3.09Å; Y220-D273 HydrophobicContact CD2-CB 4.22Å; Y220-D273 HydrophobicContact CE2-CB 4.04Å; Y220-N274 WeakPolarHBondContact CB-OD1 3.49Å; Y220-N274 WeakPolarHBondContact CD2-OD1 3.49Å; Y220-L277 HydrophobicContact CD2-CB 4.27Å; Y220-L277 HydrophobicContact CD2-CD2 3.8Å; Y220-L277 HydrophobicContact CE2-CB 3.81Å; Y220-L277 HydrophobicContact CE2-CD2 3.87Å; Y220-L277 HydrophobicContact CE2-CG 4.3Å; Y220-L277 HydrophobicContact CG-CD2 4.25Å
221S95.9Very high95.8Very high1 Ų125 Ų251%0.00712%0.118CC..Hα-helixtrans-63-41.3-177.9-660000112.7R161 K217 L218 F219 N223 F224R161-S221 PolarHBondContact NE-OG 2.77Å; R161-S221 PolarHBondContact NH2-OG 2.95Å; K217-S221 PolarHBondContact O-N 3.26Å; K217-S221 VanDerWaalsContact O-N 3.13Å; K217-S221 PolarHBondContact O-OG 3.23Å; L218-S221 PolarHBondContact O-N 3.35Å; L218-S221 VanDerWaalsContact O-N 3.13Å; F219-S221 PolarHBondContact O-N 3.31Å; S221-N223 VanDerWaalsContact C-N 3.31Å; S221-F224 PolarHBondContact O-N 2.84Å
222L96.2Very high96Very high5 Ų529.3 Ų29.33%0.02614%0.138CC..Hα-helixtrans-73.5-23.9-178.2-65.7175.9000112.9F157 Y160 V176 L177 L184 L218 F219 Y220 P228 F231F157-L222 HydrophobicContact CD2-CD2 4.05Å; F157-L222 HydrophobicContact CG-CD2 4.37Å; Y160-L222 HydrophobicContact CE2-CD2 4.41Å; V176-L222 HydrophobicContact CG1-CD2 3.67Å; L177-L222 HydrophobicContact CD2-CB 4.48Å; L184-L222 HydrophobicContact CD2-CD1 4.03Å; L218-L222 WeakPolarHBondContact O-CG 3.31Å; L218-L222 PolarHBondContact O-N 3.14Å; F219-L222 PolarHBondContact O-N 3.31Å; Y220-L222 PolarHBondContact O-N 3.26Å; L222-P228 WeakPolarHBondContact O-CG 3.48Å; L222-F231 HydrophobicContact CB-CE2 3.85Å; L222-F231 HydrophobicContact CB-CZ 4.27Å; L222-F231 HydrophobicContact CD1-CE2 4.2Å; L222-F231 HydrophobicContact CD1-CZ 3.99Å
223N96.4Very high96Very high0 Ų035 Ų350%017%0.169CC..THydrogen-bonded Turntrans-10212176.6-68.8-95.6000112.4F219 Y220 S221 D226 P228 F231 L277 Y278 Y282F219-N223 WeakPolarHBondContact O-CB 3.4Å; F219-N223 PolarHBondContact O-N 3.3Å; F219-N223 PolarHBondContact O-ND2 3.39Å; Y220-N223 CarbonylContact O-C 2.89Å; Y220-N223 PolarHBondContact O-N 3.42Å; S221-N223 VanDerWaalsContact C-N 3.31Å; N223-D226 CarbonylContact C-O 3.15Å; N223-D226 WeakPolarHBondContact CA-O 3.29Å; N223-P228 VanDerWaalsContact OD1-CD 3.29Å; N223-P228 WeakPolarHBondContact OD1-CD 3.41Å; N223-F231 WeakPolarHBondContact ND2-CD2 3.32Å; N223-F231 VanDerWaalsContact OD1-CB 3.29Å; N223-F231 WeakPolarHBondContact OD1-CB 3.36Å; N223-F231 WeakPolarHBondContact OD1-CG 3.49Å; N223-L277 HydrophobicContact CB-CD2 4.33Å; N223-Y278 HydrophobicContact CB-CE2 3.95Å; N223-Y278 PolarHBondContact OD1-OH 2.69Å; N223-Y282 VanDerWaalsContact O-CE2 3.27Å; N223-Y282 WeakPolarHBondContact O-CE2 3.44Å; N223-Y282 PolarHBondContact O-OH 3.21Å
224F95.1Very high96Very high43 Ų4336.6 Ų36.619%0.18918%0.177CC..SBendtrans-79.9-43.7-173.6-172.4-89.7000112.8R161 Y220 S221 L277 K281R161-F224 VanDerWaalsContact CA-CD1 3.46Å; R161-F224 HydrophobicContact CB-CD1 4.2Å; R161-F224 HydrophobicContact CB-CD2 4.34Å; R161-F224 HydrophobicContact CB-CE1 4.24Å; R161-F224 HydrophobicContact CB-CE2 4.37Å; R161-F224 HydrophobicContact CB-CG 4.21Å; R161-F224 HydrophobicContact CB-CZ 4.31Å; R161-F224 HydrophobicContact CG-CB 4.28Å; R161-F224 HydrophobicContact CG-CD1 4.48Å; R161-F224 HydrophobicContact CG-CD2 4.12Å; R161-F224 HydrophobicContact CG-CG 4.03Å; R161-F224 WeakPolarHBondContact O-CE1 3.4Å; R161-F224 WeakPolarHBondContact O-CZ 3.39Å; Y220-F224 HydrophobicContact CD1-CD2 4.2Å; Y220-F224 AromaticContact CE1-CD2 3.43Å; Y220-F224 HydrophobicContact CE1-CD2 3.43Å; Y220-F224 VanDerWaalsContact CE1-CD2 3.43Å; Y220-F224 AromaticContact CE1-CE2 3.87Å; Y220-F224 HydrophobicContact CE1-CE2 3.87Å; Y220-F224 HydrophobicContact CE1-CG 4.49Å; Y220-F224 AromaticContact CZ-CD2 3.84Å; Y220-F224 WeakPolarHBondContact O-CB 3.36Å; Y220-F224 PolarHBondContact O-N 3.16Å; Y220-F224 VanDerWaalsContact O-N 3.09Å; S221-F224 PolarHBondContact O-N 2.84Å; F224-L277 HydrophobicContact CD2-CD1 4.13Å; F224-K281 PolarHBondContact O-NZ 3.39Å
225Q92.3Very high96.1Very high26 Ų2636.5 Ų36.512%0.12118%0.177CC..SBendtrans-74.2-36.9-175.2-75.9-69-15.500112.1Y160 E163 K165 I173Y160-Q225 WeakPolarHBondContact O-CG 3.49Å; Y160-Q225 PolarHBondContact O-NE2 3.47Å; E163-Q225 PolarHBondContact O-NE2 3.5Å; K165-Q225 WeakPolarHBondContact CE-O 3.34Å; K165-Q225 PolarHBondContact NZ-O 3.02Å; K165-Q225 VanDerWaalsContact NZ-O 3.13Å; I173-Q225 HydrophobicContact CD1-CB 4.18Å; I173-Q225 HydrophobicContact CD1-CG 3.91Å
226D93.1Very high96Very high72 Ų7243 Ų4339%0.38521%0.207SC..SBendtrans-165.3171.6179.4-147.8-12.1000110.2W170 N223 P228 Y282W170-D226 HydrophobicContact CH2-CB 3.47Å; W170-D226 VanDerWaalsContact CH2-CB 3.47Å; W170-D226 WeakPolarHBondContact CH2-OD2 3.03Å; W170-D226 HydrophobicContact CZ3-CB 3.99Å; N223-D226 CarbonylContact C-O 3.15Å; N223-D226 WeakPolarHBondContact CA-O 3.29Å; D226-P228 VanDerWaalsContact O-CD 3.22Å; D226-P228 WeakPolarHBondContact O-CD 3.35Å; D226-Y282 VanDerWaalsContact C-CZ 3.44Å; D226-Y282 WeakPolarHBondContact CA-OH 3.34Å; D226-Y282 PolarHBondContact N-OH 2.95Å; D226-Y282 PolarHBondContact O-OH 2.86Å
227L95.1Very high96Very high20 Ų2045.2 Ų45.211%0.10522%0.221CC..  trans-85.8110.5172179.161.9000109.2F231 E232 M235 Y278 Y282 E285L227-F231 HydrophobicContact CD1-CB 4.34Å; L227-E232 HydrophobicContact CD1-CB 4.48Å; L227-E232 HydrophobicContact CD2-CB 3.94Å; L227-E232 HydrophobicContact CD2-CG 3.97Å; L227-E232 HydrophobicContact CG-CB 4.06Å; L227-M235 HydrophobicContact CD1-CE 4.18Å; L227-M235 HydrophobicContact CD2-CE 3.82Å; L227-Y278 HydrophobicContact CD1-CE1 3.95Å; L227-Y278 VanDerWaalsContact CD1-OH 3.3Å; L227-Y278 WeakPolarHBondContact CD1-OH 3.4Å; L227-Y282 HydrophobicContact CB-CD1 3.53Å; L227-Y282 HydrophobicContact CB-CD2 4.21Å; L227-Y282 HydrophobicContact CB-CE1 3.64Å; L227-Y282 HydrophobicContact CB-CE2 4.32Å; L227-Y282 HydrophobicContact CB-CG 3.86Å; L227-Y282 HydrophobicContact CD1-CD2 4.4Å; L227-Y282 HydrophobicContact CD2-CD1 4.49Å; L227-Y282 HydrophobicContact CD2-CG 4.3Å; L227-Y282 HydrophobicContact CG-CG 4.46Å; L227-Y282 VanDerWaalsContact N-CE1 3.27Å; L227-E285 HydrophobicContact CD2-CB 4.22Å; L227-E285 HydrophobicContact CD2-CG 3.86Å
228P95.1Very high96.1Very high17 Ų1742 Ų4211%0.1121%0.206CC..  trans-74.7141.7177.3-18.436000111.6L177 L222 N223 D226 F230 F231 E232L177-P228 HydrophobicContact CD1-CB 3.63Å; L177-P228 HydrophobicContact CD1-CG 3.85Å; L177-P228 HydrophobicContact CD2-CB 3.83Å; L177-P228 HydrophobicContact CD2-CG 3.79Å; L177-P228 HydrophobicContact CG-CB 4.36Å; L177-P228 HydrophobicContact CG-CG 4.48Å; L222-P228 WeakPolarHBondContact O-CG 3.48Å; N223-P228 VanDerWaalsContact OD1-CD 3.29Å; N223-P228 WeakPolarHBondContact OD1-CD 3.41Å; D226-P228 VanDerWaalsContact O-CD 3.22Å; D226-P228 WeakPolarHBondContact O-CD 3.35Å; P228-F230 PolarHBondContact O-N 3.46Å; P228-F230 VanDerWaalsContact O-N 3.08Å; P228-F231 HydrophobicContact CB-CD2 4.01Å; P228-F231 HydrophobicContact CG-CD2 3.79Å; P228-F231 HydrophobicContact CG-CE2 4.42Å; P228-F231 PolarHBondContact O-N 3.37Å; P228-E232 PolarHBondContact O-N 2.93Å
229E95.4Very high96.1Very high151 Ų15142 Ų4271%0.70621%0.207SC*.Hα-helixtrans-45.5-44.9178.2-177-179.9-174.100112.2F231 E232 D233E229-F231 PolarHBondContact O-N 3.13Å; E229-E232 WeakPolarHBondContact O-CB 3.48Å; E229-E232 PolarHBondContact O-N 3.4Å; E229-D233 WeakPolarHBondContact O-CB 3.34Å; E229-D233 PolarHBondContact O-N 2.59Å
230F97.1Very high96.1Very high53 Ų5345 Ų4523%0.23223%0.225CC..Hα-helixtrans-58.7-42.8177.9-177.4-85.2000113.4A181 L182 T185 P228 N234A181-F230 HydrophobicContact CB-CB 4.42Å; A181-F230 HydrophobicContact CB-CD1 3.52Å; A181-F230 HydrophobicContact CB-CE1 3.92Å; A181-F230 HydrophobicContact CB-CG 3.88Å; L182-F230 HydrophobicContact CB-CE2 3.83Å; L182-F230 HydrophobicContact CB-CZ 3.88Å; L182-F230 HydrophobicContact CD1-CE2 4.17Å; L182-F230 HydrophobicContact CD1-CZ 4.06Å; T185-F230 WeakPolarHBondContact OG1-CE1 3.42Å; P228-F230 PolarHBondContact O-N 3.46Å; P228-F230 VanDerWaalsContact O-N 3.08Å; F230-N234 WeakPolarHBondContact O-CB 3.39Å; F230-N234 PolarHBondContact O-N 3.28Å; F230-N234 VanDerWaalsContact O-N 3.16Å; F230-N234 PolarHBondContact O-ND2 2.81Å
231F97.4Very high96.1Very high0 Ų045 Ų450%023%0.228CC..Hα-helixtrans-78.4-28.1-179.4-71.5-69.1000112.2L177 A181 F219 L222 N223 L227 P228 E229 N234 M235 W238L177-F231 HydrophobicContact CD2-CD2 4.18Å; L177-F231 HydrophobicContact CD2-CE2 3.68Å; A181-F231 HydrophobicContact CB-CE2 4.28Å; A181-F231 HydrophobicContact CB-CZ 4.19Å; F219-F231 AromaticContact CD2-CD1 3.83Å; F219-F231 HydrophobicContact CD2-CD1 3.83Å; F219-F231 AromaticContact CD2-CE1 3.74Å; F219-F231 HydrophobicContact CD2-CE1 3.74Å; F219-F231 AromaticContact CE2-CD1 3.64Å; F219-F231 HydrophobicContact CE2-CD1 3.64Å; F219-F231 HydrophobicContact CE2-CE1 4.06Å; F219-F231 HydrophobicContact CE2-CG 4.34Å; L222-F231 HydrophobicContact CB-CE2 3.85Å; L222-F231 HydrophobicContact CB-CZ 4.27Å; L222-F231 HydrophobicContact CD1-CE2 4.2Å; L222-F231 HydrophobicContact CD1-CZ 3.99Å; N223-F231 WeakPolarHBondContact ND2-CD2 3.32Å; N223-F231 VanDerWaalsContact OD1-CB 3.29Å; N223-F231 WeakPolarHBondContact OD1-CB 3.36Å; N223-F231 WeakPolarHBondContact OD1-CG 3.49Å; L227-F231 HydrophobicContact CD1-CB 4.34Å; P228-F231 HydrophobicContact CB-CD2 4.01Å; P228-F231 HydrophobicContact CG-CD2 3.79Å; P228-F231 HydrophobicContact CG-CE2 4.42Å; P228-F231 PolarHBondContact O-N 3.37Å; E229-F231 PolarHBondContact O-N 3.13Å; F231-N234 CarbonylContact O-C 3.57Å; F231-M235 WeakPolarHBondContact O-CA 3.29Å; F231-M235 WeakPolarHBondContact O-CB 3.29Å; F231-M235 PolarHBondContact O-N 2.71Å; F231-W238 AromaticContact CD1-NE1 3.69Å; F231-W238 AromaticContact CE1-CE2 3.97Å; F231-W238 AromaticContact CE1-CZ2 3.98Å; F231-W238 HydrophobicContact CE1-CZ2 3.98Å; F231-W238 AromaticContact CE1-NE1 3.81Å
232E96.7Very high96.2Very high91 Ų9145.1 Ų45.143%0.42523%0.229SC..Hα-helixtrans-62.3-53.4169-170.8-179.1164.200110.8L227 P228 E229 N234 M235 E285L227-E232 HydrophobicContact CD1-CB 4.48Å; L227-E232 HydrophobicContact CD2-CB 3.94Å; L227-E232 HydrophobicContact CD2-CG 3.97Å; L227-E232 HydrophobicContact CG-CB 4.06Å; P228-E232 PolarHBondContact O-N 2.93Å; E229-E232 WeakPolarHBondContact O-CB 3.48Å; E229-E232 PolarHBondContact O-N 3.4Å; E232-N234 PolarHBondContact O-N 3.21Å; E232-M235 WeakPolarHBondContact O-CB 3.35Å; E232-M235 PolarHBondContact O-N 3.36Å; E232-M235 VanDerWaalsContact O-N 3.08Å; E232-E285 HydrophobicContact CG-CG 4.37Å
233D96.8Very high96.2Very high119 Ų11947 Ų4764%0.63624%0.237SC*.Hα-helixtrans-59.3-32.3178.5-75.6-19.1000112.8E229E229-D233 WeakPolarHBondContact O-CB 3.34Å; E229-D233 PolarHBondContact O-N 2.59Å
234N96.6Very high96.2Very high45 Ų4548.7 Ų48.724%0.24125%0.254CS..THydrogen-bonded Turntrans-102.113.7-178.6-68-90.4000113.1F230 F231 E232 E236 T237 W238F230-N234 WeakPolarHBondContact O-CB 3.39Å; F230-N234 PolarHBondContact O-N 3.28Å; F230-N234 VanDerWaalsContact O-N 3.16Å; F230-N234 PolarHBondContact O-ND2 2.81Å; F231-N234 CarbonylContact O-C 3.57Å; E232-N234 PolarHBondContact O-N 3.21Å; N234-E236 VanDerWaalsContact C-N 3.33Å; N234-E236 PolarHBondContact O-N 2.94Å; N234-T237 WeakPolarHBondContact O-CB 3.22Å; N234-T237 PolarHBondContact O-N 2.94Å; N234-T237 VanDerWaalsContact O-N 3.13Å; N234-W238 PolarHBondContact O-N 3Å
235M96Very high96.2Very high8 Ų847.2 Ų47.24%0.03925%0.248CC..Hα-helixtrans-61.3-40-172.3-168.6176.7-54.700112.3L227 F231 E232 T237 W238 M239 Y278 E285 Y289L227-M235 HydrophobicContact CD1-CE 4.18Å; L227-M235 HydrophobicContact CD2-CE 3.82Å; F231-M235 WeakPolarHBondContact O-CA 3.29Å; F231-M235 WeakPolarHBondContact O-CB 3.29Å; F231-M235 PolarHBondContact O-N 2.71Å; E232-M235 WeakPolarHBondContact O-CB 3.35Å; E232-M235 PolarHBondContact O-N 3.36Å; E232-M235 VanDerWaalsContact O-N 3.08Å; M235-T237 VanDerWaalsContact C-N 3.27Å; M235-T237 PolarHBondContact O-N 2.93Å; M235-W238 PolarHBondContact O-N 2.84Å; M235-M239 HydrophobicContact CG-CE 4.03Å; M235-M239 HydrophobicContact CG-CG 3.66Å; M235-M239 WeakPolarHBondContact O-CB 3.31Å; M235-M239 VanDerWaalsContact O-CG 3.25Å; M235-M239 WeakPolarHBondContact O-CG 3.06Å; M235-M239 PolarHBondContact O-N 2.93Å; M235-Y278 HydrophobicContact CE-CD1 4.21Å; M235-Y278 HydrophobicContact CE-CE1 3.64Å; M235-Y278 HydrophobicContact CG-CE1 4.26Å; M235-Y278 HydrophobicContact SD-CD1 4.19Å; M235-Y278 HydrophobicContact SD-CE1 3.99Å; M235-E285 HydrophobicContact CE-CB 3.5Å; M235-E285 HydrophobicContact CE-CG 4.41Å; M235-E285 HydrophobicContact SD-CB 4.08Å; M235-Y289 HydrophobicContact CB-CE2 4.48Å; M235-Y289 HydrophobicContact CG-CD2 4.37Å; M235-Y289 HydrophobicContact CG-CE2 3.82Å; M235-Y289 HydrophobicContact SD-CD2 4.14Å; M235-Y289 HydrophobicContact SD-CE2 3.8Å
236E96.6Very high96.3Very high135 Ų13546.1 Ų46.163%0.63124%0.243SC*.Hα-helixtrans-57.4-42.3178.1-173178.7-171.600111.8N234 T240 Y289N234-E236 VanDerWaalsContact C-N 3.33Å; N234-E236 PolarHBondContact O-N 2.94Å; E236-T240 WeakPolarHBondContact O-CB 3.45Å; E236-T240 PolarHBondContact O-N 3.29Å; E236-T240 PolarHBondContact O-OG1 3.13Å; E236-Y289 VanDerWaalsContact CA-OH 3.28Å; E236-Y289 WeakPolarHBondContact CA-OH 3.48Å; E236-Y289 WeakPolarHBondContact CB-OH 3.3Å; E236-Y289 PolarHBondContact N-OH 3.17Å
237T96.8Very high96.4Very high48 Ų4846.6 Ų46.629%0.29425%0.249SC..Hα-helixtrans-63.5-50.2178.8-63.90000110.5K189 N234 M235 N241K189-T237 HydrophobicContact CD-CG2 4.04Å; K189-T237 HydrophobicContact CG-CG2 4.26Å; N234-T237 WeakPolarHBondContact O-CB 3.22Å; N234-T237 PolarHBondContact O-N 2.94Å; N234-T237 VanDerWaalsContact O-N 3.13Å; M235-T237 VanDerWaalsContact C-N 3.27Å; M235-T237 PolarHBondContact O-N 2.93Å; T237-N241 WeakPolarHBondContact O-CB 3.33Å; T237-N241 PolarHBondContact O-N 3.25Å; T237-N241 PolarHBondContact O-ND2 3.23Å
238W97.8Very high96.2Very high0 Ų048.8 Ų48.80%026%0.26CS..Hα-helixtrans-65.3-50.8-178.9-80.1100.1000112T185 F188 I215 F219 F231 N234 M235 T240 N241 F242T185-W238 HydrophobicContact CG2-CZ2 4.2Å; T185-W238 WeakPolarHBondContact OG1-CZ2 3.46Å; T185-W238 PolarHBondContact OG1-NE1 2.81Å; F188-W238 HydrophobicContact CB-CH2 3.84Å; F188-W238 HydrophobicContact CB-CZ2 4.4Å; F188-W238 HydrophobicContact CB-CZ3 4.2Å; F188-W238 HydrophobicContact CD1-CD2 4.11Å; F188-W238 AromaticContact CD1-CE3 3.59Å; F188-W238 HydrophobicContact CD1-CE3 3.59Å; F188-W238 AromaticContact CD1-CH2 3.83Å; F188-W238 HydrophobicContact CD1-CH2 3.83Å; F188-W238 HydrophobicContact CD1-CZ2 4.3Å; F188-W238 AromaticContact CD1-CZ3 3.44Å; F188-W238 HydrophobicContact CD1-CZ3 3.44Å; F188-W238 VanDerWaalsContact CD1-CZ3 3.44Å; F188-W238 HydrophobicContact CD2-CH2 4.34Å; F188-W238 AromaticContact CD2-CZ3 3.9Å; F188-W238 HydrophobicContact CD2-CZ3 3.9Å; F188-W238 HydrophobicContact CE1-CD2 4.13Å; F188-W238 AromaticContact CE1-CE3 3.42Å; F188-W238 HydrophobicContact CE1-CE3 3.42Å; F188-W238 VanDerWaalsContact CE1-CE3 3.42Å; F188-W238 HydrophobicContact CE1-CH2 4.44Å; F188-W238 AromaticContact CE1-CZ3 3.62Å; F188-W238 HydrophobicContact CE1-CZ3 3.62Å; F188-W238 HydrophobicContact CE2-CZ3 4.06Å; F188-W238 HydrophobicContact CG-CE3 4.22Å; F188-W238 AromaticContact CG-CH2 3.76Å; F188-W238 HydrophobicContact CG-CH2 3.76Å; F188-W238 AromaticContact CG-CZ3 3.58Å; F188-W238 HydrophobicContact CG-CZ3 3.58Å; F188-W238 AromaticContact CZ-CE3 3.93Å; F188-W238 HydrophobicContact CZ-CE3 3.93Å; F188-W238 AromaticContact CZ-CZ3 3.92Å; F188-W238 HydrophobicContact CZ-CZ3 3.92Å; I215-W238 HydrophobicContact CG2-CH2 3.69Å; I215-W238 HydrophobicContact CG2-CZ3 4.04Å; F219-W238 HydrophobicContact CB-CH2 4.43Å; F219-W238 HydrophobicContact CB-CZ3 4.26Å; F219-W238 AromaticContact CD2-CD2 3.62Å; F219-W238 HydrophobicContact CD2-CD2 3.62Å; F219-W238 AromaticContact CD2-CE2 3.84Å; F219-W238 AromaticContact CD2-CE3 3.65Å; F219-W238 HydrophobicContact CD2-CE3 3.65Å; F219-W238 HydrophobicContact CD2-CG 4.18Å; F219-W238 HydrophobicContact CD2-CH2 4.1Å; F219-W238 HydrophobicContact CD2-CZ2 4.08Å; F219-W238 AromaticContact CD2-CZ3 3.9Å; F219-W238 HydrophobicContact CD2-CZ3 3.9Å; F219-W238 HydrophobicContact CE2-CB 4.07Å; F219-W238 AromaticContact CE2-CD2 3.65Å; F219-W238 HydrophobicContact CE2-CD2 3.65Å; F219-W238 AromaticContact CE2-CE3 3.99Å; F219-W238 HydrophobicContact CE2-CE3 3.99Å; F219-W238 AromaticContact CE2-CG 3.69Å; F219-W238 HydrophobicContact CE2-CG 3.69Å; F219-W238 HydrophobicContact CG-CE3 4.32Å; F219-W238 HydrophobicContact CG-CZ3 4.32Å; F231-W238 AromaticContact CD1-NE1 3.69Å; F231-W238 AromaticContact CE1-CE2 3.97Å; F231-W238 AromaticContact CE1-CZ2 3.98Å; F231-W238 HydrophobicContact CE1-CZ2 3.98Å; F231-W238 AromaticContact CE1-NE1 3.81Å; N234-W238 PolarHBondContact O-N 3Å; M235-W238 PolarHBondContact O-N 2.84Å; W238-T240 VanDerWaalsContact C-N 3.34Å; W238-T240 PolarHBondContact O-N 3.31Å; W238-N241 PolarHBondContact O-N 3.41Å; W238-F242 AromaticContact CE3-CE1 3.89Å; W238-F242 HydrophobicContact CE3-CE1 3.89Å; W238-F242 AromaticContact CE3-CE2 3.79Å; W238-F242 HydrophobicContact CE3-CE2 3.79Å; W238-F242 AromaticContact CE3-CZ 3.39Å; W238-F242 HydrophobicContact CE3-CZ 3.39Å; W238-F242 HydrophobicContact CZ3-CE1 4Å; W238-F242 HydrophobicContact CZ3-CE2 4.46Å; W238-F242 AromaticContact CZ3-CZ 3.64Å; W238-F242 HydrophobicContact CZ3-CZ 3.64Å; W238-F242 WeakPolarHBondContact O-CB 3.49Å; W238-F242 WeakPolarHBondContact O-CG 3.47Å; W238-F242 PolarHBondContact O-N 3.14Å
239M97.4Very high95.7Very high1 Ų152.9 Ų52.91%0.00528%0.281CS..Hα-helixtrans-68.1-33.5-174.1-62.3-53.6159.300112.5F219 M235 F242 H243 Y278 F286 Y289 R292 F293F219-M239 HydrophobicContact CE1-CE 4.45Å; F219-M239 HydrophobicContact CZ-CE 3.92Å; M235-M239 HydrophobicContact CG-CE 4.03Å; M235-M239 HydrophobicContact CG-CG 3.66Å; M235-M239 WeakPolarHBondContact O-CB 3.31Å; M235-M239 VanDerWaalsContact O-CG 3.25Å; M235-M239 WeakPolarHBondContact O-CG 3.06Å; M235-M239 PolarHBondContact O-N 2.93Å; M239-F242 HydrophobicContact SD-CD2 4.31Å; M239-H243 VanDerWaalsContact O-CB 3.3Å; M239-H243 WeakPolarHBondContact O-CB 3.44Å; M239-H243 PolarHBondContact O-N 3.12Å; M239-Y278 HydrophobicContact CE-CD1 3.31Å; M239-Y278 HydrophobicContact CE-CD2 4.16Å; M239-Y278 HydrophobicContact CE-CE1 3.24Å; M239-Y278 HydrophobicContact CE-CE2 4.15Å; M239-Y278 HydrophobicContact CE-CG 3.78Å; M239-F286 HydrophobicContact CE-CD2 4.39Å; M239-F286 HydrophobicContact CE-CE2 4.35Å; M239-F286 HydrophobicContact CG-CD2 4.29Å; M239-F286 HydrophobicContact CG-CE2 4.06Å; M239-F286 HydrophobicContact SD-CD2 4.08Å; M239-F286 HydrophobicContact SD-CE2 3.56Å; M239-F286 VanDerWaalsContact SD-CE2 3.56Å; M239-Y289 HydrophobicContact CB-CD1 4.25Å; M239-Y289 HydrophobicContact CB-CD2 4.2Å; M239-Y289 HydrophobicContact CB-CG 4Å; M239-Y289 HydrophobicContact CG-CD2 4.03Å; M239-Y289 HydrophobicContact CG-CE2 4.39Å; M239-Y289 HydrophobicContact CG-CG 4.29Å; M239-R292 PolarHBondContact O-NH2 3.23Å; M239-F293 HydrophobicContact CB-CE2 4.23Å; M239-F293 WeakPolarHBondContact O-CZ 3.48Å; M239-F293 HydrophobicContact SD-CE2 4.38Å; M239-F293 HydrophobicContact SD-CZ 4.4Å
240T96.8Very high95.2Very high65 Ų6547.2 Ų47.240%0.39926%0.256SS..Hα-helixtrans-69.6-42.7176.4-62.10000111.6E236 W238 H243 G244 R292E236-T240 WeakPolarHBondContact O-CB 3.45Å; E236-T240 PolarHBondContact O-N 3.29Å; E236-T240 PolarHBondContact O-OG1 3.13Å; W238-T240 VanDerWaalsContact C-N 3.34Å; W238-T240 PolarHBondContact O-N 3.31Å; T240-H243 PolarHBondContact O-N 3.41Å; T240-G244 PolarHBondContact O-N 2.94Å; T240-R292 PolarHBondContact OG1-NH1 2.88Å
241N97.2Very high94.5Very high46 Ų4652.4 Ų52.425%0.24628%0.278CS..Hα-helixtrans-69.5-41.2176.7-79.7-67.8000112.3F188 I192 T237 W238 G244 L245F188-N241 HydrophobicContact CE1-CB 3.55Å; F188-N241 HydrophobicContact CZ-CB 3.76Å; I192-N241 HydrophobicContact CD1-CB 3.64Å; I192-N241 WeakPolarHBondContact CD1-OD1 3.45Å; T237-N241 WeakPolarHBondContact O-CB 3.33Å; T237-N241 PolarHBondContact O-N 3.25Å; T237-N241 PolarHBondContact O-ND2 3.23Å; W238-N241 PolarHBondContact O-N 3.41Å; N241-G244 PolarHBondContact O-N 2.91Å; N241-L245 WeakPolarHBondContact O-CG 3.46Å; N241-L245 PolarHBondContact O-N 3.1Å
242F97.9Very high93.8Very high2 Ų256 Ų561%0.00930%0.297CS..Hα-helixtrans-60.6-43.9173.3-77.5-23.8000112.2F188 F219 W238 M239 G244 L245 L246 I271 N274 F293F188-F242 HydrophobicContact CE2-CD1 4.38Å; F188-F242 HydrophobicContact CE2-CE1 4.01Å; F188-F242 AromaticContact CZ-CD1 3.77Å; F188-F242 HydrophobicContact CZ-CD1 3.77Å; F188-F242 AromaticContact CZ-CE1 3.69Å; F188-F242 HydrophobicContact CZ-CE1 3.69Å; F219-F242 HydrophobicContact CB-CZ 4.35Å; F219-F242 AromaticContact CD1-CE2 3.82Å; F219-F242 HydrophobicContact CD1-CE2 3.82Å; F219-F242 HydrophobicContact CD1-CZ 4.06Å; F219-F242 HydrophobicContact CD2-CE2 4.36Å; F219-F242 HydrophobicContact CD2-CZ 4.4Å; F219-F242 AromaticContact CE1-CE2 3.78Å; F219-F242 HydrophobicContact CE1-CE2 3.78Å; F219-F242 HydrophobicContact CE1-CZ 4.47Å; F219-F242 HydrophobicContact CE2-CE2 4.32Å; F219-F242 HydrophobicContact CG-CE2 4.11Å; F219-F242 HydrophobicContact CG-CZ 4.01Å; F219-F242 HydrophobicContact CZ-CE2 4.03Å; W238-F242 AromaticContact CE3-CE1 3.89Å; W238-F242 HydrophobicContact CE3-CE1 3.89Å; W238-F242 AromaticContact CE3-CE2 3.79Å; W238-F242 HydrophobicContact CE3-CE2 3.79Å; W238-F242 AromaticContact CE3-CZ 3.39Å; W238-F242 HydrophobicContact CE3-CZ 3.39Å; W238-F242 HydrophobicContact CZ3-CE1 4Å; W238-F242 HydrophobicContact CZ3-CE2 4.46Å; W238-F242 AromaticContact CZ3-CZ 3.64Å; W238-F242 HydrophobicContact CZ3-CZ 3.64Å; W238-F242 WeakPolarHBondContact O-CB 3.49Å; W238-F242 WeakPolarHBondContact O-CG 3.47Å; W238-F242 PolarHBondContact O-N 3.14Å; M239-F242 HydrophobicContact SD-CD2 4.31Å; F242-G244 VanDerWaalsContact C-N 3.33Å; F242-G244 PolarHBondContact O-N 2.86Å; F242-L245 PolarHBondContact O-N 3.46Å; F242-L246 VanDerWaalsContact O-CB 3.27Å; F242-L246 WeakPolarHBondContact O-CB 3.39Å; F242-L246 PolarHBondContact O-N 3.16Å; F242-I271 HydrophobicContact CB-CG1 4.48Å; F242-I271 HydrophobicContact CB-CG2 3.91Å; F242-I271 HydrophobicContact CD1-CD1 4.11Å; F242-I271 HydrophobicContact CD1-CG1 3.82Å; F242-I271 HydrophobicContact CE1-CG1 4.33Å; F242-I271 HydrophobicContact CG-CG1 4.26Å; F242-I271 HydrophobicContact CG-CG2 4.33Å; F242-N274 HydrophobicContact CE2-CB 4.32Å; F242-N274 WeakPolarHBondContact CZ-ND2 3.1Å; F242-F293 HydrophobicContact CB-CE1 4.4Å; F242-F293 HydrophobicContact CB-CZ 4.09Å
243H97.3Very high93.1Very high46 Ų4652 Ų5221%0.21328%0.279CS..Hα-helixtrans-60-44173.7-180-82.4000111.6M239 T240 L246 T247 F293M239-H243 VanDerWaalsContact O-CB 3.3Å; M239-H243 WeakPolarHBondContact O-CB 3.44Å; M239-H243 PolarHBondContact O-N 3.12Å; T240-H243 PolarHBondContact O-N 3.41Å; H243-L246 PolarHBondContact O-N 3.42Å; H243-T247 PolarHBondContact O-N 3.11Å; H243-T247 VanDerWaalsContact O-N 3.08Å; H243-T247 PolarHBondContact O-OG1 2.84Å; H243-T247 VanDerWaalsContact O-OG1 3.13Å; H243-F293 HydrophobicContact CB-CE1 4.42Å; H243-F293 HydrophobicContact CB-CE2 4.33Å; H243-F293 HydrophobicContact CB-CZ 4.01Å
244G95.9Very high92.4Very high34 Ų3450.2 Ų50.235%0.35127%0.266SS..Hα-helixtrans-57-50175.500000112.8T240 N241 F242 L246 T247 L248T240-G244 PolarHBondContact O-N 2.94Å; N241-G244 PolarHBondContact O-N 2.91Å; F242-G244 VanDerWaalsContact C-N 3.33Å; F242-G244 PolarHBondContact O-N 2.86Å; G244-L246 VanDerWaalsContact C-N 3.33Å; G244-L246 PolarHBondContact O-N 3.28Å; G244-T247 PolarHBondContact O-N 2.98Å; G244-T247 PolarHBondContact O-OG1 3.31Å; G244-T247 VanDerWaalsContact O-OG1 3.11Å; G244-L248 PolarHBondContact O-N 3.38Å
245L95.4Very high91.6Very high13 Ų1350.1 Ų50.17%0.06827%0.268CS..Hα-helixtrans-63.8-35.8177.6-69.8169.7000112.7F188 I192 L212 N241 F242 L248 L267 I271F188-L245 HydrophobicContact CE2-CD1 3.95Å; F188-L245 HydrophobicContact CZ-CD1 4.07Å; I192-L245 HydrophobicContact CD1-CD1 4Å; I192-L245 HydrophobicContact CD1-CG 4.49Å; I192-L245 HydrophobicContact CG1-CD1 4.37Å; L212-L245 HydrophobicContact CD1-CD1 4.47Å; L212-L245 HydrophobicContact CD1-CD2 4.05Å; N241-L245 WeakPolarHBondContact O-CG 3.46Å; N241-L245 PolarHBondContact O-N 3.1Å; F242-L245 PolarHBondContact O-N 3.46Å; L245-L248 WeakPolarHBondContact O-CB 3.4Å; L245-L248 PolarHBondContact O-N 3.37Å; L245-L267 HydrophobicContact CB-CD2 4.49Å; L245-L267 HydrophobicContact CD1-CD2 4.3Å; L245-L267 HydrophobicContact CD2-CD2 4.23Å; L245-I271 HydrophobicContact CB-CD1 3.64Å; L245-I271 HydrophobicContact CD1-CD1 4.35Å
246L94.9Very high90.7Very high3 Ų357.7 Ų57.72%0.01631%0.308CS..Hα-helixtrans-65.3-40.6178-173.964.8000112.1F242 H243 G244 K268 I271 F293 A296 I297 L300F242-L246 VanDerWaalsContact O-CB 3.27Å; F242-L246 WeakPolarHBondContact O-CB 3.39Å; F242-L246 PolarHBondContact O-N 3.16Å; H243-L246 PolarHBondContact O-N 3.42Å; G244-L246 VanDerWaalsContact C-N 3.33Å; G244-L246 PolarHBondContact O-N 3.28Å; L246-K268 HydrophobicContact CD1-CB 4.04Å; L246-K268 HydrophobicContact CD1-CG 4.21Å; L246-K268 WeakPolarHBondContact O-CE 3.13Å; L246-I271 HydrophobicContact CB-CG2 4.26Å; L246-I271 HydrophobicContact CD1-CG2 4.34Å; L246-I271 HydrophobicContact CD2-CG2 4.48Å; L246-F293 HydrophobicContact CD2-CD1 3.9Å; L246-F293 HydrophobicContact CD2-CE1 4.2Å; L246-A296 HydrophobicContact CD2-CB 3.99Å; L246-I297 HydrophobicContact CD2-CD1 4.32Å; L246-I297 HydrophobicContact CD2-CG1 3.74Å; L246-L300 HydrophobicContact CD1-CD2 4.16Å
247T93.8Very high90Very high81 Ų8154.4 Ų54.450%0.49730%0.295SS..Hα-helixtrans-85-7.9179.4600000114.3H243 G244 A296H243-T247 PolarHBondContact O-N 3.11Å; H243-T247 VanDerWaalsContact O-N 3.08Å; H243-T247 PolarHBondContact O-OG1 2.84Å; H243-T247 VanDerWaalsContact O-OG1 3.13Å; G244-T247 PolarHBondContact O-N 2.98Å; G244-T247 PolarHBondContact O-OG1 3.31Å; G244-T247 VanDerWaalsContact O-OG1 3.11Å; T247-A296 HydrophobicContact CG2-CB 3.86Å
248L90.7Very high89.1Confident66 Ų6658.8 Ų58.835%0.34631%0.312SS..  trans-67.7135.1-179.9-175.172.9000110.8F209 G244 L245 K268F209-L248 HydrophobicContact CE1-CD2 4.31Å; F209-L248 HydrophobicContact CZ-CD2 3.69Å; G244-L248 PolarHBondContact O-N 3.38Å; L245-L248 WeakPolarHBondContact O-CB 3.4Å; L245-L248 PolarHBondContact O-N 3.37Å; L248-K268 WeakPolarHBondContact O-CE 3.42Å; L248-K268 PolarHBondContact O-NZ 3.35Å
249D85.5Confident88.3Confident104 Ų10465.4 Ų65.456%0.55634%0.343SS*.  trans-119.9128.6166.2-175.729.4000109.5Q254D249-Q254 PolarHBondContact OD1-NE2 3.38Å
250N83.9Confident87.6Confident31 Ų3172 Ų7217%0.16637%0.374CS..  trans-142.7109.4178.4-171-23.7000110.7L252 L253N250-L252 PolarHBondContact O-N 3.09Å; N250-L252 VanDerWaalsContact O-N 3.15Å; N250-L252 WeakPolarHBondContact OD1-CB 3.4Å; N250-L252 PolarHBondContact OD1-N 3.4Å; N250-L253 HydrophobicContact CB-CD1 4.34Å; N250-L253 PolarHBondContact O-N 3.43Å; N250-L253 VanDerWaalsContact O-N 3.09Å
251K82.5Confident87.1Confident163 Ų16370.6 Ų70.671%0.70937%0.369SS*.THydrogen-bonded Turntrans-60.3-23.9-179-61.9-171.6178-172.40114.3L253 Q254K251-L253 PolarHBondContact O-N 3.01Å; K251-Q254 PolarHBondContact O-N 3.43Å
252L83.9Confident86.7Confident74 Ų7468.9 Ų68.939%0.38736%0.362SS..THydrogen-bonded Turntrans-72.8-16.5178.7-60.9178.7000113.4A199 A202 L205 N250A199-L252 WeakPolarHBondContact O-CD1 3.39Å; A202-L252 HydrophobicContact CB-CB 4.29Å; L205-L252 HydrophobicContact CD1-CB 4.44Å; L205-L252 HydrophobicContact CD1-CD1 4.18Å; N250-L252 PolarHBondContact O-N 3.09Å; N250-L252 VanDerWaalsContact O-N 3.15Å; N250-L252 WeakPolarHBondContact OD1-CB 3.4Å; N250-L252 PolarHBondContact OD1-N 3.4Å
253L82.6Confident86.2Confident8 Ų871 Ų714%0.04237%0.373CS..SBendtrans-105.1-7.4-179.8-68.2172.9000113L205 K206 F209 N250 K251 L264L205-L253 HydrophobicContact CB-CD1 4.45Å; L205-L253 HydrophobicContact CB-CD2 3.85Å; L205-L253 HydrophobicContact CB-CG 4.32Å; K206-L253 HydrophobicContact CG-CD2 4.1Å; F209-L253 HydrophobicContact CD1-CD1 3.74Å; F209-L253 HydrophobicContact CD2-CD1 3.5Å; F209-L253 VanDerWaalsContact CD2-CD1 3.5Å; F209-L253 HydrophobicContact CE1-CD1 3.62Å; F209-L253 HydrophobicContact CE2-CD1 3.37Å; F209-L253 HydrophobicContact CG-CD1 3.68Å; F209-L253 HydrophobicContact CZ-CD1 3.42Å; F209-L253 VanDerWaalsContact CZ-CD1 3.42Å; N250-L253 HydrophobicContact CB-CD1 4.34Å; N250-L253 PolarHBondContact O-N 3.43Å; N250-L253 VanDerWaalsContact O-N 3.09Å; K251-L253 PolarHBondContact O-N 3.01Å; L253-L264 HydrophobicContact CB-CB 4.12Å
254Q80.6Confident86Confident81 Ų8168.8 Ų68.838%0.37936%0.363SS..  trans-70.8141.8171.8-68176.2-4.400109D249 K251D249-Q254 PolarHBondContact OD1-NE2 3.38Å; K251-Q254 PolarHBondContact O-N 3.43Å
255T79.8Confident85.8Confident44 Ų4467.8 Ų67.827%0.2735%0.349SS..  trans-102.7139.9174.2-178.90000109.6D257 E260 K309T255-D257 HydrophobicContact CG2-CB 4.34Å; T255-D257 PolarHBondContact O-N 3.09Å; T255-D257 VanDerWaalsContact OG1-CB 3.29Å; T255-D257 WeakPolarHBondContact OG1-CB 3.31Å; T255-D257 PolarHBondContact OG1-N 3.12Å; T255-E260 WeakPolarHBondContact CG2-O 3.29Å; T255-K309 HydrophobicContact CG2-CD 4.09Å; T255-K309 PolarHBondContact O-NZ 3.07Å
256D78.1Confident85.6Confident167 Ų16770.2 Ų70.289%0.89336%0.361SS*.SBendtrans-74.5-12.2172.4-63.7-34.2000111.6
257D81.6Confident85.7Confident66 Ų6670 Ų7035%0.35336%0.361SS..  trans-68.2134.4174.7-160.9-52.2000110.5T255 E259 E260 K309T255-D257 HydrophobicContact CG2-CB 4.34Å; T255-D257 PolarHBondContact O-N 3.09Å; T255-D257 VanDerWaalsContact OG1-CB 3.29Å; T255-D257 WeakPolarHBondContact OG1-CB 3.31Å; T255-D257 PolarHBondContact OG1-N 3.12Å; D257-E259 WeakPolarHBondContact OD1-CA 3.44Å; D257-E259 WeakPolarHBondContact OD1-CB 3.49Å; D257-E259 PolarHBondContact OD1-N 2.96Å; D257-E260 HydrophobicContact CB-CB 4.38Å; D257-E260 PolarHBondContact OD1-N 3.19Å; D257-K309 VanDerWaalsContact O-CD 3.23Å; D257-K309 WeakPolarHBondContact O-CD 3.47Å; D257-K309 WeakPolarHBondContact O-CE 3.39Å; D257-K309 PolarHBondContact O-NZ 3.42Å
258E78.6Confident85.8Confident139 Ų13967.1 Ų67.165%0.6534%0.341SS*.SBendtrans-89.1-15.1178.6-66.6-173.817700112.8V308 K309E258-V308 PolarHBondContact O-N 3.11Å; E258-K309 PolarHBondContact O-N 3.32Å
259E79.9Confident86Confident140 Ų14064 Ų6465%0.65433%0.325SS*.SBendtrans-102.4-46.2-177.6-65.8-179.7-162.600112.6D257 K309D257-E259 WeakPolarHBondContact OD1-CA 3.44Å; D257-E259 WeakPolarHBondContact OD1-CB 3.49Å; D257-E259 PolarHBondContact OD1-N 2.96Å; E259-K309 WeakPolarHBondContact O-CA 3.31Å; E259-K309 PolarHBondContact O-N 3.06Å
260E83.5Confident86.5Confident140 Ų14059.8 Ų59.865%0.65430%0.302SS*.SBendtrans-85.3125.9-176.7-70.1-162164.100112.4T255 D257 K309T255-E260 WeakPolarHBondContact CG2-O 3.29Å; D257-E260 HydrophobicContact CB-CB 4.38Å; D257-E260 PolarHBondContact OD1-N 3.19Å; E260-K309 WeakPolarHBondContact O-CB 3.36Å
261A86.3Confident87.1Confident35 Ų3558.3 Ų58.329%0.28929%0.294SS..PPolyproline II helixtrans-66.5132174.300000111.8E265 L266 K309A261-E265 HydrophobicContact CB-CB 4.33Å; A261-L266 HydrophobicContact CB-CD2 4.09Å; A261-L266 HydrophobicContact CB-CG 4.12Å; A261-K309 VanDerWaalsContact CB-O 3.23Å; A261-K309 WeakPolarHBondContact CB-O 3.4Å
262G88.3Confident87.7Confident9 Ų950.6 Ų50.69%0.09326%0.26CS..PPolyproline II helixtrans-70.1167.1169.900000112.4L264 E265 L266G262-L264 PolarHBondContact O-N 3.05Å; G262-E265 VanDerWaalsContact C-OE2 3.29Å; G262-E265 WeakPolarHBondContact CA-OE2 3.11Å; G262-E265 PolarHBondContact N-OE2 3.32Å; G262-E265 PolarHBondContact O-N 3.25Å; G262-L266 WeakPolarHBondContact O-CG 3.39Å; G262-L266 PolarHBondContact O-N 3.05Å
263L88.4Confident88.2Confident46 Ų4648.9 Ų48.924%0.24125%0.252CS..Hα-helixtrans-65.7-26.9179.1-74.3170.3000112.9K206 F209 L266 L267K206-L263 HydrophobicContact CB-CD1 3.91Å; K206-L263 HydrophobicContact CG-CD1 4.15Å; K206-L263 WeakPolarHBondContact O-CD1 3.47Å; F209-L263 HydrophobicContact CB-CB 4.04Å; F209-L263 HydrophobicContact CB-CD1 4.43Å; L263-L266 HydrophobicContact CD2-CD1 4.4Å; L263-L267 WeakPolarHBondContact O-CB 3.29Å; L263-L267 PolarHBondContact O-N 3.28Å; L263-L267 VanDerWaalsContact O-N 3.09Å
264L91.2Very high88.8Confident1 Ų148.6 Ų48.61%0.00525%0.25CS..Hα-helixtrans-67.3-46.7175.8-177.662.6000110.2F209 L253 G262 L267 K268F209-L264 HydrophobicContact CD1-CD1 4.46Å; F209-L264 HydrophobicContact CE1-CD1 3.73Å; L253-L264 HydrophobicContact CB-CB 4.12Å; G262-L264 PolarHBondContact O-N 3.05Å; L264-L267 PolarHBondContact O-N 3.37Å; L264-K268 HydrophobicContact CG-CD 4.41Å; L264-K268 VanDerWaalsContact O-CG 3.31Å; L264-K268 WeakPolarHBondContact O-CG 3.23Å; L264-K268 PolarHBondContact O-N 3.31Å
265E92.6Very high89.6Confident12 Ų1244.8 Ų44.86%0.05623%0.233CC..Hα-helixtrans-63.4-45.4178.6-66.864.6-140.600110.9A261 G262 L267 K268 S269 Y310 L313A261-E265 HydrophobicContact CB-CB 4.33Å; G262-E265 VanDerWaalsContact C-OE2 3.29Å; G262-E265 WeakPolarHBondContact CA-OE2 3.11Å; G262-E265 PolarHBondContact N-OE2 3.32Å; G262-E265 PolarHBondContact O-N 3.25Å; E265-L267 VanDerWaalsContact C-N 3.35Å; E265-L267 PolarHBondContact O-N 3.47Å; E265-K268 PolarHBondContact O-N 3.2Å; E265-S269 WeakPolarHBondContact O-CB 3.44Å; E265-S269 PolarHBondContact O-N 3.49Å; E265-Y310 HydrophobicContact CG-CD1 3.58Å; E265-Y310 HydrophobicContact CG-CE1 3.6Å; E265-L313 HydrophobicContact CB-CD2 4.42Å; E265-L313 HydrophobicContact CG-CD2 4.42Å
266L92.2Very high90.2Very high64 Ų6443 Ų4334%0.33522%0.222SC..Hα-helixtrans-60.2-42.2177-70.2173.8000112.6A261 G262 L263 S269 Q270 L312A261-L266 HydrophobicContact CB-CD2 4.09Å; A261-L266 HydrophobicContact CB-CG 4.12Å; G262-L266 WeakPolarHBondContact O-CG 3.39Å; G262-L266 PolarHBondContact O-N 3.05Å; L263-L266 HydrophobicContact CD2-CD1 4.4Å; L266-S269 PolarHBondContact O-N 2.95Å; L266-Q270 PolarHBondContact O-N 2.72Å; L266-Q270 VanDerWaalsContact O-N 3.1Å; L266-L312 HydrophobicContact CD2-CD2 4.09Å
267L95.4Very high90.9Very high0 Ų035.3 Ų35.30%018%0.181CC..Hα-helixtrans-66-48.4177177.158.9000111.2F209 L212 S216 L245 L263 L264 E265 S269 Q270 I271F209-L267 HydrophobicContact CD1-CD2 3.63Å; F209-L267 HydrophobicContact CE1-CD2 3.76Å; L212-L267 HydrophobicContact CB-CD1 4.01Å; L212-L267 HydrophobicContact CB-CD2 3.9Å; L212-L267 HydrophobicContact CD1-CD2 4.14Å; S216-L267 WeakPolarHBondContact OG-CD1 3.46Å; L245-L267 HydrophobicContact CB-CD2 4.49Å; L245-L267 HydrophobicContact CD1-CD2 4.3Å; L245-L267 HydrophobicContact CD2-CD2 4.23Å; L263-L267 WeakPolarHBondContact O-CB 3.29Å; L263-L267 PolarHBondContact O-N 3.28Å; L263-L267 VanDerWaalsContact O-N 3.09Å; L264-L267 PolarHBondContact O-N 3.37Å; E265-L267 VanDerWaalsContact C-N 3.35Å; E265-L267 PolarHBondContact O-N 3.47Å; L267-S269 PolarHBondContact O-N 2.86Å; L267-Q270 PolarHBondContact O-N 2.85Å; L267-I271 HydrophobicContact CD1-CD1 4.11Å; L267-I271 HydrophobicContact CD1-CG1 4.38Å; L267-I271 HydrophobicContact CG-CD1 3.98Å; L267-I271 WeakPolarHBondContact O-CG1 3.3Å; L267-I271 PolarHBondContact O-N 2.7Å
268K95.9Very high91.6Very high19 Ų1932.1 Ų32.18%0.08316%0.164CC..Hα-helixtrans-58.7-39.6177.7-71.3-177.6179.7-176.20111.4L246 L248 L264 E265 I271 C272 L300 L313L246-K268 HydrophobicContact CD1-CB 4.04Å; L246-K268 HydrophobicContact CD1-CG 4.21Å; L246-K268 WeakPolarHBondContact O-CE 3.13Å; L248-K268 WeakPolarHBondContact O-CE 3.42Å; L248-K268 PolarHBondContact O-NZ 3.35Å; L264-K268 HydrophobicContact CG-CD 4.41Å; L264-K268 VanDerWaalsContact O-CG 3.31Å; L264-K268 WeakPolarHBondContact O-CG 3.23Å; L264-K268 PolarHBondContact O-N 3.31Å; E265-K268 PolarHBondContact O-N 3.2Å; K268-I271 WeakPolarHBondContact O-CB 3.47Å; K268-I271 PolarHBondContact O-N 3.16Å; K268-C272 PolarHBondContact O-N 3Å; K268-C272 PolarHBondContact O-SG 3.26Å; K268-C272 VanDerWaalsContact O-SG 3.4Å; K268-L300 HydrophobicContact CD-CD1 4.23Å; K268-L313 HydrophobicContact CB-CD1 3.51Å; K268-L313 HydrophobicContact CB-CD2 4.3Å; K268-L313 HydrophobicContact CD-CD2 4.49Å
269S94.6Very high92.2Very high2 Ų225.5 Ų25.51%0.01413%0.133CC..Hα-helixtrans-63.3-45.3178.2-160.30000111.5E265 L266 L267 I271 C272 D273 L312 L313 N316E265-S269 WeakPolarHBondContact O-CB 3.44Å; E265-S269 PolarHBondContact O-N 3.49Å; L266-S269 PolarHBondContact O-N 2.95Å; L267-S269 PolarHBondContact O-N 2.86Å; S269-I271 VanDerWaalsContact C-N 3.27Å; S269-I271 PolarHBondContact O-N 2.74Å; S269-C272 WeakPolarHBondContact O-CB 3.23Å; S269-C272 PolarHBondContact O-N 3.11Å; S269-D273 PolarHBondContact O-N 3.4Å; S269-D273 VanDerWaalsContact O-N 3.1Å; S269-L312 WeakPolarHBondContact OG-CG 3.15Å; S269-L312 PolarHBondContact OG-O 3.36Å; S269-L313 VanDerWaalsContact N-CD1 3.33Å; S269-L313 WeakPolarHBondContact OG-CA 3.15Å; S269-N316 PolarHBondContact OG-ND2 3.5Å
270Q96.1Very high92.7Very high14 Ų1423.2 Ų23.27%0.06512%0.122CC..Hα-helixtrans-64.2-33.5175.8-173.759.763.400112.2K217 L266 L267 D273 N274K217-Q270 HydrophobicContact CG-CG 3.95Å; L266-Q270 PolarHBondContact O-N 2.72Å; L266-Q270 VanDerWaalsContact O-N 3.1Å; L267-Q270 PolarHBondContact O-N 2.85Å; Q270-D273 PolarHBondContact O-N 2.98Å; Q270-N274 PolarHBondContact NE2-OD1 2.76Å; Q270-N274 PolarHBondContact O-N 3.2Å; Q270-N274 PolarHBondContact O-OD1 3.2Å; Q270-N274 VanDerWaalsContact O-OD1 3.09Å
271I97.5Very high93.1Very high1 Ų121 Ų211%0.00511%0.111CC..Hα-helixtrans-67.4-40.3174.7-68.7166.4000110.8F242 L245 L246 L267 K268 S269 D273 N274 A275 F293F242-I271 HydrophobicContact CB-CG1 4.48Å; F242-I271 HydrophobicContact CB-CG2 3.91Å; F242-I271 HydrophobicContact CD1-CD1 4.11Å; F242-I271 HydrophobicContact CD1-CG1 3.82Å; F242-I271 HydrophobicContact CE1-CG1 4.33Å; F242-I271 HydrophobicContact CG-CG1 4.26Å; F242-I271 HydrophobicContact CG-CG2 4.33Å; L245-I271 HydrophobicContact CB-CD1 3.64Å; L245-I271 HydrophobicContact CD1-CD1 4.35Å; L246-I271 HydrophobicContact CB-CG2 4.26Å; L246-I271 HydrophobicContact CD1-CG2 4.34Å; L246-I271 HydrophobicContact CD2-CG2 4.48Å; L267-I271 HydrophobicContact CD1-CD1 4.11Å; L267-I271 HydrophobicContact CD1-CG1 4.38Å; L267-I271 HydrophobicContact CG-CD1 3.98Å; L267-I271 WeakPolarHBondContact O-CG1 3.3Å; L267-I271 PolarHBondContact O-N 2.7Å; K268-I271 WeakPolarHBondContact O-CB 3.47Å; K268-I271 PolarHBondContact O-N 3.16Å; S269-I271 VanDerWaalsContact C-N 3.27Å; S269-I271 PolarHBondContact O-N 2.74Å; I271-D273 VanDerWaalsContact C-N 3.3Å; I271-D273 PolarHBondContact O-N 2.72Å; I271-N274 PolarHBondContact O-N 2.95Å; I271-A275 WeakPolarHBondContact O-CB 3.38Å; I271-A275 PolarHBondContact O-N 2.92Å; I271-F293 HydrophobicContact CG2-CE1 4.14Å
272C95.8Very high93.5Very high0 Ų019.9 Ų19.90%010%0.099CC..Hα-helixtrans-57.5-43.3172.4-68.20000111.4K268 S269 N274 A275 A276 N316K268-C272 PolarHBondContact O-N 3Å; K268-C272 PolarHBondContact O-SG 3.26Å; K268-C272 VanDerWaalsContact O-SG 3.4Å; S269-C272 WeakPolarHBondContact O-CB 3.23Å; S269-C272 PolarHBondContact O-N 3.11Å; C272-N274 PolarHBondContact O-N 2.76Å; C272-A275 PolarHBondContact O-N 3.31Å; C272-A276 VanDerWaalsContact O-CB 3.31Å; C272-A276 WeakPolarHBondContact O-CB 3.3Å; C272-A276 PolarHBondContact O-N 3.38Å; C272-N316 HydrophobicContact CB-CB 3.93Å
273D93.4Very high93.6Very high39 Ų3921 Ų2121%0.20910%0.103CC..Hα-helixtrans-63.1-42.3175.8-70-12.6000112.5Y220 S269 Q270 I271 A276 L277 N316Y220-D273 HydrophobicContact CD2-CB 4.22Å; Y220-D273 HydrophobicContact CE2-CB 4.04Å; S269-D273 PolarHBondContact O-N 3.4Å; S269-D273 VanDerWaalsContact O-N 3.1Å; Q270-D273 PolarHBondContact O-N 2.98Å; I271-D273 VanDerWaalsContact C-N 3.3Å; I271-D273 PolarHBondContact O-N 2.72Å; D273-A276 PolarHBondContact O-N 2.78Å; D273-L277 WeakPolarHBondContact O-CB 3.26Å; D273-L277 PolarHBondContact O-N 2.95Å; D273-N316 WeakPolarHBondContact OD1-CB 3.32Å; D273-N316 PolarHBondContact OD1-ND2 2.96Å; D273-N316 PolarHBondContact OD2-ND2 2.98Å; D273-N316 VanDerWaalsContact OD2-ND2 3.12Å
274N95.9Very high93.7Very high1 Ų126.8 Ų26.81%0.00513%0.129CC..Hα-helixtrans-63.8-43.9178.2-67.20.4000110.8S216 F219 Y220 F242 Q270 I271 C272 L277 Y278S216-N274 PolarHBondContact O-ND2 3.03Å; S216-N274 PolarHBondContact O-OD1 2.95Å; F219-N274 HydrophobicContact CD1-CB 4.22Å; F219-N274 HydrophobicContact CE1-CB 4.27Å; Y220-N274 WeakPolarHBondContact CB-OD1 3.49Å; Y220-N274 WeakPolarHBondContact CD2-OD1 3.49Å; F242-N274 HydrophobicContact CE2-CB 4.32Å; F242-N274 WeakPolarHBondContact CZ-ND2 3.1Å; Q270-N274 PolarHBondContact NE2-OD1 2.76Å; Q270-N274 PolarHBondContact O-N 3.2Å; Q270-N274 PolarHBondContact O-OD1 3.2Å; Q270-N274 VanDerWaalsContact O-OD1 3.09Å; I271-N274 PolarHBondContact O-N 2.95Å; C272-N274 PolarHBondContact O-N 2.76Å; N274-L277 PolarHBondContact O-N 3.48Å; N274-Y278 WeakPolarHBondContact O-CD2 3.31Å; N274-Y278 PolarHBondContact O-N 3.43Å; N274-Y278 VanDerWaalsContact O-N 3.1Å
275A95.9Very high93.9Very high2 Ų229.9 Ų29.92%0.01714%0.143CC..Hα-helixtrans-65.8-38.6176.200000111.7I271 C272 Y278 A279 F286 F293 F320I271-A275 WeakPolarHBondContact O-CB 3.38Å; I271-A275 PolarHBondContact O-N 2.92Å; C272-A275 PolarHBondContact O-N 3.31Å; A275-Y278 PolarHBondContact O-N 3.19Å; A275-A279 VanDerWaalsContact O-CB 3.28Å; A275-A279 WeakPolarHBondContact O-CB 3.34Å; A275-A279 PolarHBondContact O-N 3.06Å; A275-F286 HydrophobicContact CB-CZ 4.23Å; A275-F293 HydrophobicContact CB-CD1 3.99Å; A275-F293 HydrophobicContact CB-CE1 4.27Å; A275-F293 HydrophobicContact CB-CG 4.46Å; A275-F320 HydrophobicContact CB-CD2 3.99Å; A275-F320 HydrophobicContact CB-CE2 3.88Å
276A92.7Very high94Very high6 Ų629.3 Ų29.35%0.0514%0.141CC..Hα-helixtrans-65.5-42.8175.900000111.6C272 D273 Y278 A279 Q280 F320C272-A276 VanDerWaalsContact O-CB 3.31Å; C272-A276 WeakPolarHBondContact O-CB 3.3Å; C272-A276 PolarHBondContact O-N 3.38Å; D273-A276 PolarHBondContact O-N 2.78Å; A276-Y278 PolarHBondContact O-N 2.74Å; A276-A279 PolarHBondContact O-N 2.99Å; A276-Q280 WeakPolarHBondContact O-CB 3.45Å; A276-Q280 WeakPolarHBondContact O-CG 3.47Å; A276-Q280 PolarHBondContact O-N 2.81Å; A276-F320 HydrophobicContact CB-CB 4.26Å; A276-F320 HydrophobicContact CB-CD2 4.19Å
277L93.6Very high94Very high5 Ų531.5 Ų31.53%0.02615%0.149CC..Hα-helixtrans-57.2-48.6174.5176.167.7000111.4Y220 N223 F224 D273 N274 Q280 K281 Y282Y220-L277 HydrophobicContact CD2-CB 4.27Å; Y220-L277 HydrophobicContact CD2-CD2 3.8Å; Y220-L277 HydrophobicContact CE2-CB 3.81Å; Y220-L277 HydrophobicContact CE2-CD2 3.87Å; Y220-L277 HydrophobicContact CE2-CG 4.3Å; Y220-L277 HydrophobicContact CG-CD2 4.25Å; N223-L277 HydrophobicContact CB-CD2 4.33Å; F224-L277 HydrophobicContact CD2-CD1 4.13Å; D273-L277 WeakPolarHBondContact O-CB 3.26Å; D273-L277 PolarHBondContact O-N 2.95Å; N274-L277 PolarHBondContact O-N 3.48Å; L277-Q280 PolarHBondContact O-N 3.02Å; L277-K281 HydrophobicContact CD1-CD 3.63Å; L277-K281 HydrophobicContact CD1-CG 4.16Å; L277-K281 PolarHBondContact O-N 3.03Å; L277-Y282 HydrophobicContact CG-CE2 4.32Å
278Y95Very high93.9Very high0 Ų036 Ų360%018%0.179CC..Hα-helixtrans-66.6-45.6179.7-91.3-117000111.9F219 N223 L227 M235 M239 N274 A275 A276 Q280 Y282 D283 F286F219-Y278 HydrophobicContact CE1-CD2 4.17Å; F219-Y278 AromaticContact CE1-CE2 3.43Å; F219-Y278 HydrophobicContact CE1-CE2 3.43Å; F219-Y278 VanDerWaalsContact CE1-CE2 3.43Å; F219-Y278 AromaticContact CE1-CZ 3.92Å; F219-Y278 HydrophobicContact CZ-CE1 4.43Å; F219-Y278 AromaticContact CZ-CE2 3.54Å; F219-Y278 HydrophobicContact CZ-CE2 3.54Å; F219-Y278 AromaticContact CZ-CZ 3.48Å; F219-Y278 VanDerWaalsContact CZ-CZ 3.48Å; F219-Y278 WeakPolarHBondContact CZ-OH 3.5Å; N223-Y278 HydrophobicContact CB-CE2 3.95Å; N223-Y278 PolarHBondContact OD1-OH 2.69Å; L227-Y278 HydrophobicContact CD1-CE1 3.95Å; L227-Y278 VanDerWaalsContact CD1-OH 3.3Å; L227-Y278 WeakPolarHBondContact CD1-OH 3.4Å; M235-Y278 HydrophobicContact CE-CD1 4.21Å; M235-Y278 HydrophobicContact CE-CE1 3.64Å; M235-Y278 HydrophobicContact CG-CE1 4.26Å; M235-Y278 HydrophobicContact SD-CD1 4.19Å; M235-Y278 HydrophobicContact SD-CE1 3.99Å; M239-Y278 HydrophobicContact CE-CD1 3.31Å; M239-Y278 HydrophobicContact CE-CD2 4.16Å; M239-Y278 HydrophobicContact CE-CE1 3.24Å; M239-Y278 HydrophobicContact CE-CE2 4.15Å; M239-Y278 HydrophobicContact CE-CG 3.78Å; N274-Y278 WeakPolarHBondContact O-CD2 3.31Å; N274-Y278 PolarHBondContact O-N 3.43Å; N274-Y278 VanDerWaalsContact O-N 3.1Å; A275-Y278 PolarHBondContact O-N 3.19Å; A276-Y278 PolarHBondContact O-N 2.74Å; Y278-Q280 PolarHBondContact O-N 2.96Å; Y278-Y282 HydrophobicContact CD1-CD2 4.27Å; Y278-Y282 AromaticContact CD2-CD2 3.91Å; Y278-Y282 HydrophobicContact CD2-CD2 3.91Å; Y278-Y282 HydrophobicContact CD2-CE2 4.44Å; Y278-Y282 HydrophobicContact CE1-CD2 4.42Å; Y278-Y282 HydrophobicContact CE2-CD2 4.04Å; Y278-Y282 HydrophobicContact CE2-CE2 4.37Å; Y278-Y282 HydrophobicContact CG-CD2 4.03Å; Y278-Y282 CarbonylContact O-C 3.53Å; Y278-Y282 WeakPolarHBondContact O-CA 3.49Å; Y278-Y282 PolarHBondContact O-N 3.18Å; Y278-D283 PolarHBondContact O-N 3.25Å; Y278-F286 HydrophobicContact CD1-CB 4.3Å; Y278-F286 HydrophobicContact CD1-CD2 4.15Å; Y278-F286 HydrophobicContact CD1-CG 4.37Å
279A92.1Very high93.9Very high0 Ų037.2 Ų37.20%018%0.183CC..Hα-helixtrans-58.4-34.6173.100000111.7A275 A276 F286 L290 F320 V324 R327A275-A279 VanDerWaalsContact O-CB 3.28Å; A275-A279 WeakPolarHBondContact O-CB 3.34Å; A275-A279 PolarHBondContact O-N 3.06Å; A276-A279 PolarHBondContact O-N 2.99Å; A279-F286 HydrophobicContact CB-CD1 4.13Å; A279-F286 HydrophobicContact CB-CE1 4.15Å; A279-L290 HydrophobicContact CB-CD1 3.83Å; A279-F320 HydrophobicContact CB-CE2 4.12Å; A279-V324 HydrophobicContact CB-CG2 4.21Å; A279-R327 PolarHBondContact O-NE 3.39Å; A279-R327 VanDerWaalsContact O-NE 3.15Å; A279-R327 PolarHBondContact O-NH1 3.32Å; A279-R327 PolarHBondContact O-NH2 2.93Å
280Q90.8Very high93.8Very high91 Ų9137.1 Ų37.143%0.42518%0.182SC..Hα-helixtrans-79.6-45.4-177.3-75.1172.821.500113.7A276 L277 Y278 S323 R327A276-Q280 WeakPolarHBondContact O-CB 3.45Å; A276-Q280 WeakPolarHBondContact O-CG 3.47Å; A276-Q280 PolarHBondContact O-N 2.81Å; L277-Q280 PolarHBondContact O-N 3.02Å; Y278-Q280 PolarHBondContact O-N 2.96Å; Q280-S323 VanDerWaalsContact NE2-CB 3.31Å; Q280-R327 VanDerWaalsContact C-NH2 3.33Å; Q280-R327 PolarHBondContact O-NH2 2.87Å
281K92.3Very high93.6Very high94 Ų9439.1 Ų39.141%0.40920%0.196SC..Hα-helixtrans-106-29-169.8-62.9-169.4-176.1176.50114.5F224 L277F224-K281 PolarHBondContact O-NZ 3.39Å; L277-K281 HydrophobicContact CD1-CD 3.63Å; L277-K281 HydrophobicContact CD1-CG 4.16Å; L277-K281 PolarHBondContact O-N 3.03Å
282Y94Very high93.4Very high11 Ų1142.3 Ų42.34%0.04321%0.208CC..  trans-128.245.4-168.2-45.6-50.6000110.6N223 D226 L227 L277 Y278 E284 F286N223-Y282 VanDerWaalsContact O-CE2 3.27Å; N223-Y282 WeakPolarHBondContact O-CE2 3.44Å; N223-Y282 PolarHBondContact O-OH 3.21Å; D226-Y282 VanDerWaalsContact C-CZ 3.44Å; D226-Y282 WeakPolarHBondContact CA-OH 3.34Å; D226-Y282 PolarHBondContact N-OH 2.95Å; D226-Y282 PolarHBondContact O-OH 2.86Å; L227-Y282 HydrophobicContact CB-CD1 3.53Å; L227-Y282 HydrophobicContact CB-CD2 4.21Å; L227-Y282 HydrophobicContact CB-CE1 3.64Å; L227-Y282 HydrophobicContact CB-CE2 4.32Å; L227-Y282 HydrophobicContact CB-CG 3.86Å; L227-Y282 HydrophobicContact CD1-CD2 4.4Å; L227-Y282 HydrophobicContact CD2-CD1 4.49Å; L227-Y282 HydrophobicContact CD2-CG 4.3Å; L227-Y282 HydrophobicContact CG-CG 4.46Å; L227-Y282 VanDerWaalsContact N-CE1 3.27Å; L277-Y282 HydrophobicContact CG-CE2 4.32Å; Y278-Y282 HydrophobicContact CD1-CD2 4.27Å; Y278-Y282 AromaticContact CD2-CD2 3.91Å; Y278-Y282 HydrophobicContact CD2-CD2 3.91Å; Y278-Y282 HydrophobicContact CD2-CE2 4.44Å; Y278-Y282 HydrophobicContact CE1-CD2 4.42Å; Y278-Y282 HydrophobicContact CE2-CD2 4.04Å; Y278-Y282 HydrophobicContact CE2-CE2 4.37Å; Y278-Y282 HydrophobicContact CG-CD2 4.03Å; Y278-Y282 CarbonylContact O-C 3.53Å; Y278-Y282 WeakPolarHBondContact O-CA 3.49Å; Y278-Y282 PolarHBondContact O-N 3.18Å; Y282-E284 VanDerWaalsContact C-N 3.33Å; Y282-E284 PolarHBondContact O-N 2.81Å; Y282-F286 WeakPolarHBondContact O-CB 3.37Å; Y282-F286 PolarHBondContact O-N 3.06Å
283D90.1Very high93.4Very high32 Ų3242.3 Ų42.317%0.17121%0.209CC..Hα-helixtrans-65.9-36.2-170.1-171.833.4000112.6Y278 E285 F286 Q287 R327 Y330Y278-D283 PolarHBondContact O-N 3.25Å; D283-E285 VanDerWaalsContact C-N 3.34Å; D283-E285 PolarHBondContact O-N 3.17Å; D283-F286 PolarHBondContact O-N 2.68Å; D283-Q287 WeakPolarHBondContact O-CB 3.48Å; D283-Q287 PolarHBondContact O-N 2.68Å; D283-R327 IonicContact OD1-NH1 2.75Å; D283-R327 IonicContact OD2-CZ 2.69Å; D283-R327 IonicContact OD2-NH1 2.74Å; D283-R327 PolarHBondContact OD2-NH1 2.91Å; D283-Y330 WeakPolarHBondContact OD1-CE2 3.43Å; D283-Y330 VanDerWaalsContact OD1-CZ 3.23Å; D283-Y330 PolarHBondContact OD1-OH 3.22Å
284E91.4Very high93.4Very high168 Ų16841.1 Ų41.179%0.78520%0.203SC*.Hα-helixtrans-61.3-45.3-178.1-62-172.1-178.400110.7Y282Y282-E284 VanDerWaalsContact C-N 3.33Å; Y282-E284 PolarHBondContact O-N 2.81Å
285E94.2Very high93.2Very high67 Ų6745 Ų4531%0.31323%0.227SC..Hα-helixtrans-79.2-33.5-179.9-55.678-170.800111.9L227 E232 M235 D283 P288L227-E285 HydrophobicContact CD2-CB 4.22Å; L227-E285 HydrophobicContact CD2-CG 3.86Å; E232-E285 HydrophobicContact CG-CG 4.37Å; M235-E285 HydrophobicContact CE-CB 3.5Å; M235-E285 HydrophobicContact CE-CG 4.41Å; M235-E285 HydrophobicContact SD-CB 4.08Å; D283-E285 VanDerWaalsContact C-N 3.34Å; D283-E285 PolarHBondContact O-N 3.17Å; E285-P288 VanDerWaalsContact O-CD 3.27Å; E285-P288 WeakPolarHBondContact O-CD 3.46Å
286F94.8Very high93.1Very high0 Ų045.5 Ų45.50%023%0.23CC..Hα-helixtrans-81.7-18.1-177.6-170.8-126.6000114.1M239 A275 Y278 A279 Y282 D283 P288 Y289 L290 F293 F320M239-F286 HydrophobicContact CE-CD2 4.39Å; M239-F286 HydrophobicContact CE-CE2 4.35Å; M239-F286 HydrophobicContact CG-CD2 4.29Å; M239-F286 HydrophobicContact CG-CE2 4.06Å; M239-F286 HydrophobicContact SD-CD2 4.08Å; M239-F286 HydrophobicContact SD-CE2 3.56Å; M239-F286 VanDerWaalsContact SD-CE2 3.56Å; A275-F286 HydrophobicContact CB-CZ 4.23Å; Y278-F286 HydrophobicContact CD1-CB 4.3Å; Y278-F286 HydrophobicContact CD1-CD2 4.15Å; Y278-F286 HydrophobicContact CD1-CG 4.37Å; A279-F286 HydrophobicContact CB-CD1 4.13Å; A279-F286 HydrophobicContact CB-CE1 4.15Å; Y282-F286 WeakPolarHBondContact O-CB 3.37Å; Y282-F286 PolarHBondContact O-N 3.06Å; D283-F286 PolarHBondContact O-N 2.68Å; F286-P288 VanDerWaalsContact C-N 3.33Å; F286-P288 VanDerWaalsContact O-N 3.13Å; F286-Y289 HydrophobicContact CD2-CD2 4.05Å; F286-Y289 PolarHBondContact O-N 3.48Å; F286-L290 HydrophobicContact CD1-CB 4.29Å; F286-L290 HydrophobicContact CD1-CD1 3.7Å; F286-L290 HydrophobicContact CE1-CB 4.3Å; F286-L290 HydrophobicContact CE1-CD1 3.35Å; F286-L290 HydrophobicContact CE1-CG 4.44Å; F286-L290 HydrophobicContact CZ-CD1 4.39Å; F286-L290 PolarHBondContact O-N 3.21Å; F286-L290 VanDerWaalsContact O-N 3.14Å; F286-F293 AromaticContact CE2-CD2 3.99Å; F286-F293 HydrophobicContact CE2-CD2 3.99Å; F286-F293 AromaticContact CE2-CE2 3.94Å; F286-F293 HydrophobicContact CE2-CE2 3.94Å; F286-F293 AromaticContact CZ-CD2 3.64Å; F286-F293 HydrophobicContact CZ-CD2 3.64Å; F286-F293 AromaticContact CZ-CE2 3.99Å; F286-F293 HydrophobicContact CZ-CE2 3.99Å; F286-F293 HydrophobicContact CZ-CG 4.14Å; F286-F320 HydrophobicContact CE1-CE2 4.49Å
287Q92.6Very high93.2Very high109 Ų10945.2 Ų45.251%0.50923%0.228SC..THydrogen-bonded Turntrans-45.3-44.1-177.5-172.8-172.12100114.7D283 Y289 L290 P291 Y330D283-Q287 WeakPolarHBondContact O-CB 3.48Å; D283-Q287 PolarHBondContact O-N 2.68Å; Q287-Y289 PolarHBondContact O-N 3.13Å; Q287-L290 PolarHBondContact O-N 3.29Å; Q287-P291 WeakPolarHBondContact O-CD 3.48Å; Q287-Y330 HydrophobicContact CG-CE1 4.27Å; Q287-Y330 WeakPolarHBondContact CG-OH 3.5Å
288P94.1Very high93Very high96 Ų9647.4 Ų47.462%0.62324%0.236SC*.THydrogen-bonded Turntrans-63.4-25.2-178.9-2235.1000113.7E285 F286E285-P288 VanDerWaalsContact O-CD 3.27Å; E285-P288 WeakPolarHBondContact O-CD 3.46Å; F286-P288 VanDerWaalsContact C-N 3.33Å; F286-P288 VanDerWaalsContact O-N 3.13Å
289Y94.9Very high92.8Very high43 Ų4351.7 Ų51.717%0.16926%0.259CS..THydrogen-bonded Turntrans-98.7-21.3-176.3-50.5-63.6000112.7M235 E236 M239 F286 Q287 R292 F293M235-Y289 HydrophobicContact CB-CE2 4.48Å; M235-Y289 HydrophobicContact CG-CD2 4.37Å; M235-Y289 HydrophobicContact CG-CE2 3.82Å; M235-Y289 HydrophobicContact SD-CD2 4.14Å; M235-Y289 HydrophobicContact SD-CE2 3.8Å; E236-Y289 VanDerWaalsContact CA-OH 3.28Å; E236-Y289 WeakPolarHBondContact CA-OH 3.48Å; E236-Y289 WeakPolarHBondContact CB-OH 3.3Å; E236-Y289 PolarHBondContact N-OH 3.17Å; M239-Y289 HydrophobicContact CB-CD1 4.25Å; M239-Y289 HydrophobicContact CB-CD2 4.2Å; M239-Y289 HydrophobicContact CB-CG 4Å; M239-Y289 HydrophobicContact CG-CD2 4.03Å; M239-Y289 HydrophobicContact CG-CE2 4.39Å; M239-Y289 HydrophobicContact CG-CG 4.29Å; F286-Y289 HydrophobicContact CD2-CD2 4.05Å; F286-Y289 PolarHBondContact O-N 3.48Å; Q287-Y289 PolarHBondContact O-N 3.13Å; Y289-R292 VanDerWaalsContact CD1-CZ 3.46Å; Y289-R292 WeakPolarHBondContact O-CG 3.5Å; Y289-R292 PolarHBondContact O-N 3.44Å; Y289-F293 WeakPolarHBondContact O-CD2 3.44Å; Y289-F293 PolarHBondContact O-N 2.89Å
290L92.7Very high92.9Very high0 Ų052.5 Ų52.50%026%0.263CS..Hα-helixtrans-56.2-45.3-172.7-17178.1000114.1A279 F286 Q287 R292 F293 V294 F320 V324 Y330A279-L290 HydrophobicContact CB-CD1 3.83Å; F286-L290 HydrophobicContact CD1-CB 4.29Å; F286-L290 HydrophobicContact CD1-CD1 3.7Å; F286-L290 HydrophobicContact CE1-CB 4.3Å; F286-L290 HydrophobicContact CE1-CD1 3.35Å; F286-L290 HydrophobicContact CE1-CG 4.44Å; F286-L290 HydrophobicContact CZ-CD1 4.39Å; F286-L290 PolarHBondContact O-N 3.21Å; F286-L290 VanDerWaalsContact O-N 3.14Å; Q287-L290 PolarHBondContact O-N 3.29Å; L290-R292 VanDerWaalsContact C-N 3.32Å; L290-R292 PolarHBondContact O-N 2.73Å; L290-F293 PolarHBondContact O-N 2.98Å; L290-F293 VanDerWaalsContact O-N 3.07Å; L290-V294 HydrophobicContact CG-CG2 4.24Å; L290-V294 WeakPolarHBondContact O-CG2 3.47Å; L290-V294 PolarHBondContact O-N 3.48Å; L290-F320 HydrophobicContact CD1-CE2 3.9Å; L290-F320 HydrophobicContact CD1-CZ 3.69Å; L290-V324 HydrophobicContact CD1-CG2 3.95Å; L290-V324 HydrophobicContact CD2-CG1 3.87Å; L290-V324 HydrophobicContact CD2-CG2 4.39Å; L290-Y330 HydrophobicContact CD2-CD1 3.61Å; L290-Y330 HydrophobicContact CD2-CD2 3.54Å; L290-Y330 HydrophobicContact CD2-CE1 3.32Å; L290-Y330 HydrophobicContact CD2-CE2 3.25Å; L290-Y330 HydrophobicContact CD2-CG 3.72Å
291P92.1Very high92.9Very high56 Ų5648.5 Ų48.536%0.36425%0.245SC..Hα-helixtrans-59.4-38.2-176-26.336.1000113.9Q287 V294 T295Q287-P291 WeakPolarHBondContact O-CD 3.48Å; P291-V294 PolarHBondContact O-N 3.44Å; P291-T295 PolarHBondContact O-N 3.02Å; P291-T295 PolarHBondContact O-OG1 2.73Å
292R93.9Very high92.7Very high68 Ų6847.1 Ų47.126%0.25724%0.244SC..Hα-helixtrans-67-37.6177.158.9167.6-175.4-170.72.4112M239 T240 Y289 L290 T295 A296M239-R292 PolarHBondContact O-NH2 3.23Å; T240-R292 PolarHBondContact OG1-NH1 2.88Å; Y289-R292 VanDerWaalsContact CD1-CZ 3.46Å; Y289-R292 WeakPolarHBondContact O-CG 3.5Å; Y289-R292 PolarHBondContact O-N 3.44Å; L290-R292 VanDerWaalsContact C-N 3.32Å; L290-R292 PolarHBondContact O-N 2.73Å; R292-T295 PolarHBondContact O-N 3.27Å; R292-A296 WeakPolarHBondContact O-CB 3.37Å; R292-A296 PolarHBondContact O-N 3.03Å
293F95.7Very high92.5Very high1 Ų151.1 Ų51.10%0.00427%0.274CS..Hα-helixtrans-67-41.7174.8-82.6-84.1000111.6M239 F242 H243 L246 I271 A275 F286 Y289 L290 T295 A296 I297 F320M239-F293 HydrophobicContact CB-CE2 4.23Å; M239-F293 WeakPolarHBondContact O-CZ 3.48Å; M239-F293 HydrophobicContact SD-CE2 4.38Å; M239-F293 HydrophobicContact SD-CZ 4.4Å; F242-F293 HydrophobicContact CB-CE1 4.4Å; F242-F293 HydrophobicContact CB-CZ 4.09Å; H243-F293 HydrophobicContact CB-CE1 4.42Å; H243-F293 HydrophobicContact CB-CE2 4.33Å; H243-F293 HydrophobicContact CB-CZ 4.01Å; L246-F293 HydrophobicContact CD2-CD1 3.9Å; L246-F293 HydrophobicContact CD2-CE1 4.2Å; I271-F293 HydrophobicContact CG2-CE1 4.14Å; A275-F293 HydrophobicContact CB-CD1 3.99Å; A275-F293 HydrophobicContact CB-CE1 4.27Å; A275-F293 HydrophobicContact CB-CG 4.46Å; F286-F293 AromaticContact CE2-CD2 3.99Å; F286-F293 HydrophobicContact CE2-CD2 3.99Å; F286-F293 AromaticContact CE2-CE2 3.94Å; F286-F293 HydrophobicContact CE2-CE2 3.94Å; F286-F293 AromaticContact CZ-CD2 3.64Å; F286-F293 HydrophobicContact CZ-CD2 3.64Å; F286-F293 AromaticContact CZ-CE2 3.99Å; F286-F293 HydrophobicContact CZ-CE2 3.99Å; F286-F293 HydrophobicContact CZ-CG 4.14Å; Y289-F293 WeakPolarHBondContact O-CD2 3.44Å; Y289-F293 PolarHBondContact O-N 2.89Å; L290-F293 PolarHBondContact O-N 2.98Å; L290-F293 VanDerWaalsContact O-N 3.07Å; F293-T295 VanDerWaalsContact C-N 3.35Å; F293-T295 PolarHBondContact O-N 3.39Å; F293-A296 PolarHBondContact O-N 3.34Å; F293-I297 VanDerWaalsContact O-CB 3.31Å; F293-I297 WeakPolarHBondContact O-CB 3.14Å; F293-I297 VanDerWaalsContact O-CG1 3.29Å; F293-I297 WeakPolarHBondContact O-CG1 3.4Å; F293-I297 PolarHBondContact O-N 3.49Å; F293-F320 HydrophobicContact CB-CE1 4.49Å; F293-F320 HydrophobicContact CB-CZ 3.94Å
294V92.6Very high92.5Very high14 Ų1450.8 Ų50.89%0.08527%0.273CS..Hα-helixtrans-57.5-47.5174.6173.70000110.9L290 P291 W298 F320 L321 V324 L333L290-V294 HydrophobicContact CG-CG2 4.24Å; L290-V294 WeakPolarHBondContact O-CG2 3.47Å; L290-V294 PolarHBondContact O-N 3.48Å; P291-V294 PolarHBondContact O-N 3.44Å; V294-W298 WeakPolarHBondContact O-CB 3.34Å; V294-W298 PolarHBondContact O-N 3.05Å; V294-F320 HydrophobicContact CG2-CE1 3.82Å; V294-F320 HydrophobicContact CG2-CZ 4.04Å; V294-L321 HydrophobicContact CG1-CD2 4.16Å; V294-V324 HydrophobicContact CG2-CG1 4.22Å; V294-L333 HydrophobicContact CG2-CD1 4.18Å
295T91.4Very high92.2Very high83 Ų8344.1 Ų44.151%0.50925%0.249SC..Hα-helixtrans-65.8-41.4177.8-58.30000112.8P291 R292 F293 W298 N299P291-T295 PolarHBondContact O-N 3.02Å; P291-T295 PolarHBondContact O-OG1 2.73Å; R292-T295 PolarHBondContact O-N 3.27Å; F293-T295 VanDerWaalsContact C-N 3.35Å; F293-T295 PolarHBondContact O-N 3.39Å; T295-W298 WeakPolarHBondContact O-CB 3.38Å; T295-N299 PolarHBondContact O-N 3.4Å; T295-N299 PolarHBondContact O-ND2 3.26Å
296A94.3Very high91.8Very high11 Ų1144.4 Ų44.49%0.09125%0.25CC..Hα-helixtrans-65.6-46.8179.600000112.1L246 T247 R292 F293 W298 N299 L300L246-A296 HydrophobicContact CD2-CB 3.99Å; T247-A296 HydrophobicContact CG2-CB 3.86Å; R292-A296 WeakPolarHBondContact O-CB 3.37Å; R292-A296 PolarHBondContact O-N 3.03Å; F293-A296 PolarHBondContact O-N 3.34Å; A296-W298 VanDerWaalsContact C-N 3.32Å; A296-N299 PolarHBondContact O-N 3.45Å; A296-L300 WeakPolarHBondContact O-CB 3.45Å; A296-L300 PolarHBondContact O-N 3.32Å
297I94.3Very high91.5Very high0 Ų047.6 Ų47.60%027%0.265CS..Hα-helixtrans-67-37.2179.3-68.8174.8000110.7L246 F293 L300 L301 A317 F320 L321L246-I297 HydrophobicContact CD2-CD1 4.32Å; L246-I297 HydrophobicContact CD2-CG1 3.74Å; F293-I297 VanDerWaalsContact O-CB 3.31Å; F293-I297 WeakPolarHBondContact O-CB 3.14Å; F293-I297 VanDerWaalsContact O-CG1 3.29Å; F293-I297 WeakPolarHBondContact O-CG1 3.4Å; F293-I297 PolarHBondContact O-N 3.49Å; I297-L300 WeakPolarHBondContact O-CB 3.4Å; I297-L300 PolarHBondContact O-N 3.09Å; I297-L301 HydrophobicContact CG2-CD1 4.13Å; I297-L301 WeakPolarHBondContact O-CG 3.46Å; I297-L301 PolarHBondContact O-N 3.13Å; I297-A317 HydrophobicContact CG2-CB 3.69Å; I297-A317 WeakPolarHBondContact CG2-O 3.5Å; I297-F320 HydrophobicContact CB-CD1 4.28Å; I297-F320 HydrophobicContact CD1-CB 4.17Å; I297-F320 HydrophobicContact CD1-CD1 3.25Å; I297-F320 HydrophobicContact CD1-CD2 4.19Å; I297-F320 HydrophobicContact CD1-CE1 3.56Å; I297-F320 HydrophobicContact CD1-CE2 4.44Å; I297-F320 HydrophobicContact CD1-CG 3.59Å; I297-F320 HydrophobicContact CD1-CZ 4.15Å; I297-F320 HydrophobicContact CG1-CD1 4.3Å; I297-F320 HydrophobicContact CG2-CD1 4.13Å; I297-L321 HydrophobicContact CG2-CD2 4.48Å; I297-L321 HydrophobicContact CG2-CG 4.21Å
298W90.3Very high91.1Very high51 Ų5145.2 Ų45.219%0.19326%0.258CS..Hα-helixtrans-56.9-53.4172173.9-100000112.5V294 T295 A296 L300 L301 V302 L321 S342 I343 V347V294-W298 WeakPolarHBondContact O-CB 3.34Å; V294-W298 PolarHBondContact O-N 3.05Å; T295-W298 WeakPolarHBondContact O-CB 3.38Å; A296-W298 VanDerWaalsContact C-N 3.32Å; W298-L300 VanDerWaalsContact C-N 3.28Å; W298-L300 PolarHBondContact O-N 3.23Å; W298-L301 PolarHBondContact O-N 3.25Å; W298-V302 HydrophobicContact CZ2-CG2 4.2Å; W298-V302 WeakPolarHBondContact O-CG2 3.41Å; W298-V302 PolarHBondContact O-N 2.92Å; W298-V302 VanDerWaalsContact O-N 3.12Å; W298-L321 HydrophobicContact CE3-CD1 4.39Å; W298-S342 WeakPolarHBondContact CZ2-OG 3.28Å; W298-I343 HydrophobicContact CE3-CG1 4.02Å; W298-I343 VanDerWaalsContact CH2-CA 3.44Å; W298-I343 HydrophobicContact CH2-CB 3.99Å; W298-I343 HydrophobicContact CH2-CG1 3.39Å; W298-I343 HydrophobicContact CZ2-CG1 4.47Å; W298-I343 HydrophobicContact CZ3-CB 3.87Å; W298-I343 HydrophobicContact CZ3-CD1 4.34Å; W298-I343 HydrophobicContact CZ3-CG1 3.11Å; W298-I343 HydrophobicContact CZ3-CG2 4.35Å; W298-V347 HydrophobicContact CE3-CG2 4.2Å; W298-V347 HydrophobicContact CH2-CG2 3.95Å; W298-V347 HydrophobicContact CZ3-CB 4.47Å; W298-V347 HydrophobicContact CZ3-CG2 3.5Å; W298-V347 VanDerWaalsContact CZ3-CG2 3.5Å
299N90.7Very high90.8Very high91 Ų9141.5 Ų41.549%0.48723%0.232SC..Hα-helixtrans-62.6-38.8179-70.4-27.2000111.6T295 A296 V302 S303T295-N299 PolarHBondContact O-N 3.4Å; T295-N299 PolarHBondContact O-ND2 3.26Å; A296-N299 PolarHBondContact O-N 3.45Å; N299-V302 PolarHBondContact O-N 3.04Å; N299-S303 WeakPolarHBondContact O-CB 3.33Å; N299-S303 PolarHBondContact O-N 3.01Å; N299-S303 PolarHBondContact O-OG 3.22Å
300L93Very high90.6Very high16 Ų1641.3 Ų41.38%0.08423%0.231CC..Hα-helixtrans-56-52.4174.6-178.470000110.6L246 K268 A296 I297 W298 V302 S303 T304 L313L246-L300 HydrophobicContact CD1-CD2 4.16Å; K268-L300 HydrophobicContact CD-CD1 4.23Å; A296-L300 WeakPolarHBondContact O-CB 3.45Å; A296-L300 PolarHBondContact O-N 3.32Å; I297-L300 WeakPolarHBondContact O-CB 3.4Å; I297-L300 PolarHBondContact O-N 3.09Å; W298-L300 VanDerWaalsContact C-N 3.28Å; W298-L300 PolarHBondContact O-N 3.23Å; L300-V302 VanDerWaalsContact C-N 3.33Å; L300-V302 PolarHBondContact O-N 3.17Å; L300-S303 PolarHBondContact O-N 3.41Å; L300-S303 VanDerWaalsContact O-N 3.11Å; L300-S303 PolarHBondContact O-OG 2.68Å; L300-T304 WeakPolarHBondContact O-CB 3.19Å; L300-T304 PolarHBondContact O-N 2.57Å; L300-T304 PolarHBondContact O-OG1 3.08Å; L300-L313 HydrophobicContact CD1-CD2 4.31Å; L300-L313 HydrophobicContact CD2-CD1 3.93Å; L300-L313 HydrophobicContact CD2-CD2 4.25Å; L300-L313 HydrophobicContact CD2-CG 4.17Å
301L91.6Very high90.4Very high8 Ų842.5 Ų42.54%0.04224%0.238CC..Hα-helixtrans-61.1-38.1-179.3-72.4169.2000113.3I297 W298 S303 V314 A317 I318 L321 V347I297-L301 HydrophobicContact CG2-CD1 4.13Å; I297-L301 WeakPolarHBondContact O-CG 3.46Å; I297-L301 PolarHBondContact O-N 3.13Å; W298-L301 PolarHBondContact O-N 3.25Å; L301-S303 VanDerWaalsContact C-N 3.31Å; L301-V314 HydrophobicContact CD2-CB 4.35Å; L301-V314 HydrophobicContact CD2-CG1 3.87Å; L301-V314 HydrophobicContact CD2-CG2 4.44Å; L301-A317 HydrophobicContact CD1-CB 4.23Å; L301-A317 HydrophobicContact CD2-CB 3.68Å; L301-A317 HydrophobicContact CG-CB 3.96Å; L301-I318 HydrophobicContact CD1-CG1 4.03Å; L301-I318 HydrophobicContact CD2-CD1 4.38Å; L301-I318 HydrophobicContact CD2-CG1 3.73Å; L301-L321 HydrophobicContact CD1-CD1 3.46Å; L301-L321 VanDerWaalsContact CD1-CD1 3.46Å; L301-L321 HydrophobicContact CD1-CG 4.37Å; L301-V347 HydrophobicContact CB-CG1 4.34Å; L301-V347 HydrophobicContact CB-CG2 4.07Å; L301-V347 HydrophobicContact CD1-CG1 3.96Å
302V89Confident90.3Very high65 Ų6543.3 Ų43.339%0.39424%0.238SC..Hα-helixtrans-72.3-26.3177.8175.60000112.3W298 N299 L300 K346 V347W298-V302 HydrophobicContact CZ2-CG2 4.2Å; W298-V302 WeakPolarHBondContact O-CG2 3.41Å; W298-V302 PolarHBondContact O-N 2.92Å; W298-V302 VanDerWaalsContact O-N 3.12Å; N299-V302 PolarHBondContact O-N 3.04Å; L300-V302 VanDerWaalsContact C-N 3.33Å; L300-V302 PolarHBondContact O-N 3.17Å; V302-K346 HydrophobicContact CG1-CD 4.25Å; V302-K346 HydrophobicContact CG2-CB 4.31Å; V302-V347 HydrophobicContact CG2-CG2 4.35Å
303S88.6Confident90.2Very high95 Ų9540.3 Ų40.366%0.66423%0.227SC*.Hα-helixtrans-95.9-10.9-177.567.60000114.8N299 L300 L301N299-S303 WeakPolarHBondContact O-CB 3.33Å; N299-S303 PolarHBondContact O-N 3.01Å; N299-S303 PolarHBondContact O-OG 3.22Å; L300-S303 PolarHBondContact O-N 3.41Å; L300-S303 VanDerWaalsContact O-N 3.11Å; L300-S303 PolarHBondContact O-OG 2.68Å; L301-S303 VanDerWaalsContact C-N 3.31Å
304T89.9Confident90.1Very high25 Ų2540.3 Ų40.315%0.15323%0.228CC..  trans-89.9137.4-175.8-55.10000110.5L300 Y310 V314L300-T304 WeakPolarHBondContact O-CB 3.19Å; L300-T304 PolarHBondContact O-N 2.57Å; L300-T304 PolarHBondContact O-OG1 3.08Å; T304-Y310 VanDerWaalsContact CG2-CB 3.5Å; T304-Y310 HydrophobicContact CG2-CD1 3.91Å; T304-Y310 HydrophobicContact CG2-CD2 3.81Å; T304-Y310 HydrophobicContact CG2-CE2 4.48Å; T304-Y310 HydrophobicContact CG2-CG 3.48Å; T304-Y310 VanDerWaalsContact CG2-CG 3.48Å; T304-V314 HydrophobicContact CG2-CG2 3.67Å
305G86.6Confident90Very high27 Ų2739.8 Ų39.828%0.27822%0.224SC..  trans-79.5-173.7-178.800000114.4E307 R382G305-E307 WeakPolarHBondContact CA-OE2 3.37Å; G305-R382 PolarHBondContact O-NH1 2.87Å; G305-R382 PolarHBondContact O-NH2 3.49Å
306Q85.3Confident90Very high73 Ų7336.1 Ų36.134%0.34120%0.202SC..SBendtrans-93.3-0.7-174.7-68.8-63.2-25.700114.2P350 R355Q306-P350 PolarHBondContact NE2-O 3.48Å; Q306-P350 PolarHBondContact OE1-O 3.22Å; Q306-R355 PolarHBondContact O-NH1 2.98Å
307E87.2Confident90Very high67 Ų6735.6 Ų35.631%0.31320%0.197SC..  trans-63.9146.8-177.7-53.194.413100112.1G305 K309 Y310 R382G305-E307 WeakPolarHBondContact CA-OE2 3.37Å; E307-K309 VanDerWaalsContact C-N 3.25Å; E307-K309 HydrophobicContact CB-CG 3.97Å; E307-K309 PolarHBondContact O-N 3.13Å; E307-Y310 HydrophobicContact CB-CD2 4.04Å; E307-Y310 HydrophobicContact CB-CE2 4.27Å; E307-Y310 HydrophobicContact CG-CE2 4.49Å; E307-Y310 PolarHBondContact O-N 2.89Å; E307-Y310 VanDerWaalsContact O-N 3.11Å; E307-Y310 WeakPolarHBondContact OE2-CD2 3.34Å; E307-Y310 WeakPolarHBondContact OE2-CE2 3.33Å; E307-R382 PolarHBondContact O-NH2 2.72Å
308V85.2Confident89.9Confident59 Ų5935.6 Ų35.636%0.35820%0.197SC..G310 helixtrans-61.1-34.4-174.6175.20000111.8E258 Y310 D311 A357E258-V308 PolarHBondContact O-N 3.11Å; V308-Y310 PolarHBondContact O-N 3.27Å; V308-D311 VanDerWaalsContact O-CB 3.3Å; V308-D311 WeakPolarHBondContact O-CB 3.31Å; V308-D311 PolarHBondContact O-N 2.87Å; V308-A357 HydrophobicContact CG2-CB 3.56Å
309K87.6Confident89.9Confident19 Ų1936.7 Ų36.78%0.08321%0.205CC..G310 helixtrans-54.3-24.2176.363.7164.2157.8-145.30114.9T255 D257 E258 E259 E260 A261 E307T255-K309 HydrophobicContact CG2-CD 4.09Å; T255-K309 PolarHBondContact O-NZ 3.07Å; D257-K309 VanDerWaalsContact O-CD 3.23Å; D257-K309 WeakPolarHBondContact O-CD 3.47Å; D257-K309 WeakPolarHBondContact O-CE 3.39Å; D257-K309 PolarHBondContact O-NZ 3.42Å; E258-K309 PolarHBondContact O-N 3.32Å; E259-K309 WeakPolarHBondContact O-CA 3.31Å; E259-K309 PolarHBondContact O-N 3.06Å; E260-K309 WeakPolarHBondContact O-CB 3.36Å; A261-K309 VanDerWaalsContact CB-O 3.23Å; A261-K309 WeakPolarHBondContact CB-O 3.4Å; E307-K309 VanDerWaalsContact C-N 3.25Å; E307-K309 HydrophobicContact CB-CG 3.97Å; E307-K309 PolarHBondContact O-N 3.13Å
310Y90.8Very high90Very high38 Ų3832.4 Ų32.415%0.14918%0.181CC..G310 helixtrans-96.9-3.6-179.2-57.9-57.1000113.3E265 T304 E307 V308 L312 L313 V314E265-Y310 HydrophobicContact CG-CD1 3.58Å; E265-Y310 HydrophobicContact CG-CE1 3.6Å; T304-Y310 VanDerWaalsContact CG2-CB 3.5Å; T304-Y310 HydrophobicContact CG2-CD1 3.91Å; T304-Y310 HydrophobicContact CG2-CD2 3.81Å; T304-Y310 HydrophobicContact CG2-CE2 4.48Å; T304-Y310 HydrophobicContact CG2-CG 3.48Å; T304-Y310 VanDerWaalsContact CG2-CG 3.48Å; E307-Y310 HydrophobicContact CB-CD2 4.04Å; E307-Y310 HydrophobicContact CB-CE2 4.27Å; E307-Y310 HydrophobicContact CG-CE2 4.49Å; E307-Y310 PolarHBondContact O-N 2.89Å; E307-Y310 VanDerWaalsContact O-N 3.11Å; E307-Y310 WeakPolarHBondContact OE2-CD2 3.34Å; E307-Y310 WeakPolarHBondContact OE2-CE2 3.33Å; V308-Y310 PolarHBondContact O-N 3.27Å; Y310-L312 PolarHBondContact O-N 3.41Å; Y310-L313 PolarHBondContact O-N 3.35Å; Y310-V314 WeakPolarHBondContact O-CB 3.48Å; Y310-V314 WeakPolarHBondContact O-CG2 3.24Å; Y310-V314 PolarHBondContact O-N 3.34Å
311D89.2Confident90Very high26 Ų2631.8 Ų31.814%0.13918%0.178CC..Hα-helixtrans-56.7-50.1-173.1-77.711.8000112.5V308 L313 V314 S315 R355 R382V308-D311 VanDerWaalsContact O-CB 3.3Å; V308-D311 WeakPolarHBondContact O-CB 3.31Å; V308-D311 PolarHBondContact O-N 2.87Å; D311-L313 VanDerWaalsContact C-N 3.32Å; D311-L313 PolarHBondContact O-N 3.36Å; D311-V314 PolarHBondContact O-N 2.99Å; D311-S315 VanDerWaalsContact O-CB 3.29Å; D311-S315 WeakPolarHBondContact O-CB 3.49Å; D311-S315 PolarHBondContact O-N 3.45Å; D311-S315 PolarHBondContact O-OG 3.17Å; D311-R355 VanDerWaalsContact CG-NH1 3.34Å; D311-R355 IonicContact OD1-CZ 2.74Å; D311-R355 IonicContact OD1-NH1 3.51Å; D311-R355 PolarHBondContact OD1-NH1 3.26Å; D311-R355 IonicContact OD1-NH2 3.76Å; D311-R355 IonicContact OD2-CZ 3.58Å; D311-R355 IonicContact OD2-NH1 2.78Å; D311-R355 PolarHBondContact OD2-NH1 3.47Å; D311-R355 VanDerWaalsContact OD2-NH1 3.16Å; D311-R355 IonicContact OD2-NH2 4Å; D311-R355 PolarHBondContact OD2-NH2 2.88Å; D311-R382 HydrophobicContact CB-CG 4.37Å; D311-R382 IonicContact OD1-CZ 2.68Å; D311-R382 IonicContact OD1-NE 2.85Å; D311-R382 PolarHBondContact OD1-NE 2.93Å; D311-R382 IonicContact OD1-NH2 2.59Å; D311-R382 PolarHBondContact OD1-NH2 2.87Å
312L88.6Confident89.9Confident72 Ų7231.7 Ų31.738%0.37718%0.179SC..Hα-helixtrans-58.5-45.3179.1-17566.3000111.6L266 S269 Y310 N316L266-L312 HydrophobicContact CD2-CD2 4.09Å; S269-L312 WeakPolarHBondContact OG-CG 3.15Å; S269-L312 PolarHBondContact OG-O 3.36Å; Y310-L312 PolarHBondContact O-N 3.41Å; L312-N316 VanDerWaalsContact O-CG 3.29Å; L312-N316 PolarHBondContact O-N 3.32Å; L312-N316 PolarHBondContact O-OD1 3.43Å
313L92.6Very high89.9Confident5 Ų529.3 Ų29.33%0.02617%0.165CC..Hα-helixtrans-62.8-49179.517660.2000111.7E265 K268 S269 L300 Y310 D311 A317E265-L313 HydrophobicContact CB-CD2 4.42Å; E265-L313 HydrophobicContact CG-CD2 4.42Å; K268-L313 HydrophobicContact CB-CD1 3.51Å; K268-L313 HydrophobicContact CB-CD2 4.3Å; K268-L313 HydrophobicContact CD-CD2 4.49Å; S269-L313 VanDerWaalsContact N-CD1 3.33Å; S269-L313 WeakPolarHBondContact OG-CA 3.15Å; L300-L313 HydrophobicContact CD1-CD2 4.31Å; L300-L313 HydrophobicContact CD2-CD1 3.93Å; L300-L313 HydrophobicContact CD2-CD2 4.25Å; L300-L313 HydrophobicContact CD2-CG 4.17Å; Y310-L313 PolarHBondContact O-N 3.35Å; D311-L313 VanDerWaalsContact C-N 3.32Å; D311-L313 PolarHBondContact O-N 3.36Å; L313-A317 WeakPolarHBondContact O-CB 3.18Å; L313-A317 PolarHBondContact O-N 3.11Å
314V92.4Very high90Very high2 Ų224.8 Ų24.81%0.01213%0.134CC..Hα-helixtrans-65.5-42.9-178.3170.60000110.5L301 T304 Y310 D311 A317 I318 R382L301-V314 HydrophobicContact CD2-CB 4.35Å; L301-V314 HydrophobicContact CD2-CG1 3.87Å; L301-V314 HydrophobicContact CD2-CG2 4.44Å; T304-V314 HydrophobicContact CG2-CG2 3.67Å; Y310-V314 WeakPolarHBondContact O-CB 3.48Å; Y310-V314 WeakPolarHBondContact O-CG2 3.24Å; Y310-V314 PolarHBondContact O-N 3.34Å; D311-V314 PolarHBondContact O-N 2.99Å; V314-A317 PolarHBondContact O-N 3.09Å; V314-I318 HydrophobicContact CG1-CD1 3.68Å; V314-I318 HydrophobicContact CG1-CG1 4.31Å; V314-I318 WeakPolarHBondContact O-CB 3.32Å; V314-I318 VanDerWaalsContact O-CG1 3.26Å; V314-I318 WeakPolarHBondContact O-CG1 3.27Å; V314-I318 PolarHBondContact O-N 2.94Å; V314-R382 HydrophobicContact CB-CG 4.41Å; V314-R382 HydrophobicContact CG1-CG 4.11Å
315S90.8Very high89.9Confident2 Ų223.7 Ų23.71%0.01413%0.127CC..Hα-helixtrans-59.1-51.3176.6-66.30000111.6D311 A317 I318 Q319 D380 T381 R382D311-S315 VanDerWaalsContact O-CB 3.29Å; D311-S315 WeakPolarHBondContact O-CB 3.49Å; D311-S315 PolarHBondContact O-N 3.45Å; D311-S315 PolarHBondContact O-OG 3.17Å; S315-A317 VanDerWaalsContact C-N 3.34Å; S315-A317 PolarHBondContact O-N 2.89Å; S315-I318 PolarHBondContact O-N 2.98Å; S315-Q319 WeakPolarHBondContact O-CB 3.21Å; S315-Q319 PolarHBondContact O-N 3.12Å; S315-D380 WeakPolarHBondContact CB-O 3.27Å; S315-D380 PolarHBondContact OG-O 3.18Å; S315-T381 VanDerWaalsContact OG-C 3.25Å; S315-T381 PolarHBondContact OG-O 3.2Å; S315-R382 PolarHBondContact OG-N 3.35Å
316N91.6Very high89.9Confident7 Ų726.3 Ų26.34%0.03713%0.132CC..Hα-helixtrans-66.4-36.9-179.4-64.98.7000111.7S269 C272 D273 L312 Q319 F320S269-N316 PolarHBondContact OG-ND2 3.5Å; C272-N316 HydrophobicContact CB-CB 3.93Å; D273-N316 WeakPolarHBondContact OD1-CB 3.32Å; D273-N316 PolarHBondContact OD1-ND2 2.96Å; D273-N316 PolarHBondContact OD2-ND2 2.98Å; D273-N316 VanDerWaalsContact OD2-ND2 3.12Å; L312-N316 VanDerWaalsContact O-CG 3.29Å; L312-N316 PolarHBondContact O-N 3.32Å; L312-N316 PolarHBondContact O-OD1 3.43Å; N316-Q319 PolarHBondContact O-N 2.85Å; N316-F320 PolarHBondContact O-N 2.97Å
317A94.1Very high90Very high0 Ų025.6 Ų25.60%013%0.126CC..Hα-helixtrans-63.6-44.4174.500000112.6I297 L301 L313 V314 S315 F320 L321I297-A317 HydrophobicContact CG2-CB 3.69Å; I297-A317 WeakPolarHBondContact CG2-O 3.5Å; L301-A317 HydrophobicContact CD1-CB 4.23Å; L301-A317 HydrophobicContact CD2-CB 3.68Å; L301-A317 HydrophobicContact CG-CB 3.96Å; L313-A317 WeakPolarHBondContact O-CB 3.18Å; L313-A317 PolarHBondContact O-N 3.11Å; V314-A317 PolarHBondContact O-N 3.09Å; S315-A317 VanDerWaalsContact C-N 3.34Å; S315-A317 PolarHBondContact O-N 2.89Å; A317-F320 PolarHBondContact O-N 3.2Å; A317-L321 PolarHBondContact O-N 3.23Å
318I92.8Very high90Very high0 Ų026.5 Ų26.50%014%0.137CC..Hα-helixtrans-66.1-41.4175.4-69.5170.8000110.5L301 V314 S315 F320 L321 A322 V347 N351 A385 L389L301-I318 HydrophobicContact CD1-CG1 4.03Å; L301-I318 HydrophobicContact CD2-CD1 4.38Å; L301-I318 HydrophobicContact CD2-CG1 3.73Å; V314-I318 HydrophobicContact CG1-CD1 3.68Å; V314-I318 HydrophobicContact CG1-CG1 4.31Å; V314-I318 WeakPolarHBondContact O-CB 3.32Å; V314-I318 VanDerWaalsContact O-CG1 3.26Å; V314-I318 WeakPolarHBondContact O-CG1 3.27Å; V314-I318 PolarHBondContact O-N 2.94Å; S315-I318 PolarHBondContact O-N 2.98Å; I318-F320 VanDerWaalsContact C-N 3.32Å; I318-F320 PolarHBondContact O-N 3.33Å; I318-L321 PolarHBondContact O-N 3.26Å; I318-L321 VanDerWaalsContact O-N 3.11Å; I318-A322 PolarHBondContact O-N 3.1Å; I318-V347 HydrophobicContact CD1-CG1 4.28Å; I318-V347 HydrophobicContact CG1-CG1 4.06Å; I318-N351 HydrophobicContact CD1-CB 4.35Å; I318-A385 HydrophobicContact CB-CB 3.88Å; I318-A385 HydrophobicContact CD1-CB 4.39Å; I318-A385 HydrophobicContact CG2-CB 3.77Å; I318-A385 WeakPolarHBondContact CG2-O 3.27Å; I318-L389 HydrophobicContact CG2-CB 3.7Å; I318-L389 HydrophobicContact CG2-CD2 3.97Å; I318-L389 HydrophobicContact CG2-CG 4.41Å
319Q90Very high90Very high74 Ų7430.9 Ų30.935%0.34615%0.154SC..Hα-helixtrans-63.4-37.9179-167.2177.426.300112.2S315 N316 A322 S323S315-Q319 WeakPolarHBondContact O-CB 3.21Å; S315-Q319 PolarHBondContact O-N 3.12Å; N316-Q319 PolarHBondContact O-N 2.85Å; Q319-A322 PolarHBondContact O-N 3.35Å; Q319-S323 WeakPolarHBondContact O-CB 3.28Å; Q319-S323 PolarHBondContact O-N 2.59Å
320F92.7Very high90Very high0 Ų030.4 Ų30.40%015%0.151CC..Hα-helixtrans-55.6-53.5169169-94.9000110.8A275 A276 A279 F286 L290 F293 V294 I297 N316 A317 I318 A322 S323 V324A275-F320 HydrophobicContact CB-CD2 3.99Å; A275-F320 HydrophobicContact CB-CE2 3.88Å; A276-F320 HydrophobicContact CB-CB 4.26Å; A276-F320 HydrophobicContact CB-CD2 4.19Å; A279-F320 HydrophobicContact CB-CE2 4.12Å; F286-F320 HydrophobicContact CE1-CE2 4.49Å; L290-F320 HydrophobicContact CD1-CE2 3.9Å; L290-F320 HydrophobicContact CD1-CZ 3.69Å; F293-F320 HydrophobicContact CB-CE1 4.49Å; F293-F320 HydrophobicContact CB-CZ 3.94Å; V294-F320 HydrophobicContact CG2-CE1 3.82Å; V294-F320 HydrophobicContact CG2-CZ 4.04Å; I297-F320 HydrophobicContact CB-CD1 4.28Å; I297-F320 HydrophobicContact CD1-CB 4.17Å; I297-F320 HydrophobicContact CD1-CD1 3.25Å; I297-F320 HydrophobicContact CD1-CD2 4.19Å; I297-F320 HydrophobicContact CD1-CE1 3.56Å; I297-F320 HydrophobicContact CD1-CE2 4.44Å; I297-F320 HydrophobicContact CD1-CG 3.59Å; I297-F320 HydrophobicContact CD1-CZ 4.15Å; I297-F320 HydrophobicContact CG1-CD1 4.3Å; I297-F320 HydrophobicContact CG2-CD1 4.13Å; N316-F320 PolarHBondContact O-N 2.97Å; A317-F320 PolarHBondContact O-N 3.2Å; I318-F320 VanDerWaalsContact C-N 3.32Å; I318-F320 PolarHBondContact O-N 3.33Å; F320-A322 VanDerWaalsContact C-N 3.31Å; F320-A322 PolarHBondContact O-N 2.82Å; F320-S323 PolarHBondContact O-N 3.06Å; F320-S323 VanDerWaalsContact O-N 3.14Å; F320-S323 PolarHBondContact O-OG 2.95Å; F320-V324 HydrophobicContact CD2-CG2 4.38Å; F320-V324 HydrophobicContact CE1-CG2 4.12Å; F320-V324 HydrophobicContact CE2-CG2 3.96Å; F320-V324 HydrophobicContact CZ-CG2 3.82Å; F320-V324 WeakPolarHBondContact O-CG2 3.43Å; F320-V324 PolarHBondContact O-N 2.69Å; F320-V324 VanDerWaalsContact O-N 3.11Å
321L92.5Very high89.9Confident3 Ų331.8 Ų31.82%0.01616%0.158CC..Hα-helixtrans-59.8-40.9179.3-68.4-177.6000112.5V294 I297 W298 L301 A317 I318 S323 V324 C325 L389V294-L321 HydrophobicContact CG1-CD2 4.16Å; I297-L321 HydrophobicContact CG2-CD2 4.48Å; I297-L321 HydrophobicContact CG2-CG 4.21Å; W298-L321 HydrophobicContact CE3-CD1 4.39Å; L301-L321 HydrophobicContact CD1-CD1 3.46Å; L301-L321 VanDerWaalsContact CD1-CD1 3.46Å; L301-L321 HydrophobicContact CD1-CG 4.37Å; A317-L321 PolarHBondContact O-N 3.23Å; I318-L321 PolarHBondContact O-N 3.26Å; I318-L321 VanDerWaalsContact O-N 3.11Å; L321-S323 VanDerWaalsContact C-N 3.32Å; L321-S323 PolarHBondContact O-N 2.78Å; L321-V324 PolarHBondContact O-N 3.35Å; L321-C325 PolarHBondContact O-N 2.73Å; L321-C325 PolarHBondContact O-SG 3.41Å; L321-L389 HydrophobicContact CB-CD1 4.03Å
322A89.9Confident89.9Confident6 Ų636.2 Ų36.25%0.0518%0.178CC..Hα-helixtrans-59.9-43.4176.400000111.3I318 Q319 F320 V324 C325 E326 L389I318-A322 PolarHBondContact O-N 3.1Å; Q319-A322 PolarHBondContact O-N 3.35Å; F320-A322 VanDerWaalsContact C-N 3.31Å; F320-A322 PolarHBondContact O-N 2.82Å; A322-V324 VanDerWaalsContact C-N 3.3Å; A322-V324 PolarHBondContact O-N 2.79Å; A322-C325 PolarHBondContact O-SG 3.2Å; A322-E326 WeakPolarHBondContact O-CG 3.5Å; A322-E326 PolarHBondContact O-N 2.56Å; A322-L389 HydrophobicContact CB-CB 4.24Å; A322-L389 HydrophobicContact CB-CD1 4.23Å
323S88.9Confident89.8Confident16 Ų1635 Ų3511%0.11217%0.171CC..Hα-helixtrans-67.2-29.7178.775.80000113.8Q280 Q319 F320 L321Q280-S323 VanDerWaalsContact NE2-CB 3.31Å; Q319-S323 WeakPolarHBondContact O-CB 3.28Å; Q319-S323 PolarHBondContact O-N 2.59Å; F320-S323 PolarHBondContact O-N 3.06Å; F320-S323 VanDerWaalsContact O-N 3.14Å; F320-S323 PolarHBondContact O-OG 2.95Å; L321-S323 VanDerWaalsContact C-N 3.32Å; L321-S323 PolarHBondContact O-N 2.78Å
324V90.6Very high89.6Confident0 Ų035 Ų350%017%0.171CC..Hα-helixtrans-80.9-42179.2178.90000111.1A279 L290 V294 F320 L321 A322 E326 R327 Y330 F334A279-V324 HydrophobicContact CB-CG2 4.21Å; L290-V324 HydrophobicContact CD1-CG2 3.95Å; L290-V324 HydrophobicContact CD2-CG1 3.87Å; L290-V324 HydrophobicContact CD2-CG2 4.39Å; V294-V324 HydrophobicContact CG2-CG1 4.22Å; F320-V324 HydrophobicContact CD2-CG2 4.38Å; F320-V324 HydrophobicContact CE1-CG2 4.12Å; F320-V324 HydrophobicContact CE2-CG2 3.96Å; F320-V324 HydrophobicContact CZ-CG2 3.82Å; F320-V324 WeakPolarHBondContact O-CG2 3.43Å; F320-V324 PolarHBondContact O-N 2.69Å; F320-V324 VanDerWaalsContact O-N 3.11Å; L321-V324 PolarHBondContact O-N 3.35Å; A322-V324 VanDerWaalsContact C-N 3.3Å; A322-V324 PolarHBondContact O-N 2.79Å; V324-E326 PolarHBondContact O-N 3.24Å; V324-R327 WeakPolarHBondContact O-CB 3.21Å; V324-R327 PolarHBondContact O-N 3.06Å; V324-R327 VanDerWaalsContact O-N 3.14Å; V324-Y330 HydrophobicContact CG1-CD2 3.98Å; V324-Y330 HydrophobicContact CG1-CG 4.04Å; V324-F334 HydrophobicContact CB-CZ 4.44Å; V324-F334 HydrophobicContact CG1-CE2 3.98Å; V324-F334 HydrophobicContact CG1-CZ 4.19Å
325C88.8Confident89.3Confident1 Ų139.9 Ų39.91%0.00719%0.194CC..Hα-helixtrans-69-20.1-177.173.60000113.3L321 A322 R327 F334 L393 F396L321-C325 PolarHBondContact O-N 2.73Å; L321-C325 PolarHBondContact O-SG 3.41Å; A322-C325 PolarHBondContact O-SG 3.2Å; C325-R327 PolarHBondContact O-N 3.5Å; C325-F334 HydrophobicContact CB-CD1 4.42Å; C325-F334 HydrophobicContact CB-CD2 3.92Å; C325-F334 HydrophobicContact CB-CE1 4.22Å; C325-F334 HydrophobicContact CB-CE2 3.7Å; C325-F334 HydrophobicContact CB-CG 4.27Å; C325-F334 HydrophobicContact CB-CZ 3.86Å; C325-L393 HydrophobicContact CB-CD2 3.94Å; C325-F396 VanDerWaalsContact O-CD2 3.3Å; C325-F396 WeakPolarHBondContact O-CD2 3.3Å; C325-F396 WeakPolarHBondContact O-CE2 3.23Å
326E86.8Confident89.2Confident83 Ų8343.5 Ų43.539%0.38821%0.213SC..THydrogen-bonded Turntrans-74.1-5.7173.7-76.3-172.3-172.800114.9A322 V324 K395 F396A322-E326 WeakPolarHBondContact O-CG 3.5Å; A322-E326 PolarHBondContact O-N 2.56Å; V324-E326 PolarHBondContact O-N 3.24Å; E326-K395 HydrophobicContact CB-CD 4.14Å; E326-K395 HydrophobicContact CG-CD 4.13Å; E326-K395 PolarHBondContact O-NZ 2.96Å; E326-F396 VanDerWaalsContact C-CE2 3.47Å; E326-F396 WeakPolarHBondContact O-CE2 3.26Å
327R86.8Confident88.9Confident58 Ų5849.9 Ų49.922%0.21924%0.243CC..SBendtrans-97.7127.9-177.1-64.5-176.9173.6-109-13.9112.6A279 Q280 D283 V324 C325 H329 Y330 K331A279-R327 PolarHBondContact O-NE 3.39Å; A279-R327 VanDerWaalsContact O-NE 3.15Å; A279-R327 PolarHBondContact O-NH1 3.32Å; A279-R327 PolarHBondContact O-NH2 2.93Å; Q280-R327 VanDerWaalsContact C-NH2 3.33Å; Q280-R327 PolarHBondContact O-NH2 2.87Å; D283-R327 IonicContact OD1-NH1 2.75Å; D283-R327 IonicContact OD2-CZ 2.69Å; D283-R327 IonicContact OD2-NH1 2.74Å; D283-R327 PolarHBondContact OD2-NH1 2.91Å; V324-R327 WeakPolarHBondContact O-CB 3.21Å; V324-R327 PolarHBondContact O-N 3.06Å; V324-R327 VanDerWaalsContact O-N 3.14Å; C325-R327 PolarHBondContact O-N 3.5Å; R327-H329 VanDerWaalsContact C-N 3.35Å; R327-H329 PolarHBondContact O-N 3.39Å; R327-Y330 HydrophobicContact CB-CD2 3.78Å; R327-Y330 HydrophobicContact CG-CD2 4.34Å; R327-Y330 PolarHBondContact O-N 2.93Å; R327-K331 PolarHBondContact O-N 3.06Å
328P86.5Confident88.6Confident85 Ų8555.9 Ų55.955%0.55228%0.275SS*.G310 helixtrans-56.7-41.2-178.5-25.232000114.7Y330 K331 F396P328-Y330 VanDerWaalsContact C-N 3.3Å; P328-Y330 PolarHBondContact O-N 3.24Å; P328-K331 VanDerWaalsContact O-CB 3.22Å; P328-K331 WeakPolarHBondContact O-CB 3.35Å; P328-K331 PolarHBondContact O-N 3.04Å; P328-F396 HydrophobicContact CB-CZ 4.24Å; P328-F396 HydrophobicContact CG-CE1 4.31Å; P328-F396 HydrophobicContact CG-CZ 3.78Å
329H86.6Confident88.3Confident152 Ų15258.1 Ų58.170%0.70429%0.289SS*.G310 helixtrans-71.6-22.4-174.9-61.798.2000113.4R327 H332R327-H329 VanDerWaalsContact C-N 3.35Å; R327-H329 PolarHBondContact O-N 3.39Å; H329-H332 PolarHBondContact O-CE1 2.8Å; H329-H332 PolarHBondContact O-ND1 3.25Å
330Y88.1Confident88.1Confident8 Ų854.8 Ų54.83%0.03127%0.273CS..G310 helixtrans-95.93.9176.6-60.1-52.6000114D283 Q287 L290 V324 R327 P328 H332 L333D283-Y330 WeakPolarHBondContact OD1-CE2 3.43Å; D283-Y330 VanDerWaalsContact OD1-CZ 3.23Å; D283-Y330 PolarHBondContact OD1-OH 3.22Å; Q287-Y330 HydrophobicContact CG-CE1 4.27Å; Q287-Y330 WeakPolarHBondContact CG-OH 3.5Å; L290-Y330 HydrophobicContact CD2-CD1 3.61Å; L290-Y330 HydrophobicContact CD2-CD2 3.54Å; L290-Y330 HydrophobicContact CD2-CE1 3.32Å; L290-Y330 HydrophobicContact CD2-CE2 3.25Å; L290-Y330 HydrophobicContact CD2-CG 3.72Å; V324-Y330 HydrophobicContact CG1-CD2 3.98Å; V324-Y330 HydrophobicContact CG1-CG 4.04Å; R327-Y330 HydrophobicContact CB-CD2 3.78Å; R327-Y330 HydrophobicContact CG-CD2 4.34Å; R327-Y330 PolarHBondContact O-N 2.93Å; P328-Y330 VanDerWaalsContact C-N 3.3Å; P328-Y330 PolarHBondContact O-N 3.24Å; Y330-H332 PolarHBondContact O-N 2.79Å; Y330-H332 VanDerWaalsContact O-N 3.12Å; Y330-L333 HydrophobicContact CD1-CD1 4.11Å; Y330-L333 HydrophobicContact CG-CD1 4.4Å; Y330-L333 WeakPolarHBondContact O-CB 3.38Å; Y330-L333 PolarHBondContact O-N 3.41Å
331K87.9Confident88Confident67 Ų6756.5 Ų56.529%0.29128%0.284SS..G310 helixtrans-49.9-40.3177.3-173.9-170.6-179.6-1320112.6R327 P328 L333 F334 E335 F396 F397R327-K331 PolarHBondContact O-N 3.06Å; P328-K331 VanDerWaalsContact O-CB 3.22Å; P328-K331 WeakPolarHBondContact O-CB 3.35Å; P328-K331 PolarHBondContact O-N 3.04Å; K331-L333 PolarHBondContact O-N 2.85Å; K331-L333 VanDerWaalsContact O-N 3.14Å; K331-F334 CarbonylContact O-C 3.59Å; K331-F334 PolarHBondContact O-N 3.42Å; K331-E335 IonicContact NZ-OE1 2.68Å; K331-E335 PolarHBondContact NZ-OE1 3.25Å; K331-E335 PolarHBondContact O-N 3.44Å; K331-E335 VanDerWaalsContact O-N 3.14Å; K331-F396 HydrophobicContact CD-CB 4.42Å; K331-F396 HydrophobicContact CG-CB 4.4Å; K331-F397 HydrophobicContact CD-CE1 4.48Å; K331-F397 HydrophobicContact CD-CZ 4.32Å; K331-F397 HydrophobicContact CG-CE1 4Å; K331-F397 HydrophobicContact CG-CE2 4.15Å; K331-F397 HydrophobicContact CG-CZ 3.4Å
332H88.7Confident87.8Confident119 Ų11957.5 Ų57.555%0.55129%0.291SS*.G310 helixtrans-60.1-23.9-178.871.2-84.3000113.8H329 Y330 F334H329-H332 PolarHBondContact O-CE1 2.8Å; H329-H332 PolarHBondContact O-ND1 3.25Å; Y330-H332 PolarHBondContact O-N 2.79Å; Y330-H332 VanDerWaalsContact O-N 3.12Å; H332-F334 PolarHBondContact O-N 3.31Å
333L86.9Confident87.7Confident46 Ų4657.4 Ų57.424%0.24129%0.289CS..G310 helixtrans-70.6-18.9176-60.2179.3000112.7V294 Y330 K331V294-L333 HydrophobicContact CG2-CD1 4.18Å; Y330-L333 HydrophobicContact CD1-CD1 4.11Å; Y330-L333 HydrophobicContact CG-CD1 4.4Å; Y330-L333 WeakPolarHBondContact O-CB 3.38Å; Y330-L333 PolarHBondContact O-N 3.41Å; K331-L333 PolarHBondContact O-N 2.85Å; K331-L333 VanDerWaalsContact O-N 3.14Å
334F88.6Confident87.7Confident6 Ų656.6 Ų56.63%0.02628%0.284CS..SBendtrans-122.94.9-176.1-53.1-84.4000113V324 C325 K331 H332 L340 I343 L393 F397V324-F334 HydrophobicContact CB-CZ 4.44Å; V324-F334 HydrophobicContact CG1-CE2 3.98Å; V324-F334 HydrophobicContact CG1-CZ 4.19Å; C325-F334 HydrophobicContact CB-CD1 4.42Å; C325-F334 HydrophobicContact CB-CD2 3.92Å; C325-F334 HydrophobicContact CB-CE1 4.22Å; C325-F334 HydrophobicContact CB-CE2 3.7Å; C325-F334 HydrophobicContact CB-CG 4.27Å; C325-F334 HydrophobicContact CB-CZ 3.86Å; K331-F334 CarbonylContact O-C 3.59Å; K331-F334 PolarHBondContact O-N 3.42Å; H332-F334 PolarHBondContact O-N 3.31Å; F334-L340 HydrophobicContact CB-CD2 4.47Å; F334-L340 WeakPolarHBondContact O-CD1 3.49Å; F334-L340 VanDerWaalsContact O-CD2 3.28Å; F334-L340 WeakPolarHBondContact O-CD2 3.5Å; F334-L340 WeakPolarHBondContact O-CG 3.29Å; F334-I343 HydrophobicContact CD1-CD1 3.73Å; F334-I343 HydrophobicContact CE1-CD1 4.37Å; F334-L393 HydrophobicContact CB-CD2 4.46Å; F334-L393 HydrophobicContact CD1-CD2 4.27Å; F334-L393 HydrophobicContact CG-CD2 4.46Å; F334-F397 HydrophobicContact CB-CE2 3.81Å; F334-F397 HydrophobicContact CB-CZ 4.14Å
335E86.8Confident87.6Confident105 Ų10560.6 Ų60.649%0.49130%0.303SS..  trans-80.2-23.3-173.2-172.6160.7-128.900113.2K331 Q337 F397K331-E335 IonicContact NZ-OE1 2.68Å; K331-E335 PolarHBondContact NZ-OE1 3.25Å; K331-E335 PolarHBondContact O-N 3.44Å; K331-E335 VanDerWaalsContact O-N 3.14Å; E335-Q337 PolarHBondContact O-N 3.38Å; E335-F397 HydrophobicContact CB-CE1 4.13Å; E335-F397 HydrophobicContact CB-CZ 4.25Å; E335-F397 HydrophobicContact CG-CE1 4.23Å
336D88.1Confident87.6Confident78 Ų7866 Ų6642%0.41733%0.326SS..SBendtrans-64.7128.8176.1172.370.8000111.4N338 T339 L340D336-N338 VanDerWaalsContact C-N 3.34Å; D336-N338 PolarHBondContact O-N 2.92Å; D336-N338 WeakPolarHBondContact OD2-CB 3.44Å; D336-N338 PolarHBondContact OD2-N 3.41Å; D336-T339 WeakPolarHBondContact O-CB 3.36Å; D336-T339 PolarHBondContact O-N 3.05Å; D336-T339 VanDerWaalsContact O-N 3.13Å; D336-T339 PolarHBondContact OD2-N 3.19Å; D336-T339 PolarHBondContact OD2-OG1 3.36Å; D336-L340 PolarHBondContact O-N 3.13Å
337Q86Confident87.7Confident141 Ų14162 Ų6266%0.65931%0.307SS*.Hα-helixtrans-65.4-36-174-173.3167.93.800112.4E335 T339 L340 T341E335-Q337 PolarHBondContact O-N 3.38Å; Q337-T339 VanDerWaalsContact C-N 3.28Å; Q337-T339 PolarHBondContact O-N 2.87Å; Q337-L340 PolarHBondContact O-N 2.82Å; Q337-T341 WeakPolarHBondContact O-CB 3.45Å; Q337-T341 PolarHBondContact O-N 3.27Å; Q337-T341 PolarHBondContact O-OG1 3.2Å; Q337-T341 VanDerWaalsContact O-OG1 3.13Å
338N87.2Confident87.9Confident125 Ų12559.2 Ų59.267%0.66830%0.297SS*.Hα-helixtrans-67.2-35.7176.6-60.1-52.4000111D336 S342D336-N338 VanDerWaalsContact C-N 3.34Å; D336-N338 PolarHBondContact O-N 2.92Å; D336-N338 WeakPolarHBondContact OD2-CB 3.44Å; D336-N338 PolarHBondContact OD2-N 3.41Å; N338-S342 VanDerWaalsContact O-CB 3.26Å; N338-S342 WeakPolarHBondContact O-CB 3.45Å; N338-S342 PolarHBondContact O-N 3.44Å
339T85.8Confident87.9Confident48 Ų4856 Ų5629%0.29428%0.276SS..Hα-helixtrans-64.2-49.3175.1-56.30000110.7D336 Q337 T341 S342 I343D336-T339 WeakPolarHBondContact O-CB 3.36Å; D336-T339 PolarHBondContact O-N 3.05Å; D336-T339 VanDerWaalsContact O-N 3.13Å; D336-T339 PolarHBondContact OD2-N 3.19Å; D336-T339 PolarHBondContact OD2-OG1 3.36Å; Q337-T339 VanDerWaalsContact C-N 3.28Å; Q337-T339 PolarHBondContact O-N 2.87Å; T339-T341 PolarHBondContact O-N 3.27Å; T339-S342 PolarHBondContact O-N 2.92Å; T339-I343 HydrophobicContact CG2-CD1 3.95Å; T339-I343 WeakPolarHBondContact O-CD1 3.41Å; T339-I343 VanDerWaalsContact O-CG1 3.23Å; T339-I343 WeakPolarHBondContact O-CG1 3.15Å; T339-I343 PolarHBondContact O-N 3.2Å
340L86.8Confident88Confident4 Ų450.4 Ų50.42%0.02125%0.253CS..Hα-helixtrans-58.7-47.6174.9-73.4171.7000112.5F334 D336 Q337 S342 I343 C344 L393 F397 P400 V401 I404F334-L340 HydrophobicContact CB-CD2 4.47Å; F334-L340 WeakPolarHBondContact O-CD1 3.49Å; F334-L340 VanDerWaalsContact O-CD2 3.28Å; F334-L340 WeakPolarHBondContact O-CD2 3.5Å; F334-L340 WeakPolarHBondContact O-CG 3.29Å; D336-L340 PolarHBondContact O-N 3.13Å; Q337-L340 PolarHBondContact O-N 2.82Å; L340-S342 VanDerWaalsContact C-N 3.33Å; L340-S342 PolarHBondContact O-N 3.24Å; L340-I343 PolarHBondContact O-N 3.11Å; L340-C344 PolarHBondContact O-N 3Å; L340-C344 PolarHBondContact O-SG 2.96Å; L340-L393 HydrophobicContact CD2-CD2 4.04Å; L340-F397 HydrophobicContact CD1-CB 4.35Å; L340-F397 HydrophobicContact CD1-CD1 4.14Å; L340-F397 HydrophobicContact CD1-CG 4.19Å; L340-F397 HydrophobicContact CD2-CD2 4.25Å; L340-F397 HydrophobicContact CD2-CG 4.39Å; L340-P400 HydrophobicContact CD1-CB 4.47Å; L340-V401 HydrophobicContact CD2-CG2 4.44Å; L340-I404 HydrophobicContact CB-CD1 4.31Å
341T89.4Confident88.1Confident36 Ų3650.4 Ų50.422%0.22125%0.253CS..Hα-helixtrans-59.8-46176.8-64.60000110.8Q337 T339 I343 C344 E345Q337-T341 WeakPolarHBondContact O-CB 3.45Å; Q337-T341 PolarHBondContact O-N 3.27Å; Q337-T341 PolarHBondContact O-OG1 3.2Å; Q337-T341 VanDerWaalsContact O-OG1 3.13Å; T339-T341 PolarHBondContact O-N 3.27Å; T341-I343 VanDerWaalsContact C-N 3.31Å; T341-I343 PolarHBondContact O-N 3.49Å; T341-C344 PolarHBondContact O-N 3.28Å; T341-E345 HydrophobicContact CG2-CG 4.18Å; T341-E345 WeakPolarHBondContact O-CB 3.19Å; T341-E345 WeakPolarHBondContact O-CG 3.18Å; T341-E345 PolarHBondContact O-N 3.09Å
342S89.3Confident88.1Confident23 Ų2347.4 Ų47.416%0.16124%0.24CC..Hα-helixtrans-64-35.1178.3-168.20000112.4W298 N338 T339 L340 K346W298-S342 WeakPolarHBondContact CZ2-OG 3.28Å; N338-S342 VanDerWaalsContact O-CB 3.26Å; N338-S342 WeakPolarHBondContact O-CB 3.45Å; N338-S342 PolarHBondContact O-N 3.44Å; T339-S342 PolarHBondContact O-N 2.92Å; L340-S342 VanDerWaalsContact C-N 3.33Å; L340-S342 PolarHBondContact O-N 3.24Å; S342-K346 WeakPolarHBondContact O-CB 3.34Å; S342-K346 PolarHBondContact O-N 3.46Å
343I88.1Confident88Confident4 Ų446.3 Ų46.32%0.02124%0.235CC..Hα-helixtrans-65-46.9176.3-67.1156.5000109.3W298 F334 T339 L340 T341 V347 I348 L389 L393W298-I343 HydrophobicContact CE3-CG1 4.02Å; W298-I343 VanDerWaalsContact CH2-CA 3.44Å; W298-I343 HydrophobicContact CH2-CB 3.99Å; W298-I343 HydrophobicContact CH2-CG1 3.39Å; W298-I343 HydrophobicContact CZ2-CG1 4.47Å; W298-I343 HydrophobicContact CZ3-CB 3.87Å; W298-I343 HydrophobicContact CZ3-CD1 4.34Å; W298-I343 HydrophobicContact CZ3-CG1 3.11Å; W298-I343 HydrophobicContact CZ3-CG2 4.35Å; F334-I343 HydrophobicContact CD1-CD1 3.73Å; F334-I343 HydrophobicContact CE1-CD1 4.37Å; T339-I343 HydrophobicContact CG2-CD1 3.95Å; T339-I343 WeakPolarHBondContact O-CD1 3.41Å; T339-I343 VanDerWaalsContact O-CG1 3.23Å; T339-I343 WeakPolarHBondContact O-CG1 3.15Å; T339-I343 PolarHBondContact O-N 3.2Å; L340-I343 PolarHBondContact O-N 3.11Å; T341-I343 VanDerWaalsContact C-N 3.31Å; T341-I343 PolarHBondContact O-N 3.49Å; I343-V347 WeakPolarHBondContact O-CB 3.37Å; I343-V347 PolarHBondContact O-N 3.23Å; I343-I348 HydrophobicContact CG2-CD1 3.82Å; I343-I348 HydrophobicContact CG2-CG1 4.22Å; I343-I348 PolarHBondContact O-N 3.17Å; I343-L389 HydrophobicContact CG2-CD2 3.95Å; I343-L393 HydrophobicContact CG2-CD1 3.85Å
344C87.9Confident88Confident0 Ų044.3 Ų44.30%023%0.225CC..Iπ-helixtrans-61.5-48.7178.6-62.10000111.2L340 T341 V349 I404 F405L340-C344 PolarHBondContact O-N 3Å; L340-C344 PolarHBondContact O-SG 2.96Å; T341-C344 PolarHBondContact O-N 3.28Å; C344-V349 WeakPolarHBondContact O-CG2 3.46Å; C344-V349 PolarHBondContact O-N 3.34Å; C344-I404 HydrophobicContact CB-CG2 3.66Å; C344-F405 HydrophobicContact CB-CD1 4.41Å; C344-F405 HydrophobicContact CB-CE1 3.68Å; C344-F405 HydrophobicContact CB-CE2 4.42Å; C344-F405 HydrophobicContact CB-CZ 3.69Å; C344-F405 VanDerWaalsContact SG-CZ 3.5Å
345E88.3Confident88Confident84 Ų8445.6 Ų45.639%0.39323%0.229SC..Iπ-helixtrans-74.4-46.6-174.6-75.8-176151.200114.7T341 P350 Y408T341-E345 HydrophobicContact CG2-CG 4.18Å; T341-E345 WeakPolarHBondContact O-CB 3.19Å; T341-E345 WeakPolarHBondContact O-CG 3.18Å; T341-E345 PolarHBondContact O-N 3.09Å; E345-P350 VanDerWaalsContact O-CD 3.26Å; E345-P350 WeakPolarHBondContact O-CD 3.43Å; E345-Y408 HydrophobicContact CG-CE1 4.03Å; E345-Y408 HydrophobicContact CG-CE2 4.14Å; E345-Y408 VanDerWaalsContact CG-CZ 3.42Å; E345-Y408 WeakPolarHBondContact CG-OH 3.38Å; E345-Y408 PolarHBondContact OE1-OH 3.26Å
346K88.9Confident88Confident113 Ų11344.9 Ų44.949%0.49124%0.236SC..Iπ-helixtrans-98.4-20.1-168-59.2-171.1-177.41730113.4V302 S342V302-K346 HydrophobicContact CG1-CD 4.25Å; V302-K346 HydrophobicContact CG2-CB 4.31Å; S342-K346 WeakPolarHBondContact O-CB 3.34Å; S342-K346 PolarHBondContact O-N 3.46Å
347V89.4Confident87.9Confident0 Ų042.8 Ų42.80%023%0.229CC..Iπ-helixtrans-112.7-53.2-178-178.60000110.8W298 L301 V302 I318 I343 N351 L389W298-V347 HydrophobicContact CE3-CG2 4.2Å; W298-V347 HydrophobicContact CH2-CG2 3.95Å; W298-V347 HydrophobicContact CZ3-CB 4.47Å; W298-V347 HydrophobicContact CZ3-CG2 3.5Å; W298-V347 VanDerWaalsContact CZ3-CG2 3.5Å; L301-V347 HydrophobicContact CB-CG1 4.34Å; L301-V347 HydrophobicContact CB-CG2 4.07Å; L301-V347 HydrophobicContact CD1-CG1 3.96Å; V302-V347 HydrophobicContact CG2-CG2 4.35Å; I318-V347 HydrophobicContact CD1-CG1 4.28Å; I318-V347 HydrophobicContact CG1-CG1 4.06Å; I343-V347 WeakPolarHBondContact O-CB 3.37Å; I343-V347 PolarHBondContact O-N 3.23Å; V347-N351 WeakPolarHBondContact O-CB 3.12Å; V347-N351 PolarHBondContact O-ND2 3.43Å; V347-L389 HydrophobicContact CG1-CD2 4.31Å
348I90.1Very high88Confident0 Ų037.3 Ų37.30%021%0.205CC..Iπ-helixtrans-76-56.4-171.4-64.1169.4000111.5I343 N351 M352 A386 L389 V390 L393 F405I343-I348 HydrophobicContact CG2-CD1 3.82Å; I343-I348 HydrophobicContact CG2-CG1 4.22Å; I343-I348 PolarHBondContact O-N 3.17Å; I348-N351 PolarHBondContact O-N 3.29Å; I348-M352 HydrophobicContact CG2-CE 4.25Å; I348-M352 HydrophobicContact CG2-CG 4.29Å; I348-M352 HydrophobicContact CG2-SD 3.8Å; I348-M352 WeakPolarHBondContact O-CG 3.31Å; I348-M352 PolarHBondContact O-N 3.38Å; I348-A386 HydrophobicContact CG2-CB 4.34Å; I348-L389 HydrophobicContact CD1-CD2 4.01Å; I348-L389 HydrophobicContact CD1-CG 4.05Å; I348-L389 HydrophobicContact CG1-CD2 3.82Å; I348-L389 HydrophobicContact CG1-CG 4.31Å; I348-V390 HydrophobicContact CD1-CG2 3.93Å; I348-V390 HydrophobicContact CG2-CG2 3.58Å; I348-L393 HydrophobicContact CD1-CD1 3.88Å; I348-F405 HydrophobicContact CB-CE1 4.31Å; I348-F405 HydrophobicContact CB-CZ 3.99Å; I348-F405 HydrophobicContact CD1-CE2 4.37Å; I348-F405 HydrophobicContact CD1-CZ 3.71Å; I348-F405 HydrophobicContact CG1-CZ 4.45Å; I348-F405 HydrophobicContact CG2-CE1 3.92Å; I348-F405 HydrophobicContact CG2-CZ 3.64Å
349V88.2Confident88.1Confident18 Ų1833.9 Ų33.911%0.10919%0.185CC..THydrogen-bonded Turntrans-56-49.6-174.8166.40000113C344 N351 M352 F405 Y408 M412C344-V349 WeakPolarHBondContact O-CG2 3.46Å; C344-V349 PolarHBondContact O-N 3.34Å; V349-N351 PolarHBondContact O-N 3.4Å; V349-M352 PolarHBondContact O-N 2.88Å; V349-F405 HydrophobicContact CG2-CE1 4.18Å; V349-Y408 HydrophobicContact CG2-CG 4.41Å; V349-M412 HydrophobicContact CG1-CE 3.57Å; V349-M412 HydrophobicContact CG2-CE 4.42Å
350P88.5Confident88.3Confident34 Ų3437 Ų3722%0.22120%0.196CC..THydrogen-bonded Turntrans-64.2-30-177.9-23.536000113.1Q306 E345 M352Q306-P350 PolarHBondContact NE2-O 3.48Å; Q306-P350 PolarHBondContact OE1-O 3.22Å; E345-P350 VanDerWaalsContact O-CD 3.26Å; E345-P350 WeakPolarHBondContact O-CD 3.43Å; P350-M352 VanDerWaalsContact C-N 3.31Å
351N88.6Confident88.4Confident8 Ų838.3 Ų38.34%0.04321%0.208CC..THydrogen-bonded Turntrans-87.20.4179.6-69.7-52000113I318 V347 I348 V349 R382 R383 A386I318-N351 HydrophobicContact CD1-CB 4.35Å; V347-N351 WeakPolarHBondContact O-CB 3.12Å; V347-N351 PolarHBondContact O-ND2 3.43Å; I348-N351 PolarHBondContact O-N 3.29Å; V349-N351 PolarHBondContact O-N 3.4Å; N351-R382 HydrophobicContact CB-CB 4.14Å; N351-R382 CarbonylContact O-C 3.59Å; N351-R382 WeakPolarHBondContact OD1-CD 3.33Å; N351-R382 PolarHBondContact OD1-NH1 3.35Å; N351-R382 VanDerWaalsContact OD1-NH1 3.14Å; N351-R383 VanDerWaalsContact O-CA 3.3Å; N351-R383 WeakPolarHBondContact O-CA 3.35Å; N351-R383 WeakPolarHBondContact O-CG 3.36Å; N351-R383 PolarHBondContact O-N 3.42Å; N351-A386 HydrophobicContact CB-CB 4.21Å
352M87.7Confident88.6Confident4 Ų436.9 Ų36.92%0.0220%0.198CC..THydrogen-bonded Turntrans-100-13.6172.6-76.8-171.3148.200113.6I348 V349 P350 R383 A386 C387 V390 Y432 L433 S436I348-M352 HydrophobicContact CG2-CE 4.25Å; I348-M352 HydrophobicContact CG2-CG 4.29Å; I348-M352 HydrophobicContact CG2-SD 3.8Å; I348-M352 WeakPolarHBondContact O-CG 3.31Å; I348-M352 PolarHBondContact O-N 3.38Å; V349-M352 PolarHBondContact O-N 2.88Å; P350-M352 VanDerWaalsContact C-N 3.31Å; M352-R383 PolarHBondContact O-NE 2.93Å; M352-R383 PolarHBondContact O-NH2 3.23Å; M352-A386 HydrophobicContact CG-CB 3.97Å; M352-C387 HydrophobicContact CE-CB 4.39Å; M352-V390 HydrophobicContact CE-CG2 4.13Å; M352-Y432 HydrophobicContact CE-CD1 3.85Å; M352-Y432 HydrophobicContact CE-CE1 3.99Å; M352-Y432 HydrophobicContact CG-CD1 4.27Å; M352-Y432 HydrophobicContact SD-CD1 4.32Å; M352-L433 HydrophobicContact CE-CD1 4.16Å; M352-L433 HydrophobicContact SD-CB 4.12Å; M352-L433 HydrophobicContact SD-CD1 3.66Å; M352-L433 HydrophobicContact SD-CG 4.45Å; M352-S436 WeakPolarHBondContact CE-OG 3.38Å
353E86.6Confident88.7Confident95 Ų9541.7 Ų41.744%0.44422%0.218SC..SBendtrans-65.9154.7-179-66.9-171.8172.800112.8R355 R383E353-R355 PolarHBondContact O-N 3.13Å; E353-R383 PolarHBondContact O-NE 2.89Å; E353-R383 PolarHBondContact O-NH2 3.09Å
354F88.1Confident88.8Confident4 Ų447.6 Ų47.62%0.01825%0.25CS..  trans-85.2104.2179.3-157.7-88.7000109.4D358 E359 F362 R383 W424 K425 D428 V479F354-D358 HydrophobicContact CD1-CB 4.21Å; F354-D358 HydrophobicContact CD2-CB 4.43Å; F354-D358 HydrophobicContact CE1-CB 3.98Å; F354-D358 HydrophobicContact CE2-CB 4.14Å; F354-D358 HydrophobicContact CG-CB 4.43Å; F354-D358 HydrophobicContact CZ-CB 3.9Å; F354-E359 HydrophobicContact CD1-CB 4.26Å; F354-E359 VanDerWaalsContact CE1-CA 3.49Å; F354-E359 HydrophobicContact CE1-CB 3.74Å; F354-E359 HydrophobicContact CE1-CG 4.28Å; F354-F362 HydrophobicContact CZ-CB 4.27Å; F354-R383 VanDerWaalsContact CB-NH2 3.27Å; F354-W424 HydrophobicContact CB-CZ3 4.45Å; F354-W424 AromaticContact CD1-CH2 3.64Å; F354-W424 HydrophobicContact CD1-CH2 3.64Å; F354-W424 HydrophobicContact CD1-CZ3 4.17Å; F354-W424 HydrophobicContact CE1-CH2 4.05Å; F354-W424 HydrophobicContact CG-CH2 4.18Å; F354-W424 HydrophobicContact CG-CZ3 4.26Å; F354-K425 HydrophobicContact CB-CG 4.47Å; F354-K425 WeakPolarHBondContact O-CD 3.25Å; F354-K425 PolarHBondContact O-NZ 3.28Å; F354-D428 WeakPolarHBondContact CB-OD2 3.46Å; F354-D428 WeakPolarHBondContact CD2-OD1 3.44Å; F354-V479 HydrophobicContact CD2-CG1 3.9Å; F354-V479 HydrophobicContact CE1-CG1 4.42Å; F354-V479 HydrophobicContact CE1-CG2 4.1Å; F354-V479 HydrophobicContact CE2-CG1 3.63Å; F354-V479 HydrophobicContact CG-CG1 4.49Å; F354-V479 HydrophobicContact CZ-CG1 3.92Å; F354-V479 HydrophobicContact CZ-CG2 3.95Å
355R88.4Confident88.9Confident33 Ų3351.9 Ų51.913%0.12527%0.273CS..  trans-83.7163.6-172.8-57.6176.6-63.1165.50.9110.6Q306 D311 E353 A357 D358 E359Q306-R355 PolarHBondContact O-NH1 2.98Å; D311-R355 VanDerWaalsContact CG-NH1 3.34Å; D311-R355 IonicContact OD1-CZ 2.74Å; D311-R355 IonicContact OD1-NH1 3.51Å; D311-R355 PolarHBondContact OD1-NH1 3.26Å; D311-R355 IonicContact OD1-NH2 3.76Å; D311-R355 IonicContact OD2-CZ 3.58Å; D311-R355 IonicContact OD2-NH1 2.78Å; D311-R355 PolarHBondContact OD2-NH1 3.47Å; D311-R355 VanDerWaalsContact OD2-NH1 3.16Å; D311-R355 IonicContact OD2-NH2 4Å; D311-R355 PolarHBondContact OD2-NH2 2.88Å; E353-R355 PolarHBondContact O-N 3.13Å; R355-A357 PolarHBondContact O-N 3.24Å; R355-D358 WeakPolarHBondContact CB-OD2 3.43Å; R355-D358 PolarHBondContact N-OD2 3.48Å; R355-D358 IonicContact NE-OD2 3.77Å; R355-D358 PolarHBondContact NE-OD2 3.38Å; R355-D358 IonicContact NH2-OD1 2.69Å; R355-D358 WeakPolarHBondContact O-CB 3.17Å; R355-D358 PolarHBondContact O-N 3.25Å; R355-E359 PolarHBondContact O-N 3.13Å
356S87.2Confident89.1Confident90 Ų9048.8 Ų48.863%0.62926%0.26SS*.Hα-helixtrans-59.7-34.2175.3-62.70000112.6D358 E359 E360S356-D358 VanDerWaalsContact C-N 3.33Å; S356-D358 PolarHBondContact O-N 3.21Å; S356-E359 WeakPolarHBondContact O-CB 3.45Å; S356-E359 PolarHBondContact O-N 3.1Å; S356-E360 PolarHBondContact O-N 3.41Å
357A84.9Confident89.1Confident34 Ų3448.6 Ų48.628%0.28126%0.261SS..Hα-helixtrans-67-33.3174.400000112.9V308 R355 E359 A361V308-A357 HydrophobicContact CG2-CB 3.56Å; R355-A357 PolarHBondContact O-N 3.24Å; A357-E359 VanDerWaalsContact C-N 3.33Å; A357-A361 WeakPolarHBondContact O-CB 3.34Å; A357-A361 PolarHBondContact O-N 2.96Å
358D87.9Confident89Confident27 Ų2750.6 Ų50.614%0.14427%0.271CS..Hα-helixtrans-70.7-34.3174.8-55.3-51.4000110.4F354 R355 S356 F362 R383F354-D358 HydrophobicContact CD1-CB 4.21Å; F354-D358 HydrophobicContact CD2-CB 4.43Å; F354-D358 HydrophobicContact CE1-CB 3.98Å; F354-D358 HydrophobicContact CE2-CB 4.14Å; F354-D358 HydrophobicContact CG-CB 4.43Å; F354-D358 HydrophobicContact CZ-CB 3.9Å; R355-D358 WeakPolarHBondContact CB-OD2 3.43Å; R355-D358 PolarHBondContact N-OD2 3.48Å; R355-D358 IonicContact NE-OD2 3.77Å; R355-D358 PolarHBondContact NE-OD2 3.38Å; R355-D358 IonicContact NH2-OD1 2.69Å; R355-D358 WeakPolarHBondContact O-CB 3.17Å; R355-D358 PolarHBondContact O-N 3.25Å; S356-D358 VanDerWaalsContact C-N 3.33Å; S356-D358 PolarHBondContact O-N 3.21Å; D358-F362 VanDerWaalsContact O-CB 3.23Å; D358-F362 WeakPolarHBondContact O-CB 3.49Å; D358-F362 PolarHBondContact O-N 3.35Å; D358-R383 IonicContact OD2-NE 3.65Å
359E90.3Very high89Confident53 Ų5352.2 Ų52.225%0.24828%0.277CS..Hα-helixtrans-66.8-47.3175.2-161.3165.8-175.500111.9F354 R355 S356 A357 A361 F362 E363 K425F354-E359 HydrophobicContact CD1-CB 4.26Å; F354-E359 VanDerWaalsContact CE1-CA 3.49Å; F354-E359 HydrophobicContact CE1-CB 3.74Å; F354-E359 HydrophobicContact CE1-CG 4.28Å; R355-E359 PolarHBondContact O-N 3.13Å; S356-E359 WeakPolarHBondContact O-CB 3.45Å; S356-E359 PolarHBondContact O-N 3.1Å; A357-E359 VanDerWaalsContact C-N 3.33Å; E359-A361 PolarHBondContact O-N 3.02Å; E359-F362 WeakPolarHBondContact O-CB 3.49Å; E359-F362 PolarHBondContact O-N 2.93Å; E359-E363 WeakPolarHBondContact O-CG 3.43Å; E359-E363 PolarHBondContact O-N 3.41Å; E359-K425 WeakPolarHBondContact OE2-CE 3.39Å; E359-K425 IonicContact OE2-NZ 2.7Å; E359-K425 PolarHBondContact OE2-NZ 2.51Å
360E90.1Very high89.2Confident112 Ų11251.5 Ų51.552%0.52327%0.273SS..Hα-helixtrans-60.6-44.9173.1-174.5179.6174.300111.4S356 F362 E363 D364S356-E360 PolarHBondContact O-N 3.41Å; E360-F362 VanDerWaalsContact C-N 3.3Å; E360-F362 PolarHBondContact O-N 2.88Å; E360-E363 PolarHBondContact O-N 2.73Å; E360-D364 WeakPolarHBondContact O-CB 3.46Å; E360-D364 PolarHBondContact O-N 3.31Å
361A89Confident89.1Confident33 Ų3355.3 Ų55.327%0.27328%0.283SS..Hα-helixtrans-63.1-37.2175.700000112.3A357 E359 N365 S366 Y369A357-A361 WeakPolarHBondContact O-CB 3.34Å; A357-A361 PolarHBondContact O-N 2.96Å; E359-A361 PolarHBondContact O-N 3.02Å; A361-N365 CarbonylContact O-C 3.04Å; A361-N365 WeakPolarHBondContact O-CA 3.46Å; A361-N365 PolarHBondContact O-N 3.44Å; A361-N365 VanDerWaalsContact O-O 3.12Å; A361-S366 PolarHBondContact O-N 2.76Å; A361-S366 VanDerWaalsContact O-N 3.13Å; A361-Y369 HydrophobicContact CB-CD2 4.26Å
362F92.7Very high88.9Confident5 Ų560.6 Ų60.62%0.02230%0.302CS..Hα-helixtrans-66.9-39.5177.4-177.7-82000112.2F354 D358 E359 E360 S366 Y369 P478 V479 A482 S515 V517F354-F362 HydrophobicContact CZ-CB 4.27Å; D358-F362 VanDerWaalsContact O-CB 3.23Å; D358-F362 WeakPolarHBondContact O-CB 3.49Å; D358-F362 PolarHBondContact O-N 3.35Å; E359-F362 WeakPolarHBondContact O-CB 3.49Å; E359-F362 PolarHBondContact O-N 2.93Å; E360-F362 VanDerWaalsContact C-N 3.3Å; E360-F362 PolarHBondContact O-N 2.88Å; F362-S366 WeakPolarHBondContact O-CB 3.47Å; F362-Y369 HydrophobicContact CB-CD2 4.3Å; F362-Y369 HydrophobicContact CB-CE2 4.37Å; F362-Y369 HydrophobicContact CD2-CD1 4.15Å; F362-Y369 AromaticContact CD2-CE1 3.78Å; F362-Y369 HydrophobicContact CD2-CE1 3.78Å; F362-Y369 HydrophobicContact CD2-CE2 4.39Å; F362-Y369 AromaticContact CD2-CZ 3.92Å; F362-Y369 HydrophobicContact CE2-CE1 4.38Å; F362-P478 HydrophobicContact CE1-CB 4.02Å; F362-P478 HydrophobicContact CE1-CG 4.21Å; F362-P478 HydrophobicContact CZ-CB 4.19Å; F362-V479 HydrophobicContact CD1-CG2 4.17Å; F362-V479 HydrophobicContact CD2-CG2 4.25Å; F362-V479 HydrophobicContact CE1-CG2 4.05Å; F362-V479 HydrophobicContact CE2-CG2 4.12Å; F362-V479 HydrophobicContact CG-CG2 4.28Å; F362-V479 HydrophobicContact CZ-CG2 4.02Å; F362-A482 HydrophobicContact CE2-CB 3.99Å; F362-A482 HydrophobicContact CZ-CB 4.26Å; F362-S515 WeakPolarHBondContact CE1-OG 3.37Å; F362-V517 HydrophobicContact CD1-CG2 4.36Å; F362-V517 HydrophobicContact CD2-CB 3.98Å; F362-V517 HydrophobicContact CD2-CG1 3.96Å; F362-V517 HydrophobicContact CD2-CG2 3.75Å; F362-V517 HydrophobicContact CE1-CB 4.32Å; F362-V517 HydrophobicContact CE1-CG2 4.37Å; F362-V517 HydrophobicContact CE2-CB 3.46Å; F362-V517 VanDerWaalsContact CE2-CB 3.46Å; F362-V517 HydrophobicContact CE2-CG1 3.42Å; F362-V517 VanDerWaalsContact CE2-CG1 3.42Å; F362-V517 HydrophobicContact CE2-CG2 3.79Å; F362-V517 HydrophobicContact CG-CG2 4.05Å; F362-V517 HydrophobicContact CZ-CB 3.65Å; F362-V517 HydrophobicContact CZ-CG1 4.07Å; F362-V517 HydrophobicContact CZ-CG2 4.1Å
363E91.1Very high88.7Confident124 Ų12461.8 Ų61.858%0.57931%0.309SS*.Hα-helixtrans-85.2-52.7-176.7-66.9-175.4169.400112.6E359 E360E359-E363 WeakPolarHBondContact O-CG 3.43Å; E359-E363 PolarHBondContact O-N 3.41Å; E360-E363 PolarHBondContact O-N 2.73Å
364D89.9Confident88.5Confident129 Ų12958.9 Ų58.969%0.6930%0.296SS*.Hα-helixtrans-95.3-27.4-169.3-66.2-37.1000113.2E360E360-D364 WeakPolarHBondContact O-CB 3.46Å; E360-D364 PolarHBondContact O-N 3.31Å
365N91.3Very high87.9Confident89 Ų8963.1 Ų63.148%0.47632%0.316SS..SBendtrans-123.840.3-179.9-160.82.3000113A361 E367 E368 Y369A361-N365 CarbonylContact O-C 3.04Å; A361-N365 WeakPolarHBondContact O-CA 3.46Å; A361-N365 PolarHBondContact O-N 3.44Å; A361-N365 VanDerWaalsContact O-O 3.12Å; N365-E367 PolarHBondContact O-N 3.34Å; N365-E367 VanDerWaalsContact O-N 3.1Å; N365-E368 PolarHBondContact O-N 3.36Å; N365-E368 WeakPolarHBondContact OD1-CB 3.49Å; N365-Y369 PolarHBondContact O-N 2.81Å; N365-Y369 VanDerWaalsContact O-N 3.1Å
366S93Very high86.8Confident19 Ų1963.2 Ų63.213%0.13333%0.327CS..Hα-helixtrans-51.5-36.3-173.854.40000114.5A361 F362 Y369 I370 T516A361-S366 PolarHBondContact O-N 2.76Å; A361-S366 VanDerWaalsContact O-N 3.13Å; F362-S366 WeakPolarHBondContact O-CB 3.47Å; S366-Y369 PolarHBondContact O-N 2.89Å; S366-I370 WeakPolarHBondContact O-CB 3.29Å; S366-I370 VanDerWaalsContact O-CD1 3.26Å; S366-I370 WeakPolarHBondContact O-CD1 3.07Å; S366-I370 WeakPolarHBondContact O-CG1 3.19Å; S366-I370 PolarHBondContact O-N 3.07Å; S366-T516 WeakPolarHBondContact OG-CB 3.45Å; S366-T516 WeakPolarHBondContact OG-CG2 3.45Å
367E88.8Confident85.4Confident110 Ų11061.8 Ų61.851%0.51432%0.317SS..Hα-helixtrans-62.4-47.7178.4-174.2178.1-179.600111.9N365 Y369 I370 R371 K611N365-E367 PolarHBondContact O-N 3.34Å; N365-E367 VanDerWaalsContact O-N 3.1Å; E367-Y369 VanDerWaalsContact C-N 3.34Å; E367-I370 PolarHBondContact O-N 3.39Å; E367-R371 WeakPolarHBondContact O-CB 3.36Å; E367-R371 PolarHBondContact O-N 2.94Å; E367-K611 IonicContact OE1-NZ 3.95Å; E367-K611 PolarHBondContact OE1-NZ 2.93Å; E367-K611 IonicContact OE2-NZ 3.58Å; E367-K611 PolarHBondContact OE2-NZ 3.26Å
368E87.1Confident84.3Confident41 Ų4160.8 Ų60.819%0.19231%0.307CS..Hα-helixtrans-67.4-38.2178.4-179.663.817700111.1N365 R371 R372N365-E368 PolarHBondContact O-N 3.36Å; N365-E368 WeakPolarHBondContact OD1-CB 3.49Å; E368-R371 PolarHBondContact O-N 3.47Å; E368-R371 IonicContact OE1-NH2 3.97Å; E368-R371 PolarHBondContact OE1-NH2 3.08Å; E368-R371 IonicContact OE2-CZ 3.77Å; E368-R371 IonicContact OE2-NE 3.38Å; E368-R371 PolarHBondContact OE2-NE 3.39Å; E368-R371 IonicContact OE2-NH2 3.83Å; E368-R371 PolarHBondContact OE2-NH2 3.4Å; E368-R372 HydrophobicContact CG-CG 4.44Å; E368-R372 WeakPolarHBondContact O-CB 3.38Å; E368-R372 WeakPolarHBondContact O-CG 3.47Å; E368-R372 PolarHBondContact O-N 3.1Å; E368-R372 IonicContact OE1-CZ 2.67Å; E368-R372 VanDerWaalsContact OE1-CZ 3.27Å; E368-R372 IonicContact OE1-NE 3.4Å; E368-R372 PolarHBondContact OE1-NE 3Å; E368-R372 IonicContact OE1-NH2 2.78Å; E368-R372 PolarHBondContact OE1-NH2 3.08Å
369Y90.3Very high83Confident34 Ų3464.1 Ų64.113%0.13332%0.324CS..Hα-helixtrans-57.7-52.4174.2-176.6-83.3000111.3A361 F362 N365 S366 E367 R371 R372 D373 V517A361-Y369 HydrophobicContact CB-CD2 4.26Å; F362-Y369 HydrophobicContact CB-CD2 4.3Å; F362-Y369 HydrophobicContact CB-CE2 4.37Å; F362-Y369 HydrophobicContact CD2-CD1 4.15Å; F362-Y369 AromaticContact CD2-CE1 3.78Å; F362-Y369 HydrophobicContact CD2-CE1 3.78Å; F362-Y369 HydrophobicContact CD2-CE2 4.39Å; F362-Y369 AromaticContact CD2-CZ 3.92Å; F362-Y369 HydrophobicContact CE2-CE1 4.38Å; N365-Y369 PolarHBondContact O-N 2.81Å; N365-Y369 VanDerWaalsContact O-N 3.1Å; S366-Y369 PolarHBondContact O-N 2.89Å; E367-Y369 VanDerWaalsContact C-N 3.34Å; Y369-R371 VanDerWaalsContact C-N 3.32Å; Y369-R371 PolarHBondContact O-N 3.4Å; Y369-R372 PolarHBondContact O-N 3.37Å; Y369-D373 WeakPolarHBondContact O-CB 3.27Å; Y369-D373 PolarHBondContact O-N 3.04Å; Y369-V517 HydrophobicContact CD1-CG1 4Å; Y369-V517 HydrophobicContact CD1-CG2 4.09Å; Y369-V517 HydrophobicContact CE1-CG1 4.01Å
370I91.6Very high81.8Confident4 Ų466.1 Ų66.12%0.02134%0.336CS..Hα-helixtrans-57.5-46.7178.2-69.8156.2000110.5S366 E367 D373 L374 T516 V517 T520 Y521 Y571S366-I370 WeakPolarHBondContact O-CB 3.29Å; S366-I370 VanDerWaalsContact O-CD1 3.26Å; S366-I370 WeakPolarHBondContact O-CD1 3.07Å; S366-I370 WeakPolarHBondContact O-CG1 3.19Å; S366-I370 PolarHBondContact O-N 3.07Å; E367-I370 PolarHBondContact O-N 3.39Å; I370-D373 PolarHBondContact O-N 2.8Å; I370-L374 HydrophobicContact CG2-CD1 3.65Å; I370-L374 HydrophobicContact CG2-CG 4.16Å; I370-L374 WeakPolarHBondContact O-CB 2.98Å; I370-L374 WeakPolarHBondContact O-CG 3.39Å; I370-L374 PolarHBondContact O-N 3.46Å; I370-T516 HydrophobicContact CD1-CG2 4.13Å; I370-V517 HydrophobicContact CD1-CG2 4.38Å; I370-V517 HydrophobicContact CG1-CB 4.38Å; I370-V517 HydrophobicContact CG1-CG1 4.16Å; I370-V517 HydrophobicContact CG1-CG2 4.16Å; I370-T520 HydrophobicContact CD1-CG2 3.82Å; I370-T520 HydrophobicContact CG1-CG2 4.37Å; I370-T520 HydrophobicContact CG2-CG2 3.94Å; I370-Y521 HydrophobicContact CB-CE1 4.43Å; I370-Y521 HydrophobicContact CG1-CE1 4.03Å; I370-Y521 HydrophobicContact CG2-CE1 4.24Å; I370-Y571 HydrophobicContact CG2-CD2 4.13Å; I370-Y571 HydrophobicContact CG2-CE2 3.61Å
371R86.5Confident81.3Confident114 Ų11462.6 Ų62.643%0.4332%0.323SS..Hα-helixtrans-62.3-47.8-177.3-168.917566.4143.83.2111.6E367 E368 Y369 D373 E375E367-R371 WeakPolarHBondContact O-CB 3.36Å; E367-R371 PolarHBondContact O-N 2.94Å; E368-R371 PolarHBondContact O-N 3.47Å; E368-R371 IonicContact OE1-NH2 3.97Å; E368-R371 PolarHBondContact OE1-NH2 3.08Å; E368-R371 IonicContact OE2-CZ 3.77Å; E368-R371 IonicContact OE2-NE 3.38Å; E368-R371 PolarHBondContact OE2-NE 3.39Å; E368-R371 IonicContact OE2-NH2 3.83Å; E368-R371 PolarHBondContact OE2-NH2 3.4Å; Y369-R371 VanDerWaalsContact C-N 3.32Å; Y369-R371 PolarHBondContact O-N 3.4Å; R371-D373 VanDerWaalsContact C-N 3.33Å; R371-D373 PolarHBondContact O-N 3.43Å; R371-E375 VanDerWaalsContact CG-CD 3.43Å; R371-E375 HydrophobicContact CG-CG 4.3Å; R371-E375 VanDerWaalsContact CG-OE2 3.31Å; R371-E375 WeakPolarHBondContact CG-OE2 3.47Å; R371-E375 WeakPolarHBondContact O-CB 3.15Å; R371-E375 WeakPolarHBondContact O-CG 3.38Å; R371-E375 PolarHBondContact O-N 2.92Å
372R83.8Confident81.2Confident118 Ų11861.1 Ų61.145%0.44531%0.31SS..Hα-helixtrans-58-47.5177.4-74.3179.7-175.7-174.14.4111.7E368 Y369 G376 S377 D378E368-R372 HydrophobicContact CG-CG 4.44Å; E368-R372 WeakPolarHBondContact O-CB 3.38Å; E368-R372 WeakPolarHBondContact O-CG 3.47Å; E368-R372 PolarHBondContact O-N 3.1Å; E368-R372 IonicContact OE1-CZ 2.67Å; E368-R372 VanDerWaalsContact OE1-CZ 3.27Å; E368-R372 IonicContact OE1-NE 3.4Å; E368-R372 PolarHBondContact OE1-NE 3Å; E368-R372 IonicContact OE1-NH2 2.78Å; E368-R372 PolarHBondContact OE1-NH2 3.08Å; Y369-R372 PolarHBondContact O-N 3.37Å; R372-G376 PolarHBondContact O-N 2.99Å; R372-S377 WeakPolarHBondContact CA-OG 3.21Å; R372-S377 PolarHBondContact O-N 3.35Å; R372-D378 HydrophobicContact CB-CB 4.43Å; R372-D378 PolarHBondContact O-N 3.35Å
373D84.8Confident80.9Confident30 Ų3061.9 Ų61.916%0.1631%0.312CS..Hα-helixtrans-75.4-39-173.3-165.157.9000113.9Y369 I370 R371 K486 Y521Y369-D373 WeakPolarHBondContact O-CB 3.27Å; Y369-D373 PolarHBondContact O-N 3.04Å; I370-D373 PolarHBondContact O-N 2.8Å; R371-D373 VanDerWaalsContact C-N 3.33Å; R371-D373 PolarHBondContact O-N 3.43Å; D373-K486 IonicContact OD1-NZ 3.67Å; D373-K486 PolarHBondContact OD1-NZ 3.04Å; D373-K486 WeakPolarHBondContact OD2-CD 3.28Å; D373-K486 WeakPolarHBondContact OD2-CE 3.38Å; D373-K486 IonicContact OD2-NZ 3.22Å; D373-K486 PolarHBondContact OD2-NZ 3.28Å; D373-Y521 VanDerWaalsContact CB-OH 3.23Å; D373-Y521 WeakPolarHBondContact CB-OH 3.23Å; D373-Y521 PolarHBondContact OD2-OH 3.24Å
374L82.8Confident80.6Confident33 Ų3358.2 Ų58.217%0.17329%0.293CS..Hα-helixtrans-86-34-177.6-64.2-172.8000113.8I370 M489 Y521 H524 Y571I370-L374 HydrophobicContact CG2-CD1 3.65Å; I370-L374 HydrophobicContact CG2-CG 4.16Å; I370-L374 WeakPolarHBondContact O-CB 2.98Å; I370-L374 WeakPolarHBondContact O-CG 3.39Å; I370-L374 PolarHBondContact O-N 3.46Å; L374-M489 HydrophobicContact CD2-CE 3.4Å; L374-M489 VanDerWaalsContact CD2-CE 3.4Å; L374-M489 HydrophobicContact CD2-SD 4.15Å; L374-Y521 HydrophobicContact CD1-CD1 4.16Å; L374-Y521 HydrophobicContact CD1-CE1 3.96Å; L374-Y521 HydrophobicContact CD2-CD1 4.35Å; L374-Y521 HydrophobicContact CD2-CE1 3.89Å; L374-Y521 HydrophobicContact CG-CD1 4.47Å; L374-Y521 HydrophobicContact CG-CE1 3.85Å; L374-H524 HydrophobicContact CD1-CB 4.33Å; L374-Y571 HydrophobicContact CB-CE1 4.48Å; L374-Y571 HydrophobicContact CD1-CD1 4.01Å; L374-Y571 HydrophobicContact CD1-CE1 3.55Å
375E74.7Confident80.5Confident93 Ų9352.3 Ų52.344%0.43526%0.262SS..Hα-helixtrans-89.9-10.4-176.9-57.5178.6-172.700112.7R371 Y571R371-E375 VanDerWaalsContact CG-CD 3.43Å; R371-E375 HydrophobicContact CG-CG 4.3Å; R371-E375 VanDerWaalsContact CG-OE2 3.31Å; R371-E375 WeakPolarHBondContact CG-OE2 3.47Å; R371-E375 WeakPolarHBondContact O-CB 3.15Å; R371-E375 WeakPolarHBondContact O-CG 3.38Å; R371-E375 PolarHBondContact O-N 2.92Å; E375-Y571 PolarHBondContact OE1-OH 3.48Å
376G64.7Low80.4Confident36 Ų3648 Ų4837%0.37124%0.24SC..THydrogen-bonded Turntrans75.928178.900000113.2R372 I379R372-G376 PolarHBondContact O-N 2.99Å; G376-I379 WeakPolarHBondContact O-CG1 3.32Å
377S58.9Low80.1Confident59 Ų5947.4 Ų47.441%0.41324%0.235SC..  trans-88.210.1170.652.40000112.4R372 I379R372-S377 WeakPolarHBondContact CA-OG 3.21Å; R372-S377 PolarHBondContact O-N 3.35Å; S377-I379 PolarHBondContact O-N 2.89Å
378D62.2Low80Confident14 Ų1444.1 Ų44.18%0.07522%0.221CC..G310 helixtrans-78.512.717469-31.8000114.1R372 D380 T381 R384R372-D378 HydrophobicContact CB-CB 4.43Å; R372-D378 PolarHBondContact O-N 3.35Å; D378-D380 PolarHBondContact O-N 3.39Å; D378-T381 HydrophobicContact CB-CG2 4.09Å; D378-T381 WeakPolarHBondContact O-CB 3.44Å; D378-T381 WeakPolarHBondContact O-CG2 3.4Å; D378-T381 PolarHBondContact O-N 3.13Å; D378-T381 PolarHBondContact O-OG1 3.32Å; D378-R384 WeakPolarHBondContact O-CB 3.23Å; D378-R384 WeakPolarHBondContact O-CG 3.46Å; D378-R384 WeakPolarHBondContact OD2-CD 3.33Å
379I59.2Low80.2Confident96 Ų9642.2 Ų42.249%0.49221%0.212SC..G310 helixtrans-51.3-34.2-175.8-62.3172000111.9G376 S377G376-I379 WeakPolarHBondContact O-CG1 3.32Å; S377-I379 PolarHBondContact O-N 2.89Å
380D65.4Low80.2Confident96 Ų9640.6 Ų40.651%0.51321%0.206SC..G310 helixtrans-92.65.8-175.6-56.7-32.8000113.6S315 D378S315-D380 WeakPolarHBondContact CB-O 3.27Å; S315-D380 PolarHBondContact OG-O 3.18Å; D378-D380 PolarHBondContact O-N 3.39Å
381T80.1Confident80Confident38 Ų3843.4 Ų43.423%0.23322%0.216CC..SBendtrans-87.1146.7179.369.30000112.3S315 D378 R383 R384 A385S315-T381 VanDerWaalsContact OG-C 3.25Å; S315-T381 PolarHBondContact OG-O 3.2Å; D378-T381 HydrophobicContact CB-CG2 4.09Å; D378-T381 WeakPolarHBondContact O-CB 3.44Å; D378-T381 WeakPolarHBondContact O-CG2 3.4Å; D378-T381 PolarHBondContact O-N 3.13Å; D378-T381 PolarHBondContact O-OG1 3.32Å; T381-R383 VanDerWaalsContact C-N 3.32Å; T381-R383 PolarHBondContact O-N 3.48Å; T381-R384 PolarHBondContact O-N 2.8Å; T381-R384 WeakPolarHBondContact OG1-CB 3.38Å; T381-R384 PolarHBondContact OG1-N 2.95Å; T381-A385 PolarHBondContact O-N 3.17Å
382R87Confident80.1Confident2 Ų238 Ų381%0.00820%0.196CC..Hα-helixtrans-58.9-42.4178.1-60.4-162.7-172-161.27.4112.9G305 E307 D311 V314 S315 N351 R384 A385 A386G305-R382 PolarHBondContact O-NH1 2.87Å; G305-R382 PolarHBondContact O-NH2 3.49Å; E307-R382 PolarHBondContact O-NH2 2.72Å; D311-R382 HydrophobicContact CB-CG 4.37Å; D311-R382 IonicContact OD1-CZ 2.68Å; D311-R382 IonicContact OD1-NE 2.85Å; D311-R382 PolarHBondContact OD1-NE 2.93Å; D311-R382 IonicContact OD1-NH2 2.59Å; D311-R382 PolarHBondContact OD1-NH2 2.87Å; V314-R382 HydrophobicContact CB-CG 4.41Å; V314-R382 HydrophobicContact CG1-CG 4.11Å; S315-R382 PolarHBondContact OG-N 3.35Å; N351-R382 HydrophobicContact CB-CB 4.14Å; N351-R382 CarbonylContact O-C 3.59Å; N351-R382 WeakPolarHBondContact OD1-CD 3.33Å; N351-R382 PolarHBondContact OD1-NH1 3.35Å; N351-R382 VanDerWaalsContact OD1-NH1 3.14Å; R382-R384 VanDerWaalsContact C-N 3.32Å; R382-R384 PolarHBondContact O-N 3.23Å; R382-A385 PolarHBondContact O-N 3.02Å; R382-A386 VanDerWaalsContact O-CB 3.28Å; R382-A386 WeakPolarHBondContact O-CB 3.43Å; R382-A386 PolarHBondContact O-N 3.28Å
383R86.3Confident80.5Confident20 Ų2032.3 Ų32.38%0.07517%0.174CC..Hα-helixtrans-58.2-45.1178-74.9177.6158.2-134.6-23.9111.3N351 M352 E353 F354 D358 T381 C387 D428 Y432N351-R383 VanDerWaalsContact O-CA 3.3Å; N351-R383 WeakPolarHBondContact O-CA 3.35Å; N351-R383 WeakPolarHBondContact O-CG 3.36Å; N351-R383 PolarHBondContact O-N 3.42Å; M352-R383 PolarHBondContact O-NE 2.93Å; M352-R383 PolarHBondContact O-NH2 3.23Å; E353-R383 PolarHBondContact O-NE 2.89Å; E353-R383 PolarHBondContact O-NH2 3.09Å; F354-R383 VanDerWaalsContact CB-NH2 3.27Å; D358-R383 IonicContact OD2-NE 3.65Å; T381-R383 VanDerWaalsContact C-N 3.32Å; T381-R383 PolarHBondContact O-N 3.48Å; R383-C387 WeakPolarHBondContact O-CB 3.29Å; R383-C387 PolarHBondContact O-N 3.1Å; R383-D428 IonicContact CZ-OD2 3.43Å; R383-D428 IonicContact NH1-OD1 3.61Å; R383-D428 PolarHBondContact NH1-OD1 3.39Å; R383-D428 IonicContact NH1-OD2 3.06Å; R383-D428 IonicContact NH2-OD1 3.01Å; R383-D428 IonicContact NH2-OD2 3.34Å; R383-D428 PolarHBondContact NH2-OD2 3.11Å; R383-Y432 HydrophobicContact CB-CE1 4.11Å; R383-Y432 PolarHBondContact O-OH 2.77Å
384R83.8Confident80.7Confident47 Ų4731.9 Ų31.918%0.17717%0.173CC..Hα-helixtrans-66.9-47.8178.2-179.765.3-152.1-159.3-10.1112.1D378 T381 R382 A386 C387 D388D378-R384 WeakPolarHBondContact O-CB 3.23Å; D378-R384 WeakPolarHBondContact O-CG 3.46Å; D378-R384 WeakPolarHBondContact OD2-CD 3.33Å; T381-R384 PolarHBondContact O-N 2.8Å; T381-R384 WeakPolarHBondContact OG1-CB 3.38Å; T381-R384 PolarHBondContact OG1-N 2.95Å; R382-R384 VanDerWaalsContact C-N 3.32Å; R382-R384 PolarHBondContact O-N 3.23Å; R384-A386 VanDerWaalsContact C-N 3.31Å; R384-A386 PolarHBondContact O-N 2.68Å; R384-C387 VanDerWaalsContact O-CB 3.27Å; R384-C387 WeakPolarHBondContact O-CB 3.34Å; R384-C387 PolarHBondContact O-N 2.91Å; R384-C387 VanDerWaalsContact O-N 3.12Å; R384-D388 IonicContact CZ-OD1 3.89Å; R384-D388 IonicContact CZ-OD2 3.19Å; R384-D388 IonicContact NE-OD1 3.56Å; R384-D388 PolarHBondContact NE-OD1 3.5Å; R384-D388 IonicContact NE-OD2 2.67Å; R384-D388 PolarHBondContact NE-OD2 3.49Å; R384-D388 IonicContact NH2-OD1 3.43Å; R384-D388 PolarHBondContact NH2-OD1 3.37Å; R384-D388 IonicContact NH2-OD2 2.99Å; R384-D388 PolarHBondContact O-N 2.73Å
385A88.3Confident80.9Confident5 Ų536 Ų364%0.04119%0.19CC..Hα-helixtrans-59.2-44.1177.500000111.1I318 T381 R382 C387 D388 L389I318-A385 HydrophobicContact CB-CB 3.88Å; I318-A385 HydrophobicContact CD1-CB 4.39Å; I318-A385 HydrophobicContact CG2-CB 3.77Å; I318-A385 WeakPolarHBondContact CG2-O 3.27Å; T381-A385 PolarHBondContact O-N 3.17Å; R382-A385 PolarHBondContact O-N 3.02Å; A385-C387 VanDerWaalsContact C-N 3.33Å; A385-C387 PolarHBondContact O-N 3.19Å; A385-D388 PolarHBondContact O-N 3.45Å; A385-L389 PolarHBondContact O-N 2.77Å
386A89.9Confident81.7Confident0 Ų034.9 Ų34.90%018%0.184CC..Hα-helixtrans-60.6-40.6175.200000112I348 N351 M352 R382 R384 L389 V390I348-A386 HydrophobicContact CG2-CB 4.34Å; N351-A386 HydrophobicContact CB-CB 4.21Å; M352-A386 HydrophobicContact CG-CB 3.97Å; R382-A386 VanDerWaalsContact O-CB 3.28Å; R382-A386 WeakPolarHBondContact O-CB 3.43Å; R382-A386 PolarHBondContact O-N 3.28Å; R384-A386 VanDerWaalsContact C-N 3.31Å; R384-A386 PolarHBondContact O-N 2.68Å; A386-L389 PolarHBondContact O-N 2.77Å; A386-V390 WeakPolarHBondContact O-CG2 3.46Å; A386-V390 PolarHBondContact O-N 3.29Å
387C86.3Confident82.9Confident5 Ų533.8 Ų33.83%0.03417%0.169CC..Hα-helixtrans-60.7-46.1173.6-173.40000112.2M352 R383 R384 A385 L389 V390 R391 Y432 S436M352-C387 HydrophobicContact CE-CB 4.39Å; R383-C387 WeakPolarHBondContact O-CB 3.29Å; R383-C387 PolarHBondContact O-N 3.1Å; R384-C387 VanDerWaalsContact O-CB 3.27Å; R384-C387 WeakPolarHBondContact O-CB 3.34Å; R384-C387 PolarHBondContact O-N 2.91Å; R384-C387 VanDerWaalsContact O-N 3.12Å; A385-C387 VanDerWaalsContact C-N 3.33Å; A385-C387 PolarHBondContact O-N 3.19Å; C387-L389 VanDerWaalsContact C-N 3.31Å; C387-L389 PolarHBondContact O-N 2.93Å; C387-V390 WeakPolarHBondContact O-CB 3.23Å; C387-V390 PolarHBondContact O-N 3.36Å; C387-R391 WeakPolarHBondContact O-CG 3.42Å; C387-R391 PolarHBondContact O-N 2.87Å; C387-R391 PolarHBondContact SG-NH2 2.62Å; C387-Y432 HydrophobicContact CB-CE1 4.27Å; C387-S436 WeakPolarHBondContact SG-CB 3.39Å; C387-S436 PolarHBondContact SG-OG 2.62Å
388D87.1Confident84.4Confident41 Ų4133.7 Ų33.722%0.21916%0.162CC..Hα-helixtrans-65.8-35.2179.2-69.4-29.3000111.1R384 A385 R391 G392R384-D388 IonicContact CZ-OD1 3.89Å; R384-D388 IonicContact CZ-OD2 3.19Å; R384-D388 IonicContact NE-OD1 3.56Å; R384-D388 PolarHBondContact NE-OD1 3.5Å; R384-D388 IonicContact NE-OD2 2.67Å; R384-D388 PolarHBondContact NE-OD2 3.49Å; R384-D388 IonicContact NH2-OD1 3.43Å; R384-D388 PolarHBondContact NH2-OD1 3.37Å; R384-D388 IonicContact NH2-OD2 2.99Å; R384-D388 PolarHBondContact O-N 2.73Å; A385-D388 PolarHBondContact O-N 3.45Å; D388-R391 PolarHBondContact O-N 3.29Å; D388-R391 IonicContact OD1-CZ 3.65Å; D388-R391 VanDerWaalsContact OD1-CZ 3.29Å; D388-R391 IonicContact OD1-NH1 3.29Å; D388-R391 PolarHBondContact OD1-NH1 3.49Å; D388-R391 IonicContact OD1-NH2 3.84Å; D388-G392 PolarHBondContact O-N 2.9Å
389L90.9Very high85.7Confident1 Ų134.9 Ų34.91%0.00518%0.177CC..Hα-helixtrans-64.7-40.9171.2-179.460.8000112.8I318 L321 A322 I343 V347 I348 A385 A386 C387 R391 G392 L393I318-L389 HydrophobicContact CG2-CB 3.7Å; I318-L389 HydrophobicContact CG2-CD2 3.97Å; I318-L389 HydrophobicContact CG2-CG 4.41Å; L321-L389 HydrophobicContact CB-CD1 4.03Å; A322-L389 HydrophobicContact CB-CB 4.24Å; A322-L389 HydrophobicContact CB-CD1 4.23Å; I343-L389 HydrophobicContact CG2-CD2 3.95Å; V347-L389 HydrophobicContact CG1-CD2 4.31Å; I348-L389 HydrophobicContact CD1-CD2 4.01Å; I348-L389 HydrophobicContact CD1-CG 4.05Å; I348-L389 HydrophobicContact CG1-CD2 3.82Å; I348-L389 HydrophobicContact CG1-CG 4.31Å; A385-L389 PolarHBondContact O-N 2.77Å; A386-L389 PolarHBondContact O-N 2.77Å; C387-L389 VanDerWaalsContact C-N 3.31Å; C387-L389 PolarHBondContact O-N 2.93Å; L389-R391 VanDerWaalsContact C-N 3.32Å; L389-R391 PolarHBondContact O-N 3.03Å; L389-G392 PolarHBondContact O-N 3.2Å; L389-L393 HydrophobicContact CD1-CD1 4.28Å; L389-L393 HydrophobicContact CD1-CG 4.18Å; L389-L393 HydrophobicContact CG-CD1 4.16Å; L389-L393 WeakPolarHBondContact O-CG 3.43Å; L389-L393 PolarHBondContact O-N 3.14Å
390V90.4Very high87.2Confident0 Ų033.6 Ų33.60%018%0.175CC..Hα-helixtrans-57.4-47.2172.9171.10000110.3I348 M352 A386 C387 L393 C394 F405 L437I348-V390 HydrophobicContact CD1-CG2 3.93Å; I348-V390 HydrophobicContact CG2-CG2 3.58Å; M352-V390 HydrophobicContact CE-CG2 4.13Å; A386-V390 WeakPolarHBondContact O-CG2 3.46Å; A386-V390 PolarHBondContact O-N 3.29Å; C387-V390 WeakPolarHBondContact O-CB 3.23Å; C387-V390 PolarHBondContact O-N 3.36Å; V390-L393 PolarHBondContact O-N 3.4Å; V390-C394 WeakPolarHBondContact O-CB 3.45Å; V390-C394 PolarHBondContact O-N 3.3Å; V390-C394 PolarHBondContact O-SG 2.99Å; V390-C394 VanDerWaalsContact O-SG 3.35Å; V390-F405 HydrophobicContact CG1-CE2 4.24Å; V390-F405 HydrophobicContact CG2-CE2 3.83Å; V390-F405 HydrophobicContact CG2-CZ 3.9Å; V390-L437 HydrophobicContact CG1-CD2 3.53Å; V390-L437 HydrophobicContact CG1-CG 4.06Å
391R87.1Confident88.5Confident63 Ų6329 Ų2924%0.23815%0.151CC..Hα-helixtrans-63.4-43.5179.1-66-174.3-147.3137.68.1111.9C387 D388 L389 L393 C394 K395C387-R391 WeakPolarHBondContact O-CG 3.42Å; C387-R391 PolarHBondContact O-N 2.87Å; C387-R391 PolarHBondContact SG-NH2 2.62Å; D388-R391 PolarHBondContact O-N 3.29Å; D388-R391 IonicContact OD1-CZ 3.65Å; D388-R391 VanDerWaalsContact OD1-CZ 3.29Å; D388-R391 IonicContact OD1-NH1 3.29Å; D388-R391 PolarHBondContact OD1-NH1 3.49Å; D388-R391 IonicContact OD1-NH2 3.84Å; L389-R391 VanDerWaalsContact C-N 3.32Å; L389-R391 PolarHBondContact O-N 3.03Å; R391-L393 PolarHBondContact O-N 3.29Å; R391-C394 PolarHBondContact O-N 3.25Å; R391-K395 PolarHBondContact O-N 2.76Å
392G89.2Confident89Confident0 Ų027.5 Ų27.50%014%0.141CC..Hα-helixtrans-59.6-45.9177.300000112.3D388 L389 K395D388-G392 PolarHBondContact O-N 2.9Å; L389-G392 PolarHBondContact O-N 3.2Å; G392-K395 WeakPolarHBondContact O-CB 3.48Å; G392-K395 PolarHBondContact O-N 3.5Å
393L90.8Very high89.1Confident0 Ų030.5 Ų30.50%017%0.166CC..Hα-helixtrans-65.4-41.5176.9-69.5170.8000112.3C325 F334 L340 I343 I348 L389 V390 R391 K395 F396 F397 V401C325-L393 HydrophobicContact CB-CD2 3.94Å; F334-L393 HydrophobicContact CB-CD2 4.46Å; F334-L393 HydrophobicContact CD1-CD2 4.27Å; F334-L393 HydrophobicContact CG-CD2 4.46Å; L340-L393 HydrophobicContact CD2-CD2 4.04Å; I343-L393 HydrophobicContact CG2-CD1 3.85Å; I348-L393 HydrophobicContact CD1-CD1 3.88Å; L389-L393 HydrophobicContact CD1-CD1 4.28Å; L389-L393 HydrophobicContact CD1-CG 4.18Å; L389-L393 HydrophobicContact CG-CD1 4.16Å; L389-L393 WeakPolarHBondContact O-CG 3.43Å; L389-L393 PolarHBondContact O-N 3.14Å; V390-L393 PolarHBondContact O-N 3.4Å; R391-L393 PolarHBondContact O-N 3.29Å; L393-K395 PolarHBondContact O-N 3.38Å; L393-K395 VanDerWaalsContact O-N 3.12Å; L393-F396 PolarHBondContact O-N 2.95Å; L393-F397 WeakPolarHBondContact O-CB 3.37Å; L393-F397 WeakPolarHBondContact O-CD2 3.38Å; L393-F397 PolarHBondContact O-N 3.04Å; L393-V401 HydrophobicContact CB-CG2 4.06Å
394C89.1Confident89.4Confident20 Ų2030.8 Ų30.814%0.13517%0.169CC..Hα-helixtrans-60.9-20.7178.1-78.90000113.2V390 R391 F396 E398V390-C394 WeakPolarHBondContact O-CB 3.45Å; V390-C394 PolarHBondContact O-N 3.3Å; V390-C394 PolarHBondContact O-SG 2.99Å; V390-C394 VanDerWaalsContact O-SG 3.35Å; R391-C394 PolarHBondContact O-N 3.25Å; C394-F396 VanDerWaalsContact C-N 3.28Å; C394-F396 PolarHBondContact O-N 3.23Å; C394-E398 WeakPolarHBondContact O-CA 3.43Å; C394-E398 WeakPolarHBondContact O-CB 3.38Å; C394-E398 PolarHBondContact O-N 3.47Å
395K88.1Confident89.7Confident121 Ų12128.5 Ų28.553%0.52616%0.161SC..Hα-helixtrans-58.7-37177.4-167.2178.4-176.5-179.20113.4E326 R391 G392 L393E326-K395 HydrophobicContact CB-CD 4.14Å; E326-K395 HydrophobicContact CG-CD 4.13Å; E326-K395 PolarHBondContact O-NZ 2.96Å; R391-K395 PolarHBondContact O-N 2.76Å; G392-K395 WeakPolarHBondContact O-CB 3.48Å; G392-K395 PolarHBondContact O-N 3.5Å; L393-K395 PolarHBondContact O-N 3.38Å; L393-K395 VanDerWaalsContact O-N 3.12Å
396F90.3Very high89.8Confident69 Ų6930.6 Ų30.630%0.30318%0.175SC..Hα-helixtrans-118.7-15.3179.2-58.8-61.9000114C325 E326 P328 K331 L393 C394C325-F396 VanDerWaalsContact O-CD2 3.3Å; C325-F396 WeakPolarHBondContact O-CD2 3.3Å; C325-F396 WeakPolarHBondContact O-CE2 3.23Å; E326-F396 VanDerWaalsContact C-CE2 3.47Å; E326-F396 WeakPolarHBondContact O-CE2 3.26Å; P328-F396 HydrophobicContact CB-CZ 4.24Å; P328-F396 HydrophobicContact CG-CE1 4.31Å; P328-F396 HydrophobicContact CG-CZ 3.78Å; K331-F396 HydrophobicContact CD-CB 4.42Å; K331-F396 HydrophobicContact CG-CB 4.4Å; L393-F396 PolarHBondContact O-N 2.95Å; C394-F396 VanDerWaalsContact C-N 3.28Å; C394-F396 PolarHBondContact O-N 3.23Å
397F90.8Very high89.8Confident13 Ų1332.7 Ų32.76%0.05720%0.196CC..Hα-helixtrans-128.130.6-173.3-51.1-73.4000112.7K331 F334 E335 L340 L393 G399 P400 V401K331-F397 HydrophobicContact CD-CE1 4.48Å; K331-F397 HydrophobicContact CD-CZ 4.32Å; K331-F397 HydrophobicContact CG-CE1 4Å; K331-F397 HydrophobicContact CG-CE2 4.15Å; K331-F397 HydrophobicContact CG-CZ 3.4Å; F334-F397 HydrophobicContact CB-CE2 3.81Å; F334-F397 HydrophobicContact CB-CZ 4.14Å; E335-F397 HydrophobicContact CB-CE1 4.13Å; E335-F397 HydrophobicContact CB-CZ 4.25Å; E335-F397 HydrophobicContact CG-CE1 4.23Å; L340-F397 HydrophobicContact CD1-CB 4.35Å; L340-F397 HydrophobicContact CD1-CD1 4.14Å; L340-F397 HydrophobicContact CD1-CG 4.19Å; L340-F397 HydrophobicContact CD2-CD2 4.25Å; L340-F397 HydrophobicContact CD2-CG 4.39Å; L393-F397 WeakPolarHBondContact O-CB 3.37Å; L393-F397 WeakPolarHBondContact O-CD2 3.38Å; L393-F397 PolarHBondContact O-N 3.04Å; F397-G399 VanDerWaalsContact C-N 3.33Å; F397-G399 PolarHBondContact O-N 3.42Å; F397-P400 WeakPolarHBondContact O-CD 3.46Å; F397-V401 HydrophobicContact CB-CG2 3.75Å; F397-V401 VanDerWaalsContact O-CB 3.28Å; F397-V401 WeakPolarHBondContact O-CB 3.4Å; F397-V401 VanDerWaalsContact O-CG2 3.22Å; F397-V401 WeakPolarHBondContact O-CG2 3.44Å; F397-V401 PolarHBondContact O-N 3.24Å
398E89.2Confident90Very high57 Ų5735.3 Ų35.327%0.26621%0.206SC..Hα-helixtrans-47.4-50.1-176.3-172.5165-134.500113.1C394 T402 K440 N452 L454C394-E398 WeakPolarHBondContact O-CA 3.43Å; C394-E398 WeakPolarHBondContact O-CB 3.38Å; C394-E398 PolarHBondContact O-N 3.47Å; E398-T402 WeakPolarHBondContact O-CB 3.43Å; E398-T402 PolarHBondContact O-N 3.44Å; E398-T402 PolarHBondContact O-OG1 3.36Å; E398-K440 WeakPolarHBondContact OE1-CE 3.38Å; E398-K440 IonicContact OE1-NZ 3.86Å; E398-K440 PolarHBondContact OE1-NZ 3.01Å; E398-K440 IonicContact OE2-NZ 3.66Å; E398-K440 PolarHBondContact OE2-NZ 3.05Å; E398-N452 PolarHBondContact OE1-ND2 3.27Å; E398-N452 PolarHBondContact OE1-OD1 3.2Å; E398-L454 HydrophobicContact CG-CD1 4.02Å
399G90.9Very high90.3Very high39 Ų3933.8 Ų33.840%0.40220%0.198SC..Hα-helixtrans-62-61.7-179.600000113.4F397 V401 T402 A403F397-G399 VanDerWaalsContact C-N 3.33Å; F397-G399 PolarHBondContact O-N 3.42Å; G399-V401 PolarHBondContact O-N 3.49Å; G399-T402 PolarHBondContact O-N 3.09Å; G399-A403 WeakPolarHBondContact O-CB 3.13Å; G399-A403 PolarHBondContact O-N 3.37Å
400P90.9Very high90.4Very high68 Ų6838.9 Ų38.944%0.44223%0.225SC..Hα-helixtrans-55.3-46.2178.7-27.934.6000113.5L340 F397 A403 I404L340-P400 HydrophobicContact CD1-CB 4.47Å; F397-P400 WeakPolarHBondContact O-CD 3.46Å; P400-A403 PolarHBondContact O-N 3.43Å; P400-I404 VanDerWaalsContact O-CG1 3.23Å; P400-I404 WeakPolarHBondContact O-CG1 3.39Å; P400-I404 PolarHBondContact O-N 2.94Å
401V91.1Very high90.5Very high0 Ų042 Ų420%025%0.247CC..Hα-helixtrans-65-44.8-178.8174.80000110.8L340 L393 F397 G399 A403 I404 F405 L437L340-V401 HydrophobicContact CD2-CG2 4.44Å; L393-V401 HydrophobicContact CB-CG2 4.06Å; F397-V401 HydrophobicContact CB-CG2 3.75Å; F397-V401 VanDerWaalsContact O-CB 3.28Å; F397-V401 WeakPolarHBondContact O-CB 3.4Å; F397-V401 VanDerWaalsContact O-CG2 3.22Å; F397-V401 WeakPolarHBondContact O-CG2 3.44Å; F397-V401 PolarHBondContact O-N 3.24Å; G399-V401 PolarHBondContact O-N 3.49Å; V401-A403 VanDerWaalsContact C-N 3.31Å; V401-A403 PolarHBondContact O-N 3.12Å; V401-I404 PolarHBondContact O-N 2.65Å; V401-F405 HydrophobicContact CG1-CD2 3.54Å; V401-F405 HydrophobicContact CG1-CE2 3.48Å; V401-F405 VanDerWaalsContact CG1-CE2 3.48Å; V401-F405 VanDerWaalsContact O-CD2 3.27Å; V401-F405 WeakPolarHBondContact O-CD2 3.18Å; V401-F405 PolarHBondContact O-N 2.91Å; V401-L437 HydrophobicContact CG1-CD2 4.28Å
402T90.5Very high90.8Very high6 Ų639.9 Ų39.94%0.03724%0.24CC..Hα-helixtrans-61.5-40.6176.1-57.30000111.2E398 G399 S406 N452 L454 V455E398-T402 WeakPolarHBondContact O-CB 3.43Å; E398-T402 PolarHBondContact O-N 3.44Å; E398-T402 PolarHBondContact O-OG1 3.36Å; G399-T402 PolarHBondContact O-N 3.09Å; T402-S406 WeakPolarHBondContact O-CB 3.43Å; T402-S406 PolarHBondContact O-N 3.03Å; T402-S406 PolarHBondContact O-OG 3.37Å; T402-N452 PolarHBondContact OG1-ND2 3.02Å; T402-L454 HydrophobicContact CG2-CB 3.9Å; T402-L454 HydrophobicContact CG2-CD1 4.26Å; T402-V455 HydrophobicContact CG2-CG2 4.4Å
403A90.5Very high91.1Very high65 Ų6540.7 Ų40.754%0.53725%0.245SC..Hα-helixtrans-66.2-44.8179.500000112.3G399 P400 V401 S406 G407G399-A403 WeakPolarHBondContact O-CB 3.13Å; G399-A403 PolarHBondContact O-N 3.37Å; P400-A403 PolarHBondContact O-N 3.43Å; V401-A403 VanDerWaalsContact C-N 3.31Å; V401-A403 PolarHBondContact O-N 3.12Å; A403-S406 PolarHBondContact O-N 2.74Å; A403-G407 PolarHBondContact O-N 3.4Å
404I91.2Very high91.3Very high26 Ų2643.8 Ų43.813%0.13327%0.266CS..Hα-helixtrans-58.2-54.1177-70.5167.5000109.8L340 C344 P400 V401 S406 G407 Y408L340-I404 HydrophobicContact CB-CD1 4.31Å; C344-I404 HydrophobicContact CB-CG2 3.66Å; P400-I404 VanDerWaalsContact O-CG1 3.23Å; P400-I404 WeakPolarHBondContact O-CG1 3.39Å; P400-I404 PolarHBondContact O-N 2.94Å; V401-I404 PolarHBondContact O-N 2.65Å; I404-S406 PolarHBondContact O-N 3.16Å; I404-G407 PolarHBondContact O-N 2.85Å; I404-G407 VanDerWaalsContact O-N 3.14Å; I404-Y408 HydrophobicContact CG2-CD2 4.17Å; I404-Y408 HydrophobicContact CG2-CE2 3.59Å; I404-Y408 WeakPolarHBondContact O-CD2 3.49Å; I404-Y408 PolarHBondContact O-N 2.88Å
405F90.9Very high91.5Very high0 Ų045.9 Ų45.90%027%0.274CS..Hα-helixtrans-69.2-32.5-178.3-73.8-55.5000114.2C344 I348 V349 V390 V401 G407 Y408 V409 L433 L437C344-F405 HydrophobicContact CB-CD1 4.41Å; C344-F405 HydrophobicContact CB-CE1 3.68Å; C344-F405 HydrophobicContact CB-CE2 4.42Å; C344-F405 HydrophobicContact CB-CZ 3.69Å; C344-F405 VanDerWaalsContact SG-CZ 3.5Å; I348-F405 HydrophobicContact CB-CE1 4.31Å; I348-F405 HydrophobicContact CB-CZ 3.99Å; I348-F405 HydrophobicContact CD1-CE2 4.37Å; I348-F405 HydrophobicContact CD1-CZ 3.71Å; I348-F405 HydrophobicContact CG1-CZ 4.45Å; I348-F405 HydrophobicContact CG2-CE1 3.92Å; I348-F405 HydrophobicContact CG2-CZ 3.64Å; V349-F405 HydrophobicContact CG2-CE1 4.18Å; V390-F405 HydrophobicContact CG1-CE2 4.24Å; V390-F405 HydrophobicContact CG2-CE2 3.83Å; V390-F405 HydrophobicContact CG2-CZ 3.9Å; V401-F405 HydrophobicContact CG1-CD2 3.54Å; V401-F405 HydrophobicContact CG1-CE2 3.48Å; V401-F405 VanDerWaalsContact CG1-CE2 3.48Å; V401-F405 VanDerWaalsContact O-CD2 3.27Å; V401-F405 WeakPolarHBondContact O-CD2 3.18Å; V401-F405 PolarHBondContact O-N 2.91Å; F405-G407 PolarHBondContact O-N 3.5Å; F405-Y408 HydrophobicContact CD1-CD2 4.3Å; F405-Y408 PolarHBondContact O-N 3.32Å; F405-Y408 VanDerWaalsContact O-N 3.1Å; F405-V409 WeakPolarHBondContact O-CG2 3.35Å; F405-V409 PolarHBondContact O-N 3.24Å; F405-L433 HydrophobicContact CB-CD1 4.22Å; F405-L433 HydrophobicContact CB-CD2 3.99Å; F405-L433 HydrophobicContact CB-CG 4.25Å; F405-L433 HydrophobicContact CD1-CD1 3.56Å; F405-L433 HydrophobicContact CD1-CD2 3.59Å; F405-L433 HydrophobicContact CD1-CG 4.12Å; F405-L433 HydrophobicContact CD2-CD1 4.2Å; F405-L433 HydrophobicContact CE1-CD1 3.84Å; F405-L433 HydrophobicContact CE1-CD2 4.38Å; F405-L433 HydrophobicContact CE2-CD1 4.41Å; F405-L433 HydrophobicContact CG-CD1 3.75Å; F405-L433 HydrophobicContact CG-CD2 4.07Å; F405-L433 HydrophobicContact CG-CG 4.28Å; F405-L433 HydrophobicContact CZ-CD1 4.26Å; F405-L437 HydrophobicContact CB-CD1 3.42Å; F405-L437 VanDerWaalsContact CB-CD1 3.42Å; F405-L437 HydrophobicContact CB-CD2 4.33Å; F405-L437 HydrophobicContact CB-CG 4.43Å; F405-L437 HydrophobicContact CD2-CD1 4.17Å; F405-L437 HydrophobicContact CD2-CD2 3.63Å; F405-L437 HydrophobicContact CD2-CG 4.33Å; F405-L437 HydrophobicContact CE2-CD2 4.34Å; F405-L437 HydrophobicContact CG-CD1 4.06Å; F405-L437 HydrophobicContact CG-CD2 4.36Å
406S90.2Very high91.8Very high49 Ų4942 Ų4234%0.34326%0.256SS..Hα-helixtrans-58.8-34.7172.5-620000111.5T402 A403 I404 N410T402-S406 WeakPolarHBondContact O-CB 3.43Å; T402-S406 PolarHBondContact O-N 3.03Å; T402-S406 PolarHBondContact O-OG 3.37Å; A403-S406 PolarHBondContact O-N 2.74Å; I404-S406 PolarHBondContact O-N 3.16Å; S406-N410 VanDerWaalsContact O-CG 3.31Å; S406-N410 PolarHBondContact O-N 2.96Å; S406-N410 VanDerWaalsContact O-N 3.16Å; S406-N410 PolarHBondContact O-ND2 3.42Å; S406-N410 VanDerWaalsContact O-ND2 3.07Å
407G90.8Very high92Very high43 Ų4342.2 Ų42.244%0.44327%0.27SS..Hα-helixtrans-60.5-49.6170.800000113.1A403 I404 F405 N410 S411A403-G407 PolarHBondContact O-N 3.4Å; I404-G407 PolarHBondContact O-N 2.85Å; I404-G407 VanDerWaalsContact O-N 3.14Å; F405-G407 PolarHBondContact O-N 3.5Å; G407-N410 PolarHBondContact O-N 3.11Å; G407-S411 PolarHBondContact O-N 3.47Å
408Y90.6Very high92.2Very high60 Ų6048 Ų4824%0.23530%0.296CS..Hα-helixtrans-66.2-42.4178.4-66.3-73.2000112.8E345 V349 I404 F405 N410 S411 M412E345-Y408 HydrophobicContact CG-CE1 4.03Å; E345-Y408 HydrophobicContact CG-CE2 4.14Å; E345-Y408 VanDerWaalsContact CG-CZ 3.42Å; E345-Y408 WeakPolarHBondContact CG-OH 3.38Å; E345-Y408 PolarHBondContact OE1-OH 3.26Å; V349-Y408 HydrophobicContact CG2-CG 4.41Å; I404-Y408 HydrophobicContact CG2-CD2 4.17Å; I404-Y408 HydrophobicContact CG2-CE2 3.59Å; I404-Y408 WeakPolarHBondContact O-CD2 3.49Å; I404-Y408 PolarHBondContact O-N 2.88Å; F405-Y408 HydrophobicContact CD1-CD2 4.3Å; F405-Y408 PolarHBondContact O-N 3.32Å; F405-Y408 VanDerWaalsContact O-N 3.1Å; Y408-N410 VanDerWaalsContact C-N 3.3Å; Y408-N410 PolarHBondContact O-N 3.22Å; Y408-S411 WeakPolarHBondContact O-CB 3.46Å; Y408-S411 PolarHBondContact O-N 3.37Å; Y408-S411 VanDerWaalsContact O-N 3.11Å; Y408-M412 WeakPolarHBondContact O-CB 3.32Å; Y408-M412 VanDerWaalsContact O-CG 3.28Å; Y408-M412 WeakPolarHBondContact O-CG 3.28Å; Y408-M412 PolarHBondContact O-N 3.01Å
409V92.3Very high92.4Very high10 Ų1048.3 Ų48.36%0.06130%0.299CS..Hα-helixtrans-55.5-47.8176.4168.80000110.1F405 S411 M412 L413 A430 L433 V434 F460F405-V409 WeakPolarHBondContact O-CG2 3.35Å; F405-V409 PolarHBondContact O-N 3.24Å; V409-S411 PolarHBondContact O-N 2.9Å; V409-M412 PolarHBondContact O-N 3.37Å; V409-L413 HydrophobicContact CG1-CD1 3.71Å; V409-L413 HydrophobicContact CG1-CG 4.4Å; V409-L413 WeakPolarHBondContact O-CB 3.27Å; V409-L413 VanDerWaalsContact O-CG 3.23Å; V409-L413 WeakPolarHBondContact O-CG 3.48Å; V409-L413 PolarHBondContact O-N 3.11Å; V409-A430 HydrophobicContact CG1-CB 4.34Å; V409-L433 HydrophobicContact CG2-CB 4.39Å; V409-L433 HydrophobicContact CG2-CD2 3.68Å; V409-L433 HydrophobicContact CG2-CG 4.06Å; V409-V434 HydrophobicContact CB-CG2 4.46Å; V409-V434 HydrophobicContact CG1-CG2 3.8Å; V409-V434 HydrophobicContact CG2-CG2 3.79Å; V409-F460 HydrophobicContact CG1-CE2 4.45Å
410N92.8Very high92.4Very high108 Ų10848.7 Ų48.758%0.57830%0.295SS*.Hα-helixtrans-62.9-41.3177.4-73.2-32.6000112.3S406 G407 Y408 S414S406-N410 VanDerWaalsContact O-CG 3.31Å; S406-N410 PolarHBondContact O-N 2.96Å; S406-N410 VanDerWaalsContact O-N 3.16Å; S406-N410 PolarHBondContact O-ND2 3.42Å; S406-N410 VanDerWaalsContact O-ND2 3.07Å; G407-N410 PolarHBondContact O-N 3.11Å; Y408-N410 VanDerWaalsContact C-N 3.3Å; Y408-N410 PolarHBondContact O-N 3.22Å; N410-S414 WeakPolarHBondContact O-CB 3.38Å; N410-S414 PolarHBondContact O-N 3.13Å
411S93.6Very high92.3Very high65 Ų6547.6 Ų47.646%0.45530%0.295SS..Hα-helixtrans-62.4-48.7176.4-169.60000111.7G407 Y408 V409 L413 S414 E415G407-S411 PolarHBondContact O-N 3.47Å; Y408-S411 WeakPolarHBondContact O-CB 3.46Å; Y408-S411 PolarHBondContact O-N 3.37Å; Y408-S411 VanDerWaalsContact O-N 3.11Å; V409-S411 PolarHBondContact O-N 2.9Å; S411-L413 PolarHBondContact O-N 3.22Å; S411-S414 WeakPolarHBondContact O-CB 3.06Å; S411-S414 PolarHBondContact O-N 3.47Å; S411-E415 PolarHBondContact O-N 3.42Å
412M93.9Very high92.3Very high18 Ų1854.7 Ų54.79%0.08933%0.328CS..Hα-helixtrans-61-45.4179.5-73.2173.1172.800111.8V349 Y408 V409 S414 E415 Y416 H426 A429 A430V349-M412 HydrophobicContact CG1-CE 3.57Å; V349-M412 HydrophobicContact CG2-CE 4.42Å; Y408-M412 WeakPolarHBondContact O-CB 3.32Å; Y408-M412 VanDerWaalsContact O-CG 3.28Å; Y408-M412 WeakPolarHBondContact O-CG 3.28Å; Y408-M412 PolarHBondContact O-N 3.01Å; V409-M412 PolarHBondContact O-N 3.37Å; M412-S414 VanDerWaalsContact C-N 3.32Å; M412-S414 PolarHBondContact O-N 3.47Å; M412-E415 PolarHBondContact O-N 2.87Å; M412-Y416 PolarHBondContact O-N 3.28Å; M412-H426 HydrophobicContact CB-CB 4.1Å; M412-H426 WeakPolarHBondContact O-CB 2.84Å; M412-A429 HydrophobicContact CE-CB 4.35Å; M412-A429 HydrophobicContact SD-CB 4.1Å; M412-A430 HydrophobicContact CB-CB 4.11Å; M412-A430 HydrophobicContact SD-CB 4.41Å
413L94.5Very high92.4Very high18 Ų1856.1 Ų56.19%0.09434%0.336CS..Hα-helixtrans-65.7-35176.4-68.2171.1000112.1V409 S411 A417 K427 A430 F460V409-L413 HydrophobicContact CG1-CD1 3.71Å; V409-L413 HydrophobicContact CG1-CG 4.4Å; V409-L413 WeakPolarHBondContact O-CB 3.27Å; V409-L413 VanDerWaalsContact O-CG 3.23Å; V409-L413 WeakPolarHBondContact O-CG 3.48Å; V409-L413 PolarHBondContact O-N 3.11Å; S411-L413 PolarHBondContact O-N 3.22Å; L413-A417 PolarHBondContact O-N 3.44Å; L413-K427 HydrophobicContact CD2-CG 4.07Å; L413-A430 HydrophobicContact CD2-CB 3.98Å; L413-A430 HydrophobicContact CG-CB 3.99Å; L413-F460 HydrophobicContact CD1-CE2 4.29Å
414S95Very high92.6Very high65 Ų6554.6 Ų54.646%0.45532%0.316SS..Hα-helixtrans-68.1-38.7174.3-174.10000112.3N410 S411 M412 A417 K418N410-S414 WeakPolarHBondContact O-CB 3.38Å; N410-S414 PolarHBondContact O-N 3.13Å; S411-S414 WeakPolarHBondContact O-CB 3.06Å; S411-S414 PolarHBondContact O-N 3.47Å; M412-S414 VanDerWaalsContact C-N 3.32Å; M412-S414 PolarHBondContact O-N 3.47Å; S414-A417 PolarHBondContact O-N 2.83Å; S414-K418 PolarHBondContact O-N 3.37Å
415E94Very high92.7Very high64 Ų6456.2 Ų56.230%0.29932%0.322SS..Hα-helixtrans-67.8-40.4175.1-70.8-53.214400111.5S411 M412 A417 K418 N423S411-E415 PolarHBondContact O-N 3.42Å; M412-E415 PolarHBondContact O-N 2.87Å; E415-A417 VanDerWaalsContact C-N 3.33Å; E415-A417 PolarHBondContact O-N 2.98Å; E415-K418 PolarHBondContact O-N 3.06Å; E415-K418 IonicContact OE1-NZ 2.68Å; E415-K418 PolarHBondContact OE1-NZ 3.09Å; E415-K418 WeakPolarHBondContact OE2-CD 3.42Å; E415-K418 WeakPolarHBondContact OE2-CE 3.27Å; E415-K418 IonicContact OE2-NZ 3.82Å; E415-K418 PolarHBondContact OE2-NZ 3.1Å; E415-N423 PolarHBondContact O-ND2 3.1Å
416Y94.6Very high92.8Very high40 Ų4059.3 Ų59.316%0.15734%0.337CS..Hα-helixtrans-55.3-47.8171.6166.7-101.7000111.7M412 K418 N419 P420 K427 L480M412-Y416 PolarHBondContact O-N 3.28Å; Y416-K418 PolarHBondContact O-N 3.45Å; Y416-K418 VanDerWaalsContact O-N 3.13Å; Y416-N419 CarbonylContact O-C 3.45Å; Y416-N419 VanDerWaalsContact O-C 3.31Å; Y416-N419 PolarHBondContact O-N 2.82Å; Y416-P420 HydrophobicContact CD2-CB 4.29Å; Y416-P420 HydrophobicContact CE2-CB 3.64Å; Y416-P420 HydrophobicContact CE2-CG 4.32Å; Y416-P420 WeakPolarHBondContact O-CA 3.47Å; Y416-P420 WeakPolarHBondContact O-CD 3.45Å; Y416-P420 VanDerWaalsContact O-N 3.13Å; Y416-K427 HydrophobicContact CD1-CB 4.29Å; Y416-K427 HydrophobicContact CD1-CD 3.88Å; Y416-K427 HydrophobicContact CD2-CB 3.75Å; Y416-K427 HydrophobicContact CD2-CD 4.25Å; Y416-K427 HydrophobicContact CE1-CD 3.59Å; Y416-K427 HydrophobicContact CE2-CB 4.17Å; Y416-K427 HydrophobicContact CE2-CD 3.96Å; Y416-K427 HydrophobicContact CG-CB 3.8Å; Y416-K427 HydrophobicContact CG-CD 4.19Å; Y416-K427 HydrophobicContact CG-CG 4.49Å; Y416-L480 HydrophobicContact CE2-CD1 4.07Å
417A93.6Very high93.1Very high72 Ų7257.4 Ų57.460%0.59532%0.322SS*.Hα-helixtrans-61.7-23.2-177.700000114L413 S414 E415L413-A417 PolarHBondContact O-N 3.44Å; S414-A417 PolarHBondContact O-N 2.83Å; E415-A417 VanDerWaalsContact C-N 3.33Å; E415-A417 PolarHBondContact O-N 2.98Å
418K95.4Very high93.3Very high136 Ų13655.3 Ų55.359%0.59130%0.301SS*.Hα-helixtrans-72.1-39.6177.2-65.9176.6-165.9167.80112.6S414 E415 Y416S414-K418 PolarHBondContact O-N 3.37Å; E415-K418 PolarHBondContact O-N 3.06Å; E415-K418 IonicContact OE1-NZ 2.68Å; E415-K418 PolarHBondContact OE1-NZ 3.09Å; E415-K418 WeakPolarHBondContact OE2-CD 3.42Å; E415-K418 WeakPolarHBondContact OE2-CE 3.27Å; E415-K418 IonicContact OE2-NZ 3.82Å; E415-K418 PolarHBondContact OE2-NZ 3.1Å; Y416-K418 PolarHBondContact O-N 3.45Å; Y416-K418 VanDerWaalsContact O-N 3.13Å
419N93.5Very high93.3Very high62 Ų6252.6 Ų52.633%0.33229%0.291SS..  trans-154.283.4179.9-171.2-5.2000111.1Y416 G421 Q422 N423Y416-N419 CarbonylContact O-C 3.45Å; Y416-N419 VanDerWaalsContact O-C 3.31Å; Y416-N419 PolarHBondContact O-N 2.82Å; N419-G421 PolarHBondContact O-N 3Å; N419-G421 VanDerWaalsContact O-N 3.13Å; N419-G421 PolarHBondContact OD1-N 2.97Å; N419-Q422 VanDerWaalsContact ND2-CD 3.34Å; N419-Q422 PolarHBondContact ND2-OE1 3.45Å; N419-Q422 PolarHBondContact O-N 3.39Å; N419-N423 WeakPolarHBondContact O-CB 3.21Å; N419-N423 PolarHBondContact O-N 2.98Å
420P90.4Very high93.4Very high48 Ų4852.1 Ų52.131%0.31229%0.288SS..Hα-helixtrans-54.8-34.7-177.3-30.637.5000114Y416 Q422 W424Y416-P420 HydrophobicContact CD2-CB 4.29Å; Y416-P420 HydrophobicContact CE2-CB 3.64Å; Y416-P420 HydrophobicContact CE2-CG 4.32Å; Y416-P420 WeakPolarHBondContact O-CA 3.47Å; Y416-P420 WeakPolarHBondContact O-CD 3.45Å; Y416-P420 VanDerWaalsContact O-N 3.13Å; P420-Q422 PolarHBondContact O-N 3.42Å; P420-W424 WeakPolarHBondContact O-CB 3.49Å; P420-W424 PolarHBondContact O-N 3.42Å
421G89.1Confident93.4Very high44 Ų4447.2 Ų47.245%0.45426%0.261SS..Hα-helixtrans-63.9-36.6-178.700000114.2N419N419-G421 PolarHBondContact O-N 3Å; N419-G421 VanDerWaalsContact O-N 3.13Å; N419-G421 PolarHBondContact OD1-N 2.97Å
422Q90.7Very high93.3Very high149 Ų14945.5 Ų45.570%0.69625%0.245SC*.Hα-helixtrans-97.3-32179.2-70.5-178.6-6.500112.6N419 P420N419-Q422 VanDerWaalsContact ND2-CD 3.34Å; N419-Q422 PolarHBondContact ND2-OE1 3.45Å; N419-Q422 PolarHBondContact O-N 3.39Å; P420-Q422 PolarHBondContact O-N 3.42Å
423N93.6Very high93.1Very high36 Ų3644.7 Ų44.719%0.19324%0.242CC..Hα-helixtrans-102.617.4-169.1-64.6-16000113.3E415 N419 K425 H426E415-N423 PolarHBondContact O-ND2 3.1Å; N419-N423 WeakPolarHBondContact O-CB 3.21Å; N419-N423 PolarHBondContact O-N 2.98Å; N423-K425 PolarHBondContact O-N 3.04Å; N423-H426 WeakPolarHBondContact O-CB 3.43Å; N423-H426 PolarHBondContact O-N 2.69Å; N423-H426 VanDerWaalsContact O-N 3.08Å
424W93.6Very high93Very high33 Ų3344.3 Ų44.313%0.12524%0.24CC..Hα-helixtrans-56-34.9179.769.3-97.7000112.9F354 P420 H426 K427 D428 F477 V479 L480F354-W424 HydrophobicContact CB-CZ3 4.45Å; F354-W424 AromaticContact CD1-CH2 3.64Å; F354-W424 HydrophobicContact CD1-CH2 3.64Å; F354-W424 HydrophobicContact CD1-CZ3 4.17Å; F354-W424 HydrophobicContact CE1-CH2 4.05Å; F354-W424 HydrophobicContact CG-CH2 4.18Å; F354-W424 HydrophobicContact CG-CZ3 4.26Å; P420-W424 WeakPolarHBondContact O-CB 3.49Å; P420-W424 PolarHBondContact O-N 3.42Å; W424-H426 PolarHBondContact O-N 3.02Å; W424-K427 WeakPolarHBondContact O-CB 3.31Å; W424-K427 PolarHBondContact O-N 2.68Å; W424-D428 PolarHBondContact O-N 2.67Å; W424-F477 HydrophobicContact CB-CD1 4.02Å; W424-F477 HydrophobicContact CB-CE1 4.3Å; W424-F477 HydrophobicContact CG-CD1 4.25Å; W424-V479 HydrophobicContact CE3-CB 4.4Å; W424-V479 HydrophobicContact CH2-CB 4.15Å; W424-V479 HydrophobicContact CH2-CG1 4.37Å; W424-V479 HydrophobicContact CH2-CG2 3.93Å; W424-V479 HydrophobicContact CZ3-CB 3.68Å; W424-V479 HydrophobicContact CZ3-CG1 3.72Å; W424-V479 HydrophobicContact CZ3-CG2 4Å; W424-L480 HydrophobicContact CB-CD1 3.87Å; W424-L480 HydrophobicContact CB-CG 4.42Å; W424-L480 HydrophobicContact CE3-CG 4.42Å
425K93.1Very high92.7Very high60 Ų6042.2 Ų42.226%0.26122%0.224SC..Hα-helixtrans-58.7-29.9177.7-62.9-172.5175.9-159.60113.4F354 E359 N423 K427 A429F354-K425 HydrophobicContact CB-CG 4.47Å; F354-K425 WeakPolarHBondContact O-CD 3.25Å; F354-K425 PolarHBondContact O-NZ 3.28Å; E359-K425 WeakPolarHBondContact OE2-CE 3.39Å; E359-K425 IonicContact OE2-NZ 2.7Å; E359-K425 PolarHBondContact OE2-NZ 2.51Å; N423-K425 PolarHBondContact O-N 3.04Å; K425-K427 VanDerWaalsContact C-N 3.33Å; K425-A429 WeakPolarHBondContact O-CB 3.39Å; K425-A429 PolarHBondContact O-N 2.99Å
426H93.7Very high92.4Very high66 Ų6639.4 Ų39.431%0.30621%0.212SC..Hα-helixtrans-67.5-35.9174.8-6783.7000111.6M412 N423 W424 A430M412-H426 HydrophobicContact CB-CB 4.1Å; M412-H426 WeakPolarHBondContact O-CB 2.84Å; N423-H426 WeakPolarHBondContact O-CB 3.43Å; N423-H426 PolarHBondContact O-N 2.69Å; N423-H426 VanDerWaalsContact O-N 3.08Å; W424-H426 PolarHBondContact O-N 3.02Å; H426-A430 VanDerWaalsContact O-CB 3.31Å; H426-A430 WeakPolarHBondContact O-CB 3.4Å; H426-A430 PolarHBondContact O-N 3Å
427K95.5Very high92.2Very high8 Ų838 Ų384%0.03521%0.207CC..Hα-helixtrans-72.4-40.7177.6-174.1173.7-177.8-173.90111.7L413 Y416 W424 K425 A430 I431 H464 D468 L480L413-K427 HydrophobicContact CD2-CG 4.07Å; Y416-K427 HydrophobicContact CD1-CB 4.29Å; Y416-K427 HydrophobicContact CD1-CD 3.88Å; Y416-K427 HydrophobicContact CD2-CB 3.75Å; Y416-K427 HydrophobicContact CD2-CD 4.25Å; Y416-K427 HydrophobicContact CE1-CD 3.59Å; Y416-K427 HydrophobicContact CE2-CB 4.17Å; Y416-K427 HydrophobicContact CE2-CD 3.96Å; Y416-K427 HydrophobicContact CG-CB 3.8Å; Y416-K427 HydrophobicContact CG-CD 4.19Å; Y416-K427 HydrophobicContact CG-CG 4.49Å; W424-K427 WeakPolarHBondContact O-CB 3.31Å; W424-K427 PolarHBondContact O-N 2.68Å; K425-K427 VanDerWaalsContact C-N 3.33Å; K427-A430 PolarHBondContact O-N 3.07Å; K427-I431 HydrophobicContact CG-CD1 4.02Å; K427-I431 HydrophobicContact CG-CG1 4.45Å; K427-I431 VanDerWaalsContact O-CG1 3.3Å; K427-I431 WeakPolarHBondContact O-CG1 3.32Å; K427-I431 PolarHBondContact O-N 3.37Å; K427-H464 WeakPolarHBondContact CE-O 3.14Å; K427-H464 PolarHBondContact NZ-O 2.89Å; K427-D468 WeakPolarHBondContact CE-OD2 3.14Å; K427-D468 IonicContact NZ-OD1 3.36Å; K427-D468 PolarHBondContact NZ-OD1 2.91Å; K427-D468 IonicContact NZ-OD2 3.29Å; K427-D468 PolarHBondContact NZ-OD2 3.23Å; K427-L480 HydrophobicContact CB-CD1 4.43Å; K427-L480 HydrophobicContact CB-CD2 3.92Å; K427-L480 HydrophobicContact CD-CD1 4.15Å; K427-L480 HydrophobicContact CD-CD2 4.4Å; K427-L480 HydrophobicContact CG-CD2 4.07Å
428D94.9Very high92Very high0 Ų034.5 Ų34.50%018%0.178CC..Hα-helixtrans-55.5-53.6171.3153.796.9000110.2F354 R383 W424 A430 I431 Y432 L480 D483F354-D428 WeakPolarHBondContact CB-OD2 3.46Å; F354-D428 WeakPolarHBondContact CD2-OD1 3.44Å; R383-D428 IonicContact CZ-OD2 3.43Å; R383-D428 IonicContact NH1-OD1 3.61Å; R383-D428 PolarHBondContact NH1-OD1 3.39Å; R383-D428 IonicContact NH1-OD2 3.06Å; R383-D428 IonicContact NH2-OD1 3.01Å; R383-D428 IonicContact NH2-OD2 3.34Å; R383-D428 PolarHBondContact NH2-OD2 3.11Å; W424-D428 PolarHBondContact O-N 2.67Å; D428-A430 VanDerWaalsContact C-N 3.27Å; D428-A430 PolarHBondContact O-N 3.1Å; D428-I431 PolarHBondContact O-N 3.24Å; D428-Y432 WeakPolarHBondContact O-CB 3.42Å; D428-Y432 PolarHBondContact O-N 3.26Å; D428-L480 HydrophobicContact CB-CD2 3.97Å; D428-D483 WeakPolarHBondContact CB-OD2 3.41Å; D428-D483 VanDerWaalsContact OD1-OD2 3.12Å
429A91.8Very high91.6Very high3 Ų328.6 Ų28.63%0.02515%0.154CC..Hα-helixtrans-59.1-39.6-179.500000111.8M412 K425 Y432 L433M412-A429 HydrophobicContact CE-CB 4.35Å; M412-A429 HydrophobicContact SD-CB 4.1Å; K425-A429 WeakPolarHBondContact O-CB 3.39Å; K425-A429 PolarHBondContact O-N 2.99Å; A429-Y432 PolarHBondContact O-N 3.01Å; A429-L433 VanDerWaalsContact O-CB 3.22Å; A429-L433 WeakPolarHBondContact O-CB 3.36Å; A429-L433 PolarHBondContact O-N 3.03Å
430A93.6Very high91.3Very high0 Ų030.4 Ų30.40%016%0.159CC..Hα-helixtrans-64.3-44.6175.200000112.6V409 M412 L413 H426 K427 D428 L433 V434V409-A430 HydrophobicContact CG1-CB 4.34Å; M412-A430 HydrophobicContact CB-CB 4.11Å; M412-A430 HydrophobicContact SD-CB 4.41Å; L413-A430 HydrophobicContact CD2-CB 3.98Å; L413-A430 HydrophobicContact CG-CB 3.99Å; H426-A430 VanDerWaalsContact O-CB 3.31Å; H426-A430 WeakPolarHBondContact O-CB 3.4Å; H426-A430 PolarHBondContact O-N 3Å; K427-A430 PolarHBondContact O-N 3.07Å; D428-A430 VanDerWaalsContact C-N 3.27Å; D428-A430 PolarHBondContact O-N 3.1Å; A430-L433 PolarHBondContact O-N 3.37Å; A430-V434 WeakPolarHBondContact O-CB 3.16Å; A430-V434 VanDerWaalsContact O-CG2 3.32Å; A430-V434 WeakPolarHBondContact O-CG2 3.36Å; A430-V434 PolarHBondContact O-N 3.43Å
431I93.9Very high91Very high4 Ų429.7 Ų29.72%0.02116%0.157CC..Hα-helixtrans-63.7-43.5177-67.3166.2000110.3K427 D428 V434 T435 F460 I465 D483 Y487K427-I431 HydrophobicContact CG-CD1 4.02Å; K427-I431 HydrophobicContact CG-CG1 4.45Å; K427-I431 VanDerWaalsContact O-CG1 3.3Å; K427-I431 WeakPolarHBondContact O-CG1 3.32Å; K427-I431 PolarHBondContact O-N 3.37Å; D428-I431 PolarHBondContact O-N 3.24Å; I431-V434 PolarHBondContact O-N 3.31Å; I431-T435 VanDerWaalsContact O-CB 3.31Å; I431-T435 WeakPolarHBondContact O-CB 3.41Å; I431-T435 PolarHBondContact O-N 3.42Å; I431-T435 PolarHBondContact O-OG1 3.32Å; I431-F460 HydrophobicContact CG1-CE1 4.15Å; I431-F460 HydrophobicContact CG1-CZ 4.11Å; I431-I465 HydrophobicContact CD1-CD1 3.97Å; I431-I465 HydrophobicContact CG1-CD1 4.03Å; I431-I465 HydrophobicContact CG2-CD1 4.11Å; I431-D483 HydrophobicContact CD1-CB 4.19Å; I431-D483 HydrophobicContact CG2-CB 4.19Å; I431-Y487 HydrophobicContact CG2-CD2 4.34Å
432Y90.6Very high90.8Very high29 Ų2932.3 Ų32.311%0.11416%0.157CC..Hα-helixtrans-63.6-43.4179-163.6-88.9000111.7M352 R383 C387 D428 A429 T435 S436M352-Y432 HydrophobicContact CE-CD1 3.85Å; M352-Y432 HydrophobicContact CE-CE1 3.99Å; M352-Y432 HydrophobicContact CG-CD1 4.27Å; M352-Y432 HydrophobicContact SD-CD1 4.32Å; R383-Y432 HydrophobicContact CB-CE1 4.11Å; R383-Y432 PolarHBondContact O-OH 2.77Å; C387-Y432 HydrophobicContact CB-CE1 4.27Å; D428-Y432 WeakPolarHBondContact O-CB 3.42Å; D428-Y432 PolarHBondContact O-N 3.26Å; A429-Y432 PolarHBondContact O-N 3.01Å; Y432-T435 PolarHBondContact O-N 3.43Å; Y432-S436 WeakPolarHBondContact O-CB 3.31Å; Y432-S436 PolarHBondContact O-N 2.86Å; Y432-S436 PolarHBondContact O-OG 3.3Å
433L90.4Very high90.5Very high2 Ų228.1 Ų28.11%0.0114%0.142CC..Hα-helixtrans-65.2-45.5177.6-179.958.5000112.1M352 F405 V409 A429 A430 T435 S436 L437M352-L433 HydrophobicContact CE-CD1 4.16Å; M352-L433 HydrophobicContact SD-CB 4.12Å; M352-L433 HydrophobicContact SD-CD1 3.66Å; M352-L433 HydrophobicContact SD-CG 4.45Å; F405-L433 HydrophobicContact CB-CD1 4.22Å; F405-L433 HydrophobicContact CB-CD2 3.99Å; F405-L433 HydrophobicContact CB-CG 4.25Å; F405-L433 HydrophobicContact CD1-CD1 3.56Å; F405-L433 HydrophobicContact CD1-CD2 3.59Å; F405-L433 HydrophobicContact CD1-CG 4.12Å; F405-L433 HydrophobicContact CD2-CD1 4.2Å; F405-L433 HydrophobicContact CE1-CD1 3.84Å; F405-L433 HydrophobicContact CE1-CD2 4.38Å; F405-L433 HydrophobicContact CE2-CD1 4.41Å; F405-L433 HydrophobicContact CG-CD1 3.75Å; F405-L433 HydrophobicContact CG-CD2 4.07Å; F405-L433 HydrophobicContact CG-CG 4.28Å; F405-L433 HydrophobicContact CZ-CD1 4.26Å; V409-L433 HydrophobicContact CG2-CB 4.39Å; V409-L433 HydrophobicContact CG2-CD2 3.68Å; V409-L433 HydrophobicContact CG2-CG 4.06Å; A429-L433 VanDerWaalsContact O-CB 3.22Å; A429-L433 WeakPolarHBondContact O-CB 3.36Å; A429-L433 PolarHBondContact O-N 3.03Å; A430-L433 PolarHBondContact O-N 3.37Å; L433-T435 VanDerWaalsContact C-N 3.32Å; L433-T435 PolarHBondContact O-N 3.31Å; L433-S436 WeakPolarHBondContact O-CB 3.46Å; L433-S436 PolarHBondContact O-N 3.48Å; L433-L437 HydrophobicContact CD1-CD1 3.97Å; L433-L437 HydrophobicContact CD1-CG 4.27Å; L433-L437 HydrophobicContact CG-CD1 3.9Å; L433-L437 WeakPolarHBondContact O-CB 3.45Å; L433-L437 WeakPolarHBondContact O-CD1 3.18Å; L433-L437 WeakPolarHBondContact O-CG 3.25Å; L433-L437 PolarHBondContact O-N 3.47Å
434V91.9Very high89.8Confident9 Ų933.3 Ų33.36%0.05517%0.165CC..Hα-helixtrans-60.7-43.3174.6168.60000111.1V409 A430 I431 S436 L437 A438 V455 F460V409-V434 HydrophobicContact CB-CG2 4.46Å; V409-V434 HydrophobicContact CG1-CG2 3.8Å; V409-V434 HydrophobicContact CG2-CG2 3.79Å; A430-V434 WeakPolarHBondContact O-CB 3.16Å; A430-V434 VanDerWaalsContact O-CG2 3.32Å; A430-V434 WeakPolarHBondContact O-CG2 3.36Å; A430-V434 PolarHBondContact O-N 3.43Å; I431-V434 PolarHBondContact O-N 3.31Å; V434-S436 VanDerWaalsContact C-N 3.28Å; V434-S436 PolarHBondContact O-N 3.32Å; V434-L437 PolarHBondContact O-N 2.76Å; V434-A438 VanDerWaalsContact O-CB 3.27Å; V434-A438 WeakPolarHBondContact O-CB 3.3Å; V434-A438 PolarHBondContact O-N 2.57Å; V434-V455 HydrophobicContact CG1-CG1 3.98Å; V434-F460 HydrophobicContact CB-CE1 4.23Å; V434-F460 HydrophobicContact CB-CE2 4.24Å; V434-F460 HydrophobicContact CB-CZ 4.02Å; V434-F460 HydrophobicContact CG1-CD1 3.94Å; V434-F460 HydrophobicContact CG1-CD2 4.13Å; V434-F460 HydrophobicContact CG1-CE1 3.99Å; V434-F460 HydrophobicContact CG1-CE2 4.21Å; V434-F460 HydrophobicContact CG1-CG 4Å; V434-F460 HydrophobicContact CG1-CZ 4.13Å; V434-F460 HydrophobicContact CG2-CD2 4.19Å; V434-F460 HydrophobicContact CG2-CE2 3.67Å; V434-F460 HydrophobicContact CG2-CZ 3.86Å
435T89.9Confident89.2Confident22 Ų2238.9 Ų38.914%0.13519%0.19CC..Hα-helixtrans-60.4-41.3177.1-59.60000111.2I431 Y432 L433 S439 I490 F491I431-T435 VanDerWaalsContact O-CB 3.31Å; I431-T435 WeakPolarHBondContact O-CB 3.41Å; I431-T435 PolarHBondContact O-N 3.42Å; I431-T435 PolarHBondContact O-OG1 3.32Å; Y432-T435 PolarHBondContact O-N 3.43Å; L433-T435 VanDerWaalsContact C-N 3.32Å; L433-T435 PolarHBondContact O-N 3.31Å; T435-S439 WeakPolarHBondContact O-CB 3.13Å; T435-S439 PolarHBondContact O-N 2.97Å; T435-I490 HydrophobicContact CG2-CD1 4.21Å; T435-I490 HydrophobicContact CG2-CG2 4.22Å; T435-F491 HydrophobicContact CG2-CE2 3.83Å; T435-F491 HydrophobicContact CG2-CZ 4.07Å
436S87.8Confident88.8Confident5 Ų540.4 Ų40.44%0.03520%0.198CC..Hα-helixtrans-66.1-46178.1-58.50000112.4M352 C387 Y432 L433 V434 S439M352-S436 WeakPolarHBondContact CE-OG 3.38Å; C387-S436 WeakPolarHBondContact SG-CB 3.39Å; C387-S436 PolarHBondContact SG-OG 2.62Å; Y432-S436 WeakPolarHBondContact O-CB 3.31Å; Y432-S436 PolarHBondContact O-N 2.86Å; Y432-S436 PolarHBondContact O-OG 3.3Å; L433-S436 WeakPolarHBondContact O-CB 3.46Å; L433-S436 PolarHBondContact O-N 3.48Å; V434-S436 VanDerWaalsContact C-N 3.28Å; V434-S436 PolarHBondContact O-N 3.32Å; S436-S439 PolarHBondContact O-N 3.05Å
437L89.2Confident88.5Confident9 Ų937.6 Ų37.65%0.04719%0.187CC..Hα-helixtrans-68.8-35.7-179.7-73.7162.5000113.3V390 V401 F405 L433 V434 S439 N452 V455V390-L437 HydrophobicContact CG1-CD2 3.53Å; V390-L437 HydrophobicContact CG1-CG 4.06Å; V401-L437 HydrophobicContact CG1-CD2 4.28Å; F405-L437 HydrophobicContact CB-CD1 3.42Å; F405-L437 VanDerWaalsContact CB-CD1 3.42Å; F405-L437 HydrophobicContact CB-CD2 4.33Å; F405-L437 HydrophobicContact CB-CG 4.43Å; F405-L437 HydrophobicContact CD2-CD1 4.17Å; F405-L437 HydrophobicContact CD2-CD2 3.63Å; F405-L437 HydrophobicContact CD2-CG 4.33Å; F405-L437 HydrophobicContact CE2-CD2 4.34Å; F405-L437 HydrophobicContact CG-CD1 4.06Å; F405-L437 HydrophobicContact CG-CD2 4.36Å; L433-L437 HydrophobicContact CD1-CD1 3.97Å; L433-L437 HydrophobicContact CD1-CG 4.27Å; L433-L437 HydrophobicContact CG-CD1 3.9Å; L433-L437 WeakPolarHBondContact O-CB 3.45Å; L433-L437 WeakPolarHBondContact O-CD1 3.18Å; L433-L437 WeakPolarHBondContact O-CG 3.25Å; L433-L437 PolarHBondContact O-N 3.47Å; V434-L437 PolarHBondContact O-N 2.76Å; L437-S439 VanDerWaalsContact C-N 3.34Å; L437-N452 WeakPolarHBondContact O-CB 3.42Å; L437-N452 PolarHBondContact O-ND2 3.43Å; L437-V455 HydrophobicContact CB-CG2 4.38Å
438A89.8Confident88.3Confident0 Ų037.2 Ų37.20%019%0.185CC..Hα-helixtrans-77.9-21.4-179.800000112.6V434 K440 A451 N452 V455 L457 F491V434-A438 VanDerWaalsContact O-CB 3.27Å; V434-A438 WeakPolarHBondContact O-CB 3.3Å; V434-A438 PolarHBondContact O-N 2.57Å; A438-K440 PolarHBondContact O-N 3.4Å; A438-A451 CarbonylContact O-C 3.38Å; A438-A451 WeakPolarHBondContact O-CA 3.45Å; A438-A451 WeakPolarHBondContact O-CB 3.33Å; A438-N452 PolarHBondContact O-N 2.96Å; A438-V455 HydrophobicContact CB-CB 4.16Å; A438-V455 HydrophobicContact CB-CG1 4.05Å; A438-V455 HydrophobicContact CB-CG2 4.49Å; A438-L457 HydrophobicContact CB-CD2 3.57Å; A438-L457 HydrophobicContact CB-CG 4.37Å; A438-F491 HydrophobicContact CB-CE1 3.93Å; A438-F491 HydrophobicContact CB-CZ 3.81Å
439S87.9Confident88Confident11 Ų1139.5 Ų39.58%0.07720%0.199CC..EExtended strand (participates in β ladder)trans-81.9115-176.6-176.70000112.4T435 S436 L437 I448T435-S439 WeakPolarHBondContact O-CB 3.13Å; T435-S439 PolarHBondContact O-N 2.97Å; S436-S439 PolarHBondContact O-N 3.05Å; L437-S439 VanDerWaalsContact C-N 3.34Å; S439-I448 WeakPolarHBondContact OG-CD1 3.33Å
440K85.4Confident87.8Confident101 Ų10144.9 Ų44.944%0.43922%0.224SC..EExtended strand (participates in β ladder)trans-102.2-44.4170.9-69.7-171.8169.7-177.80112.9E398 A438 Q450E398-K440 WeakPolarHBondContact OE1-CE 3.38Å; E398-K440 IonicContact OE1-NZ 3.86Å; E398-K440 PolarHBondContact OE1-NZ 3.01Å; E398-K440 IonicContact OE2-NZ 3.66Å; E398-K440 PolarHBondContact OE2-NZ 3.05Å; A438-K440 PolarHBondContact O-N 3.4Å; K440-Q450 HydrophobicContact CB-CB 3.96Å; K440-Q450 WeakPolarHBondContact CB-O 3.31Å; K440-Q450 PolarHBondContact N-O 3.22Å
441A84.2Confident87.7Confident33 Ų3346.1 Ų46.127%0.27323%0.234SC..EExtended strand (participates in β ladder)trans-149.3142.5-179.800000110.9I448 T449 Q450A441-I448 CarbonylContact O-C 3.55Å; A441-T449 PolarHBondContact O-N 3.37Å; A441-T449 PolarHBondContact O-OG1 3.13Å; A441-Q450 HydrophobicContact CB-CB 4.01Å; A441-Q450 HydrophobicContact CB-CG 4.17Å; A441-Q450 PolarHBondContact N-O 3.39Å; A441-Q450 PolarHBondContact O-N 3.47Å
442Q85.8Confident87.4Confident98 Ų9846.1 Ų46.146%0.45823%0.234SC..EExtended strand (participates in β ladder)trans-139.9155.4-175.767.2176.7-6.800113.4G447 I448Q442-G447 CarbonylContact C-O 3.42Å; Q442-G447 VanDerWaalsContact CA-O 3.3Å; Q442-G447 WeakPolarHBondContact CA-O 3.47Å; Q442-I448 HydrophobicContact CB-CD1 3.68Å
443T84.4Confident87.2Confident61 Ų6153.6 Ų53.637%0.37427%0.27SS..EExtended strand (participates in β ladder)trans-135.9148.4168.664.10000109.5K445 H446 G447 T449T443-K445 PolarHBondContact O-N 3.41Å; T443-H446 PolarHBondContact O-N 3.5Å; T443-H446 WeakPolarHBondContact OG1-CB 3.43Å; T443-H446 PolarHBondContact OG1-N 2.9Å; T443-H446 VanDerWaalsContact OG1-N 3.1Å; T443-H446 PolarHBondContact OG1-ND1 3.24Å; T443-G447 PolarHBondContact N-O 3.36Å; T443-G447 WeakPolarHBondContact O-CA 3.44Å; T443-G447 PolarHBondContact O-N 2.87Å; T443-T449 HydrophobicContact CG2-CG2 4.03Å
444Q79.3Confident87Confident146 Ų14658.5 Ų58.568%0.68230%0.295SS*.THydrogen-bonded Turntrans-57-36.4176.6-72.2-172.1-5.400112.3R492 R528Q444-R492 PolarHBondContact O-NH2 2.79Å; Q444-R528 PolarHBondContact O-NH1 3.47Å
445K80.9Confident86.9Confident149 Ų14959.2 Ų59.265%0.64830%0.3SS*.THydrogen-bonded Turntrans-69.3-48.8-179.8-174173.6175.1-179.30112.5T443 R492T443-K445 PolarHBondContact O-N 3.41Å; K445-R492 VanDerWaalsContact C-NH2 3.29Å; K445-R492 PolarHBondContact O-NH2 2.99Å
446H83.8Confident86.9Confident93 Ų9362.3 Ų62.343%0.43132%0.316SS..THydrogen-bonded Turntrans-104.7-3.9-170.4-54.3102.4000114.9T443 T449 S493T443-H446 PolarHBondContact O-N 3.5Å; T443-H446 WeakPolarHBondContact OG1-CB 3.43Å; T443-H446 PolarHBondContact OG1-N 2.9Å; T443-H446 VanDerWaalsContact OG1-N 3.1Å; T443-H446 PolarHBondContact OG1-ND1 3.24Å; H446-T449 HydrophobicContact CB-CG2 4.01Å; H446-S493 VanDerWaalsContact O-CB 3.26Å; H446-S493 WeakPolarHBondContact O-CB 3.35Å; H446-S493 PolarHBondContact O-OG 3.29Å
447G88.1Confident87.1Confident6 Ų662.8 Ų62.86%0.06232%0.318CS..EExtended strand (participates in β ladder)trans69.1-142.2-170.700000110.1Q442 T443 T449 R492Q442-G447 CarbonylContact C-O 3.42Å; Q442-G447 VanDerWaalsContact CA-O 3.3Å; Q442-G447 WeakPolarHBondContact CA-O 3.47Å; T443-G447 PolarHBondContact N-O 3.36Å; T443-G447 WeakPolarHBondContact O-CA 3.44Å; T443-G447 PolarHBondContact O-N 2.87Å; G447-T449 PolarHBondContact O-N 3.21Å; G447-R492 VanDerWaalsContact N-CZ 3.31Å
448I90.3Very high87.3Confident1 Ų164.9 Ų64.91%0.00533%0.331CS..EExtended strand (participates in β ladder)trans-67.9112.1177.6-58.9-49.5000111.1S439 A441 Q442 Q450 A451 I490 F491 S493 K494S439-I448 WeakPolarHBondContact OG-CD1 3.33Å; A441-I448 CarbonylContact O-C 3.55Å; Q442-I448 HydrophobicContact CB-CD1 3.68Å; I448-Q450 WeakPolarHBondContact CG2-O 3.35Å; I448-A451 HydrophobicContact CG2-CB 4.25Å; I448-I490 HydrophobicContact CD1-CG2 3.76Å; I448-I490 HydrophobicContact CG1-CG2 3.4Å; I448-I490 PolarHBondContact N-O 2.81Å; I448-F491 HydrophobicContact CB-CD1 3.98Å; I448-F491 HydrophobicContact CB-CE1 4.15Å; I448-F491 HydrophobicContact CG1-CD1 3.79Å; I448-F491 HydrophobicContact CG1-CE1 3.68Å; I448-F491 HydrophobicContact CG1-CZ 4.36Å; I448-F491 HydrophobicContact CG2-CD1 4.27Å; I448-F491 HydrophobicContact CG2-CE1 4.13Å; I448-S493 PolarHBondContact O-OG 3.09Å; I448-K494 HydrophobicContact CB-CG 4.48Å; I448-K494 HydrophobicContact CG2-CG 4.34Å; I448-K494 WeakPolarHBondContact O-CE 3.21Å; I448-K494 WeakPolarHBondContact O-CG 3.42Å
449T89Confident87.5Confident47 Ų4770 Ų7029%0.28836%0.355SS..EExtended strand (participates in β ladder)trans-89.2-23.6179.258.70000113.3A441 T443 H446 G447 K494A441-T449 PolarHBondContact O-N 3.37Å; A441-T449 PolarHBondContact O-OG1 3.13Å; T443-T449 HydrophobicContact CG2-CG2 4.03Å; H446-T449 HydrophobicContact CB-CG2 4.01Å; G447-T449 PolarHBondContact O-N 3.21Å; T449-K494 WeakPolarHBondContact O-CE 3.33Å; T449-K494 PolarHBondContact O-NZ 3.24Å
450Q88.5Confident87.8Confident117 Ų11770.4 Ų70.455%0.54736%0.355SS..EExtended strand (participates in β ladder)trans-138.6134.9174.6-62.2-176.57.600109.3K440 A441 I448K440-Q450 HydrophobicContact CB-CB 3.96Å; K440-Q450 WeakPolarHBondContact CB-O 3.31Å; K440-Q450 PolarHBondContact N-O 3.22Å; A441-Q450 HydrophobicContact CB-CB 4.01Å; A441-Q450 HydrophobicContact CB-CG 4.17Å; A441-Q450 PolarHBondContact N-O 3.39Å; A441-Q450 PolarHBondContact O-N 3.47Å; I448-Q450 WeakPolarHBondContact CG2-O 3.35Å
451A89.8Confident88.3Confident25 Ų2565.6 Ų65.621%0.20733%0.334CS..EExtended strand (participates in β ladder)trans-123.9155.6-178.300000112.1A438 I448 E453 L457 K494A438-A451 CarbonylContact O-C 3.38Å; A438-A451 WeakPolarHBondContact O-CA 3.45Å; A438-A451 WeakPolarHBondContact O-CB 3.33Å; I448-A451 HydrophobicContact CG2-CB 4.25Å; A451-E453 PolarHBondContact O-N 3.45Å; A451-L457 HydrophobicContact CB-CD1 3.84Å; A451-K494 HydrophobicContact CB-CG 4.44Å
452N87.6Confident88.9Confident4 Ų467.1 Ų67.12%0.02134%0.34CS..  trans-70.7122.1171.7-176.6-5.7000110.4E398 T402 L437 A438 L454 V455E398-N452 PolarHBondContact OE1-ND2 3.27Å; E398-N452 PolarHBondContact OE1-OD1 3.2Å; T402-N452 PolarHBondContact OG1-ND2 3.02Å; L437-N452 WeakPolarHBondContact O-CB 3.42Å; L437-N452 PolarHBondContact O-ND2 3.43Å; A438-N452 PolarHBondContact O-N 2.96Å; N452-L454 PolarHBondContact O-N 3.21Å; N452-L454 VanDerWaalsContact OD1-CB 3.3Å; N452-L454 WeakPolarHBondContact OD1-CB 3.47Å; N452-L454 WeakPolarHBondContact OD1-CG 3.13Å; N452-L454 PolarHBondContact OD1-N 3.18Å; N452-V455 HydrophobicContact CB-CG2 4.41Å; N452-V455 PolarHBondContact O-N 3.31Å
453E86.8Confident89.3Confident187 Ų18766.4 Ų66.487%0.87434%0.339SS*.THydrogen-bonded Turntrans-70.9-18.8-178.5-61.7-177.117400112.9A451 V455A451-E453 PolarHBondContact O-N 3.45Å; E453-V455 PolarHBondContact O-N 2.97Å
454L87.4Confident89.9Confident104 Ų10466.1 Ų66.155%0.54533%0.333SS..THydrogen-bonded Turntrans-72.5-11.8175.1-57.3179.5000112.7E398 T402 N452E398-L454 HydrophobicContact CG-CD1 4.02Å; T402-L454 HydrophobicContact CG2-CB 3.9Å; T402-L454 HydrophobicContact CG2-CD1 4.26Å; N452-L454 PolarHBondContact O-N 3.21Å; N452-L454 VanDerWaalsContact OD1-CB 3.3Å; N452-L454 WeakPolarHBondContact OD1-CB 3.47Å; N452-L454 WeakPolarHBondContact OD1-CG 3.13Å; N452-L454 PolarHBondContact OD1-N 3.18Å
455V88.3Confident90.7Very high25 Ų2559.1 Ų59.115%0.15230%0.301CS..SBendtrans-109.6115.1179.4-176.40000109.8T402 V434 L437 A438 N452 E453 L457T402-V455 HydrophobicContact CG2-CG2 4.4Å; V434-V455 HydrophobicContact CG1-CG1 3.98Å; L437-V455 HydrophobicContact CB-CG2 4.38Å; A438-V455 HydrophobicContact CB-CB 4.16Å; A438-V455 HydrophobicContact CB-CG1 4.05Å; A438-V455 HydrophobicContact CB-CG2 4.49Å; N452-V455 HydrophobicContact CB-CG2 4.41Å; N452-V455 PolarHBondContact O-N 3.31Å; E453-V455 PolarHBondContact O-N 2.97Å; V455-L457 HydrophobicContact CG1-CD2 4.43Å; V455-L457 PolarHBondContact O-N 3.24Å
456N90.4Very high91.4Very high87 Ų8752.6 Ų52.647%0.46527%0.273SS..  trans-79.487.3177.6-169.6-13.7000111.5T458 E459 F460N456-T458 VanDerWaalsContact C-N 3.28Å; N456-T458 PolarHBondContact O-N 3.19Å; N456-T458 PolarHBondContact OD1-N 3.36Å; N456-E459 HydrophobicContact CB-CB 4Å; N456-E459 VanDerWaalsContact ND2-CB 3.35Å; N456-E459 WeakPolarHBondContact ND2-CB 3.18Å; N456-E459 PolarHBondContact ND2-OE2 3.27Å; N456-E459 PolarHBondContact O-N 3.11Å; N456-E459 PolarHBondContact OD1-N 3.31Å; N456-E459 VanDerWaalsContact OD1-N 3.14Å; N456-F460 WeakPolarHBondContact O-CB 3.26Å; N456-F460 PolarHBondContact O-N 3.31Å
457L93.1Very high92Very high15 Ų1551.2 Ų51.28%0.07927%0.272CS..Hα-helixtrans-58.5-36.7-178.5-69.6176.5000113.9A438 A451 V455 F461 Y487 F491 K494A438-L457 HydrophobicContact CB-CD2 3.57Å; A438-L457 HydrophobicContact CB-CG 4.37Å; A451-L457 HydrophobicContact CB-CD1 3.84Å; V455-L457 HydrophobicContact CG1-CD2 4.43Å; V455-L457 PolarHBondContact O-N 3.24Å; L457-F461 WeakPolarHBondContact O-CB 3.41Å; L457-F461 PolarHBondContact O-N 2.88Å; L457-Y487 WeakPolarHBondContact CA-OH 3.3Å; L457-Y487 VanDerWaalsContact CD2-OH 3.26Å; L457-Y487 WeakPolarHBondContact CD2-OH 3.4Å; L457-Y487 PolarHBondContact O-OH 2.87Å; L457-F491 HydrophobicContact CD1-CD1 3.57Å; L457-F491 HydrophobicContact CD1-CE1 3.84Å; L457-F491 HydrophobicContact CD1-CG 4.31Å; L457-F491 HydrophobicContact CD2-CD1 3.9Å; L457-F491 HydrophobicContact CD2-CD2 4.31Å; L457-F491 HydrophobicContact CD2-CE1 3.67Å; L457-F491 HydrophobicContact CD2-CE2 4.1Å; L457-F491 HydrophobicContact CD2-CG 4.22Å; L457-F491 HydrophobicContact CD2-CZ 3.8Å; L457-F491 HydrophobicContact CG-CD1 4.39Å; L457-F491 HydrophobicContact CG-CE1 4.43Å; L457-K494 HydrophobicContact CD1-CB 3.97Å; L457-K494 HydrophobicContact CD1-CG 4.47Å
458T92.1Very high92.3Very high52 Ų5251.8 Ų51.832%0.31927%0.274SS..Hα-helixtrans-71.1-42.9-177.6-59.90000111N456 F461 V462 P496N456-T458 VanDerWaalsContact C-N 3.28Å; N456-T458 PolarHBondContact O-N 3.19Å; N456-T458 PolarHBondContact OD1-N 3.36Å; T458-F461 PolarHBondContact O-N 2.93Å; T458-V462 WeakPolarHBondContact O-CG2 3.34Å; T458-V462 PolarHBondContact O-N 3.11Å; T458-V462 VanDerWaalsContact O-N 3.1Å; T458-P496 HydrophobicContact CG2-CG 4.36Å
459E94.1Very high92.5Very high108 Ų10851.9 Ų51.951%0.50527%0.274SS..Hα-helixtrans-67.3-44.6176-179.9175.2-172.200111.4N456 F461 V462 N463N456-E459 HydrophobicContact CB-CB 4Å; N456-E459 VanDerWaalsContact ND2-CB 3.35Å; N456-E459 WeakPolarHBondContact ND2-CB 3.18Å; N456-E459 PolarHBondContact ND2-OE2 3.27Å; N456-E459 PolarHBondContact O-N 3.11Å; N456-E459 PolarHBondContact OD1-N 3.31Å; N456-E459 VanDerWaalsContact OD1-N 3.14Å; E459-F461 VanDerWaalsContact C-N 3.29Å; E459-F461 PolarHBondContact O-N 3.19Å; E459-V462 PolarHBondContact O-N 3.43Å; E459-N463 WeakPolarHBondContact CG-ND2 3.33Å; E459-N463 WeakPolarHBondContact O-CB 3.48Å; E459-N463 PolarHBondContact O-N 3.17Å
460F95.3Very high92.8Very high20 Ų2054.8 Ų54.89%0.08828%0.283CS..Hα-helixtrans-60.3-41.1176-167.4-94.5000111.7V409 L413 I431 V434 N456 H464 I465 Y487V409-F460 HydrophobicContact CG1-CE2 4.45Å; L413-F460 HydrophobicContact CD1-CE2 4.29Å; I431-F460 HydrophobicContact CG1-CE1 4.15Å; I431-F460 HydrophobicContact CG1-CZ 4.11Å; V434-F460 HydrophobicContact CB-CE1 4.23Å; V434-F460 HydrophobicContact CB-CE2 4.24Å; V434-F460 HydrophobicContact CB-CZ 4.02Å; V434-F460 HydrophobicContact CG1-CD1 3.94Å; V434-F460 HydrophobicContact CG1-CD2 4.13Å; V434-F460 HydrophobicContact CG1-CE1 3.99Å; V434-F460 HydrophobicContact CG1-CE2 4.21Å; V434-F460 HydrophobicContact CG1-CG 4Å; V434-F460 HydrophobicContact CG1-CZ 4.13Å; V434-F460 HydrophobicContact CG2-CD2 4.19Å; V434-F460 HydrophobicContact CG2-CE2 3.67Å; V434-F460 HydrophobicContact CG2-CZ 3.86Å; N456-F460 WeakPolarHBondContact O-CB 3.26Å; N456-F460 PolarHBondContact O-N 3.31Å; F460-H464 AromaticContact CD2-CD2 3.56Å; F460-H464 HydrophobicContact CE1-CB 4.33Å; F460-H464 HydrophobicContact CE2-CB 4.32Å; F460-H464 AromaticContact CE2-CD2 3.61Å; F460-H464 HydrophobicContact CZ-CB 4.18Å; F460-H464 WeakPolarHBondContact O-CB 3Å; F460-H464 PolarHBondContact O-N 2.99Å; F460-I465 HydrophobicContact CD1-CD1 4.34Å; F460-I465 HydrophobicContact CD1-CG1 4.06Å; F460-I465 HydrophobicContact CE1-CD1 3.92Å; F460-I465 HydrophobicContact CE1-CG1 4.15Å; F460-I465 PolarHBondContact O-N 2.91Å; F460-Y487 HydrophobicContact CD1-CD2 4.5Å; F460-Y487 AromaticContact CD1-CE2 3.69Å; F460-Y487 HydrophobicContact CD1-CE2 3.69Å; F460-Y487 AromaticContact CD1-CZ 3.84Å; F460-Y487 HydrophobicContact CE1-CD2 4.5Å; F460-Y487 HydrophobicContact CE1-CE2 4.03Å
461F96.1Very high92.8Very high0 Ų050.9 Ų50.90%027%0.268CS..Iπ-helixtrans-57.9-50.8173.7174.1-99.8000111.8L457 T458 E459 N463 I465 L466 L469 Y487 V488 L495 Q499L457-F461 WeakPolarHBondContact O-CB 3.41Å; L457-F461 PolarHBondContact O-N 2.88Å; T458-F461 PolarHBondContact O-N 2.93Å; E459-F461 VanDerWaalsContact C-N 3.29Å; E459-F461 PolarHBondContact O-N 3.19Å; F461-N463 PolarHBondContact O-N 2.92Å; F461-I465 HydrophobicContact CD2-CB 3.8Å; F461-I465 HydrophobicContact CD2-CG2 3.68Å; F461-I465 HydrophobicContact CE2-CB 4.35Å; F461-I465 HydrophobicContact CE2-CG2 3.87Å; F461-I465 WeakPolarHBondContact O-CB 3.39Å; F461-I465 PolarHBondContact O-N 3.07Å; F461-L466 HydrophobicContact CE1-CB 4.16Å; F461-L466 HydrophobicContact CE1-CD1 4.26Å; F461-L466 HydrophobicContact CE1-CD2 4.41Å; F461-L466 HydrophobicContact CZ-CB 4.22Å; F461-L466 HydrophobicContact CZ-CD1 4.02Å; F461-L466 WeakPolarHBondContact O-CB 3.36Å; F461-L466 PolarHBondContact O-N 3.07Å; F461-L469 HydrophobicContact CE2-CD1 4.35Å; F461-Y487 HydrophobicContact CB-CE1 4.11Å; F461-Y487 HydrophobicContact CD2-CD1 4.37Å; F461-Y487 HydrophobicContact CD2-CE1 4.39Å; F461-V488 HydrophobicContact CD2-CG2 4.26Å; F461-V488 HydrophobicContact CE2-CG2 3.59Å; F461-L495 HydrophobicContact CB-CD2 3.99Å; F461-L495 HydrophobicContact CD2-CD1 4.27Å; F461-L495 HydrophobicContact CG-CD2 4.17Å; F461-Q499 HydrophobicContact CD1-CB 4.15Å; F461-Q499 HydrophobicContact CD1-CG 4.12Å; F461-Q499 HydrophobicContact CE1-CB 3.74Å; F461-Q499 HydrophobicContact CE1-CG 4Å; F461-Q499 HydrophobicContact CZ-CB 4.42Å
462V95.9Very high92.6Very high64 Ų6455.8 Ų55.839%0.38830%0.301SS..Iπ-helixtrans-65.5-40.8-176.8171.50000112.1T458 E459T458-V462 WeakPolarHBondContact O-CG2 3.34Å; T458-V462 PolarHBondContact O-N 3.11Å; T458-V462 VanDerWaalsContact O-N 3.1Å; E459-V462 PolarHBondContact O-N 3.43Å
463N95.2Very high92.8Very high84 Ų8459.3 Ų59.345%0.44932%0.32SS..Iπ-helixtrans-85.9-29.6-171.3-68.2-17.5000113.7E459 F461E459-N463 WeakPolarHBondContact CG-ND2 3.33Å; E459-N463 WeakPolarHBondContact O-CB 3.48Å; E459-N463 PolarHBondContact O-N 3.17Å; F461-N463 PolarHBondContact O-N 2.92Å
464H95.1Very high93Very high54 Ų5451.4 Ų51.425%0.2529%0.285CS..Iπ-helixtrans-124.1-35.9-170.3-60.1-61000114.5K427 F460K427-H464 WeakPolarHBondContact CE-O 3.14Å; K427-H464 PolarHBondContact NZ-O 2.89Å; F460-H464 AromaticContact CD2-CD2 3.56Å; F460-H464 HydrophobicContact CE1-CB 4.33Å; F460-H464 HydrophobicContact CE2-CB 4.32Å; F460-H464 AromaticContact CE2-CD2 3.61Å; F460-H464 HydrophobicContact CZ-CB 4.18Å; F460-H464 WeakPolarHBondContact O-CB 3Å; F460-H464 PolarHBondContact O-N 2.99Å
465I96.9Very high93.3Very high0 Ų049 Ų490%027%0.273CS..Iπ-helixtrans-88.5-49.3-175.9-55.7-59.6000111.8I431 F460 F461 P467 D468 L469 A484 Y487 V488I431-I465 HydrophobicContact CD1-CD1 3.97Å; I431-I465 HydrophobicContact CG1-CD1 4.03Å; I431-I465 HydrophobicContact CG2-CD1 4.11Å; F460-I465 HydrophobicContact CD1-CD1 4.34Å; F460-I465 HydrophobicContact CD1-CG1 4.06Å; F460-I465 HydrophobicContact CE1-CD1 3.92Å; F460-I465 HydrophobicContact CE1-CG1 4.15Å; F460-I465 PolarHBondContact O-N 2.91Å; F461-I465 HydrophobicContact CD2-CB 3.8Å; F461-I465 HydrophobicContact CD2-CG2 3.68Å; F461-I465 HydrophobicContact CE2-CB 4.35Å; F461-I465 HydrophobicContact CE2-CG2 3.87Å; F461-I465 WeakPolarHBondContact O-CB 3.39Å; F461-I465 PolarHBondContact O-N 3.07Å; I465-P467 VanDerWaalsContact C-CD 3.47Å; I465-D468 PolarHBondContact O-N 3.37Å; I465-D468 VanDerWaalsContact O-N 3.17Å; I465-L469 HydrophobicContact CG2-CD1 4.23Å; I465-L469 PolarHBondContact O-N 3.38Å; I465-A484 HydrophobicContact CG2-CB 3.87Å; I465-A484 WeakPolarHBondContact CG2-O 3.47Å; I465-Y487 HydrophobicContact CB-CD1 4.47Å; I465-Y487 HydrophobicContact CD1-CD1 4.33Å; I465-Y487 HydrophobicContact CD1-CD2 4.01Å; I465-Y487 HydrophobicContact CD1-CG 3.85Å; I465-Y487 HydrophobicContact CG1-CD1 3.78Å; I465-Y487 HydrophobicContact CG1-CD2 4.18Å; I465-Y487 HydrophobicContact CG1-CE1 4.08Å; I465-Y487 HydrophobicContact CG1-CE2 4.45Å; I465-Y487 HydrophobicContact CG1-CG 3.82Å; I465-Y487 HydrophobicContact CG2-CD1 4.2Å; I465-Y487 HydrophobicContact CG2-CG 4.47Å; I465-V488 HydrophobicContact CG2-CG2 4.36Å
466L96.1Very high93.6Very high12 Ų1251.9 Ų51.96%0.06328%0.284CS..Hα-helixtrans-60.1-37.5-178.2-176.663.5000113.6F461 D468 L469 K470 Q502 L506F461-L466 HydrophobicContact CE1-CB 4.16Å; F461-L466 HydrophobicContact CE1-CD1 4.26Å; F461-L466 HydrophobicContact CE1-CD2 4.41Å; F461-L466 HydrophobicContact CZ-CB 4.22Å; F461-L466 HydrophobicContact CZ-CD1 4.02Å; F461-L466 WeakPolarHBondContact O-CB 3.36Å; F461-L466 PolarHBondContact O-N 3.07Å; L466-D468 VanDerWaalsContact C-N 3.33Å; L466-D468 PolarHBondContact O-N 3.34Å; L466-L469 PolarHBondContact O-N 3.46Å; L466-K470 HydrophobicContact CD1-CD 4.35Å; L466-K470 HydrophobicContact CD1-CG 4.39Å; L466-K470 HydrophobicContact CG-CD 4.15Å; L466-K470 WeakPolarHBondContact O-CB 3.3Å; L466-K470 WeakPolarHBondContact O-CG 3.47Å; L466-K470 PolarHBondContact O-N 2.78Å; L466-K470 VanDerWaalsContact O-N 3.09Å; L466-Q502 HydrophobicContact CD1-CG 4.28Å; L466-L506 HydrophobicContact CD1-CD1 3.85Å
467P95.1Very high93.7Very high63 Ų6350.3 Ų50.341%0.40927%0.273SS..Hα-helixtrans-61.1-38.9174.3-25.436.8000113.3I465 K470 S471I465-P467 VanDerWaalsContact C-CD 3.47Å; P467-K470 PolarHBondContact O-N 2.78Å; P467-S471 PolarHBondContact O-N 2.7Å
468D94.6Very high93.8Very high18 Ų1851.2 Ų51.210%0.09628%0.28CS..Hα-helixtrans-67.8-40.6179.7-67-13000111K427 I465 L466 K470 S471 A484K427-D468 WeakPolarHBondContact CE-OD2 3.14Å; K427-D468 IonicContact NZ-OD1 3.36Å; K427-D468 PolarHBondContact NZ-OD1 2.91Å; K427-D468 IonicContact NZ-OD2 3.29Å; K427-D468 PolarHBondContact NZ-OD2 3.23Å; I465-D468 PolarHBondContact O-N 3.37Å; I465-D468 VanDerWaalsContact O-N 3.17Å; L466-D468 VanDerWaalsContact C-N 3.33Å; L466-D468 PolarHBondContact O-N 3.34Å; D468-K470 PolarHBondContact O-N 3.05Å; D468-S471 WeakPolarHBondContact O-CB 3.31Å; D468-S471 PolarHBondContact O-N 2.94Å; D468-A484 HydrophobicContact CB-CB 3.99Å
469L95.1Very high93.9Very high4 Ų449.1 Ų49.12%0.02127%0.267CS..Hα-helixtrans-67.2-22.6174.4-63.3177.5000113.4F461 I465 L466 A484 I485 V488 L506 H510F461-L469 HydrophobicContact CE2-CD1 4.35Å; I465-L469 HydrophobicContact CG2-CD1 4.23Å; I465-L469 PolarHBondContact O-N 3.38Å; L466-L469 PolarHBondContact O-N 3.46Å; L469-A484 HydrophobicContact CD2-CB 3.82Å; L469-A484 HydrophobicContact CG-CB 3.98Å; L469-I485 HydrophobicContact CD2-CG1 3.73Å; L469-V488 HydrophobicContact CD1-CG2 3.89Å; L469-L506 HydrophobicContact CB-CB 4.19Å; L469-L506 HydrophobicContact CB-CD1 3.72Å; L469-H510 PolarHBondContact O-NE2 2.78Å
470K94.8Very high94Very high108 Ų10844.1 Ų44.147%0.4724%0.244SC..THydrogen-bonded Turntrans-91.5-3.4178.8-78.4-179.4178.3171.60113.4L466 P467 D468 S472 L506L466-K470 HydrophobicContact CD1-CD 4.35Å; L466-K470 HydrophobicContact CD1-CG 4.39Å; L466-K470 HydrophobicContact CG-CD 4.15Å; L466-K470 WeakPolarHBondContact O-CB 3.3Å; L466-K470 WeakPolarHBondContact O-CG 3.47Å; L466-K470 PolarHBondContact O-N 2.78Å; L466-K470 VanDerWaalsContact O-N 3.09Å; P467-K470 PolarHBondContact O-N 2.78Å; D468-K470 PolarHBondContact O-N 3.05Å; K470-S472 PolarHBondContact O-N 3.47Å; K470-L506 HydrophobicContact CG-CD1 3.81Å; K470-L506 HydrophobicContact CG-CD2 4.17Å
471S88.9Confident94.1Very high34 Ų3443.4 Ų43.424%0.23824%0.241CC..  trans-56.4134.4-179.3-177.20000110.7P467 D468 N473P467-S471 PolarHBondContact O-N 2.7Å; D468-S471 WeakPolarHBondContact O-CB 3.31Å; D468-S471 PolarHBondContact O-N 2.94Å; S471-N473 VanDerWaalsContact C-N 3.32Å; S471-N473 PolarHBondContact O-N 3.29Å; S471-N473 PolarHBondContact OG-O 3.15Å
472S85.6Confident94.1Very high128 Ų12843.5 Ų43.590%0.89524%0.242SC*.SBendtrans-70.2-30.4-176.753.20000112.8K470K470-S472 PolarHBondContact O-N 3.47Å
473N92.4Very high94.1Very high78 Ų7841 Ų4142%0.41723%0.226SC..  trans-96.3108.2174.1178.41.4000108.4S471 N475 E476 K481S471-N473 VanDerWaalsContact C-N 3.32Å; S471-N473 PolarHBondContact O-N 3.29Å; S471-N473 PolarHBondContact OG-O 3.15Å; N473-N475 PolarHBondContact O-N 2.92Å; N473-N475 PolarHBondContact OD1-N 3.14Å; N473-E476 HydrophobicContact CB-CB 4.14Å; N473-E476 PolarHBondContact O-N 3.05Å; N473-K481 PolarHBondContact O-NZ 3.13Å
474V91.5Very high94.2Very high22 Ų2237 Ų3713%0.13321%0.205CC..THydrogen-bonded Turntrans-69.2-12.7177.9-63.60000114.2K481 T509 E518V474-K481 VanDerWaalsContact CA-NZ 3.32Å; V474-K481 WeakPolarHBondContact O-CD 3.36Å; V474-K481 PolarHBondContact O-NZ 3.28Å; V474-T509 HydrophobicContact CG1-CG2 3.93Å; V474-E518 VanDerWaalsContact O-OE1 3.04Å
475N93.6Very high94.3Very high54 Ų5434.4 Ų34.429%0.28919%0.193SC..THydrogen-bonded Turntrans-98.6-4.5179.4-61.7-32.3000114.1N473 A513 E514N473-N475 PolarHBondContact O-N 2.92Å; N473-N475 PolarHBondContact OD1-N 3.14Å; N475-A513 WeakPolarHBondContact OD1-CA 3.23Å; N475-E514 VanDerWaalsContact ND2-CD 3.34Å; N475-E514 PolarHBondContact ND2-OE1 2.83Å; N475-E514 VanDerWaalsContact ND2-OE1 3.17Å; N475-E514 PolarHBondContact OD1-N 2.92Å
476E92.9Very high94.2Very high85 Ų8535.7 Ų35.740%0.39720%0.198SC..SBendtrans-75.5125.9177.4-164.3-171.7-170.400112.9N473 K481N473-E476 HydrophobicContact CB-CB 4.14Å; N473-E476 PolarHBondContact O-N 3.05Å; E476-K481 WeakPolarHBondContact O-CE 3.37Å; E476-K481 PolarHBondContact O-NZ 2.93Å
477F93.3Very high94.2Very high53 Ų5335.2 Ų35.223%0.23220%0.196CC..SBendtrans5261.9-178.6-49.1-62.8000113.6W424 V479 L480 K481W424-F477 HydrophobicContact CB-CD1 4.02Å; W424-F477 HydrophobicContact CB-CE1 4.3Å; W424-F477 HydrophobicContact CG-CD1 4.25Å; F477-V479 PolarHBondContact O-N 3.27Å; F477-L480 HydrophobicContact CB-CB 4.12Å; F477-L480 HydrophobicContact CB-CD1 4.02Å; F477-L480 HydrophobicContact CB-CG 4.21Å; F477-L480 HydrophobicContact CG-CD1 4.29Å; F477-L480 PolarHBondContact O-N 3.07Å; F477-L480 VanDerWaalsContact O-N 3.11Å; F477-K481 PolarHBondContact O-N 3.14Å
478P94.8Very high94.3Very high35 Ų3532.2 Ų32.223%0.22718%0.176CC..Hα-helixtrans-57.9-33.6-174.324.1-34.6000113.3F362 K481 A482F362-P478 HydrophobicContact CE1-CB 4.02Å; F362-P478 HydrophobicContact CE1-CG 4.21Å; F362-P478 HydrophobicContact CZ-CB 4.19Å; P478-K481 PolarHBondContact O-N 3.39Å; P478-A482 WeakPolarHBondContact O-CB 3.38Å; P478-A482 PolarHBondContact O-N 3.37Å
479V95.4Very high94.3Very high8 Ų831.9 Ų31.95%0.04817%0.174CC..Hα-helixtrans-62.4-49.1176-178.30000111.5F354 F362 W424 F477 K481 A482 D483F354-V479 HydrophobicContact CD2-CG1 3.9Å; F354-V479 HydrophobicContact CE1-CG1 4.42Å; F354-V479 HydrophobicContact CE1-CG2 4.1Å; F354-V479 HydrophobicContact CE2-CG1 3.63Å; F354-V479 HydrophobicContact CG-CG1 4.49Å; F354-V479 HydrophobicContact CZ-CG1 3.92Å; F354-V479 HydrophobicContact CZ-CG2 3.95Å; F362-V479 HydrophobicContact CD1-CG2 4.17Å; F362-V479 HydrophobicContact CD2-CG2 4.25Å; F362-V479 HydrophobicContact CE1-CG2 4.05Å; F362-V479 HydrophobicContact CE2-CG2 4.12Å; F362-V479 HydrophobicContact CG-CG2 4.28Å; F362-V479 HydrophobicContact CZ-CG2 4.02Å; W424-V479 HydrophobicContact CE3-CB 4.4Å; W424-V479 HydrophobicContact CH2-CB 4.15Å; W424-V479 HydrophobicContact CH2-CG1 4.37Å; W424-V479 HydrophobicContact CH2-CG2 3.93Å; W424-V479 HydrophobicContact CZ3-CB 3.68Å; W424-V479 HydrophobicContact CZ3-CG1 3.72Å; W424-V479 HydrophobicContact CZ3-CG2 4Å; F477-V479 PolarHBondContact O-N 3.27Å; V479-K481 PolarHBondContact O-N 3.26Å; V479-A482 WeakPolarHBondContact O-CB 3.47Å; V479-A482 PolarHBondContact O-N 3.3Å; V479-A482 VanDerWaalsContact O-N 3.13Å; V479-D483 PolarHBondContact O-N 3.04Å
480L95.9Very high94.1Very high3 Ų333.1 Ų33.12%0.01618%0.18CC..Hα-helixtrans-63-31.7179.5-67.3-176.9000112.6Y416 W424 K427 D428 F477 A484Y416-L480 HydrophobicContact CE2-CD1 4.07Å; W424-L480 HydrophobicContact CB-CD1 3.87Å; W424-L480 HydrophobicContact CB-CG 4.42Å; W424-L480 HydrophobicContact CE3-CG 4.42Å; K427-L480 HydrophobicContact CB-CD1 4.43Å; K427-L480 HydrophobicContact CB-CD2 3.92Å; K427-L480 HydrophobicContact CD-CD1 4.15Å; K427-L480 HydrophobicContact CD-CD2 4.4Å; K427-L480 HydrophobicContact CG-CD2 4.07Å; D428-L480 HydrophobicContact CB-CD2 3.97Å; F477-L480 HydrophobicContact CB-CB 4.12Å; F477-L480 HydrophobicContact CB-CD1 4.02Å; F477-L480 HydrophobicContact CB-CG 4.21Å; F477-L480 HydrophobicContact CG-CD1 4.29Å; F477-L480 PolarHBondContact O-N 3.07Å; F477-L480 VanDerWaalsContact O-N 3.11Å; L480-A484 WeakPolarHBondContact O-CB 3.32Å; L480-A484 PolarHBondContact O-N 3.17Å
481K96.6Very high94.1Very high4 Ų428 Ų282%0.01716%0.158CC..Hα-helixtrans-73.1-42.6174.3-71.9171.9178.6153.50112.1N473 V474 E476 F477 P478 V479 D483 A484 I485 E518N473-K481 PolarHBondContact O-NZ 3.13Å; V474-K481 VanDerWaalsContact CA-NZ 3.32Å; V474-K481 WeakPolarHBondContact O-CD 3.36Å; V474-K481 PolarHBondContact O-NZ 3.28Å; E476-K481 WeakPolarHBondContact O-CE 3.37Å; E476-K481 PolarHBondContact O-NZ 2.93Å; F477-K481 PolarHBondContact O-N 3.14Å; P478-K481 PolarHBondContact O-N 3.39Å; V479-K481 PolarHBondContact O-N 3.26Å; K481-D483 VanDerWaalsContact C-N 3.25Å; K481-D483 PolarHBondContact O-N 2.61Å; K481-A484 PolarHBondContact O-N 3.3Å; K481-I485 WeakPolarHBondContact O-CB 3.32Å; K481-I485 WeakPolarHBondContact O-CD1 3.48Å; K481-I485 WeakPolarHBondContact O-CG1 3.37Å; K481-I485 PolarHBondContact O-N 3.29Å; K481-E518 HydrophobicContact CB-CG 4.05Å; K481-E518 WeakPolarHBondContact CD-OE1 3.28Å; K481-E518 WeakPolarHBondContact CD-OE2 3.41Å
482A96.5Very high94.3Very high2 Ų226.9 Ų26.92%0.01715%0.149CC..Hα-helixtrans-56.8-43.7171.500000110.4F362 P478 V479 I485 K486 V517 Y521F362-A482 HydrophobicContact CE2-CB 3.99Å; F362-A482 HydrophobicContact CZ-CB 4.26Å; P478-A482 WeakPolarHBondContact O-CB 3.38Å; P478-A482 PolarHBondContact O-N 3.37Å; V479-A482 WeakPolarHBondContact O-CB 3.47Å; V479-A482 PolarHBondContact O-N 3.3Å; V479-A482 VanDerWaalsContact O-N 3.13Å; A482-I485 PolarHBondContact O-N 2.74Å; A482-K486 WeakPolarHBondContact O-CB 3.44Å; A482-K486 PolarHBondContact O-N 3.33Å; A482-V517 HydrophobicContact CB-CG1 4.23Å; A482-Y521 HydrophobicContact CB-CD2 4Å; A482-Y521 HydrophobicContact CB-CE2 4.32Å
483D95.4Very high94.6Very high12 Ų1223 Ų236%0.06412%0.122CC..Hα-helixtrans-61.8-44.1174.9-68.3-27.6000112.5D428 I431 V479 K481 K486 Y487D428-D483 WeakPolarHBondContact CB-OD2 3.41Å; D428-D483 VanDerWaalsContact OD1-OD2 3.12Å; I431-D483 HydrophobicContact CD1-CB 4.19Å; I431-D483 HydrophobicContact CG2-CB 4.19Å; V479-D483 PolarHBondContact O-N 3.04Å; K481-D483 VanDerWaalsContact C-N 3.25Å; K481-D483 PolarHBondContact O-N 2.61Å; D483-K486 PolarHBondContact O-N 2.95Å; D483-Y487 WeakPolarHBondContact O-CB 3.48Å; D483-Y487 PolarHBondContact O-N 3.5Å
484A97.3Very high94.6Very high0 Ų023.2 Ų23.20%012%0.119CC..Hα-helixtrans-63.3-43.2178.500000111.9I465 D468 L469 L480 K481 Y487 V488I465-A484 HydrophobicContact CG2-CB 3.87Å; I465-A484 WeakPolarHBondContact CG2-O 3.47Å; D468-A484 HydrophobicContact CB-CB 3.99Å; L469-A484 HydrophobicContact CD2-CB 3.82Å; L469-A484 HydrophobicContact CG-CB 3.98Å; L480-A484 WeakPolarHBondContact O-CB 3.32Å; L480-A484 PolarHBondContact O-N 3.17Å; K481-A484 PolarHBondContact O-N 3.3Å; A484-Y487 PolarHBondContact O-N 2.94Å; A484-V488 PolarHBondContact O-N 3.3Å
485I97.9Very high94.7Very high0 Ų022.7 Ų22.70%012%0.115CC..Hα-helixtrans-64.7-45.1175.1-64.6163000110.2L469 K481 A482 Y487 V488 M489 L507 H510 E518 Y521 A522 A525L469-I485 HydrophobicContact CD2-CG1 3.73Å; K481-I485 WeakPolarHBondContact O-CB 3.32Å; K481-I485 WeakPolarHBondContact O-CD1 3.48Å; K481-I485 WeakPolarHBondContact O-CG1 3.37Å; K481-I485 PolarHBondContact O-N 3.29Å; A482-I485 PolarHBondContact O-N 2.74Å; I485-Y487 VanDerWaalsContact C-N 3.31Å; I485-Y487 PolarHBondContact O-N 3.35Å; I485-V488 PolarHBondContact O-N 3.48Å; I485-M489 WeakPolarHBondContact O-CB 3.42Å; I485-M489 PolarHBondContact O-N 3.14Å; I485-L507 HydrophobicContact CB-CD2 4.22Å; I485-L507 HydrophobicContact CG1-CD2 3.81Å; I485-L507 HydrophobicContact CG2-CD2 3.76Å; I485-H510 HydrophobicContact CD1-CB 3.99Å; I485-E518 HydrophobicContact CD1-CG 3.85Å; I485-Y521 VanDerWaalsContact CG2-C 3.46Å; I485-Y521 WeakPolarHBondContact CG2-O 3.46Å; I485-A522 HydrophobicContact CD1-CB 4.17Å; I485-A525 HydrophobicContact CG2-CB 3.76Å
486K95.3Very high94.7Very high27 Ų2722.3 Ų22.312%0.11712%0.116CC..Hα-helixtrans-61.7-39178.1-179.1178177.71800111.5D373 A482 D483 M489 I490 Y521D373-K486 IonicContact OD1-NZ 3.67Å; D373-K486 PolarHBondContact OD1-NZ 3.04Å; D373-K486 WeakPolarHBondContact OD2-CD 3.28Å; D373-K486 WeakPolarHBondContact OD2-CE 3.38Å; D373-K486 IonicContact OD2-NZ 3.22Å; D373-K486 PolarHBondContact OD2-NZ 3.28Å; A482-K486 WeakPolarHBondContact O-CB 3.44Å; A482-K486 PolarHBondContact O-N 3.33Å; D483-K486 PolarHBondContact O-N 2.95Å; K486-M489 HydrophobicContact CB-CE 4.41Å; K486-M489 HydrophobicContact CG-CE 3.99Å; K486-M489 WeakPolarHBondContact O-CB 3.25Å; K486-M489 PolarHBondContact O-N 2.97Å; K486-I490 HydrophobicContact CD-CD1 4.22Å; K486-I490 HydrophobicContact CG-CD1 3.64Å; K486-I490 HydrophobicContact CG-CG1 4.18Å; K486-I490 WeakPolarHBondContact O-CB 3.23Å; K486-I490 WeakPolarHBondContact O-CG1 3.27Å; K486-I490 PolarHBondContact O-N 2.9Å; K486-Y521 HydrophobicContact CB-CD2 4.08Å; K486-Y521 HydrophobicContact CB-CE2 4.12Å; K486-Y521 HydrophobicContact CD-CE2 4.13Å; K486-Y521 HydrophobicContact CG-CE2 4.47Å
487Y95.7Very high94.7Very high2 Ų221.7 Ų21.71%0.00811%0.112CC..Hα-helixtrans-60.1-48.7175-173.8-80.8000111.3I431 L457 F460 F461 I465 D483 A484 I485 M489 I490 F491 L495I431-Y487 HydrophobicContact CG2-CD2 4.34Å; L457-Y487 WeakPolarHBondContact CA-OH 3.3Å; L457-Y487 VanDerWaalsContact CD2-OH 3.26Å; L457-Y487 WeakPolarHBondContact CD2-OH 3.4Å; L457-Y487 PolarHBondContact O-OH 2.87Å; F460-Y487 HydrophobicContact CD1-CD2 4.5Å; F460-Y487 AromaticContact CD1-CE2 3.69Å; F460-Y487 HydrophobicContact CD1-CE2 3.69Å; F460-Y487 AromaticContact CD1-CZ 3.84Å; F460-Y487 HydrophobicContact CE1-CD2 4.5Å; F460-Y487 HydrophobicContact CE1-CE2 4.03Å; F461-Y487 HydrophobicContact CB-CE1 4.11Å; F461-Y487 HydrophobicContact CD2-CD1 4.37Å; F461-Y487 HydrophobicContact CD2-CE1 4.39Å; I465-Y487 HydrophobicContact CB-CD1 4.47Å; I465-Y487 HydrophobicContact CD1-CD1 4.33Å; I465-Y487 HydrophobicContact CD1-CD2 4.01Å; I465-Y487 HydrophobicContact CD1-CG 3.85Å; I465-Y487 HydrophobicContact CG1-CD1 3.78Å; I465-Y487 HydrophobicContact CG1-CD2 4.18Å; I465-Y487 HydrophobicContact CG1-CE1 4.08Å; I465-Y487 HydrophobicContact CG1-CE2 4.45Å; I465-Y487 HydrophobicContact CG1-CG 3.82Å; I465-Y487 HydrophobicContact CG2-CD1 4.2Å; I465-Y487 HydrophobicContact CG2-CG 4.47Å; D483-Y487 WeakPolarHBondContact O-CB 3.48Å; D483-Y487 PolarHBondContact O-N 3.5Å; A484-Y487 PolarHBondContact O-N 2.94Å; I485-Y487 VanDerWaalsContact C-N 3.31Å; I485-Y487 PolarHBondContact O-N 3.35Å; Y487-M489 VanDerWaalsContact C-N 3.28Å; Y487-M489 PolarHBondContact O-N 2.56Å; Y487-I490 PolarHBondContact O-N 2.78Å; Y487-F491 AromaticContact CD1-CD2 3.94Å; Y487-F491 HydrophobicContact CD1-CD2 3.94Å; Y487-F491 AromaticContact CD2-CD2 3.74Å; Y487-F491 HydrophobicContact CD2-CD2 3.74Å; Y487-F491 AromaticContact CD2-CE2 3.74Å; Y487-F491 HydrophobicContact CD2-CE2 3.74Å; Y487-F491 HydrophobicContact CE1-CB 4.5Å; Y487-F491 AromaticContact CE1-CD2 3.82Å; Y487-F491 HydrophobicContact CE1-CD2 3.82Å; Y487-F491 HydrophobicContact CE1-CG 4.46Å; Y487-F491 AromaticContact CE2-CD2 3.61Å; Y487-F491 HydrophobicContact CE2-CD2 3.61Å; Y487-F491 AromaticContact CE2-CE2 3.51Å; Y487-F491 HydrophobicContact CE2-CE2 3.51Å; Y487-F491 AromaticContact CG-CD2 3.91Å; Y487-F491 HydrophobicContact CG-CD2 3.91Å; Y487-F491 HydrophobicContact CG-CE2 4.36Å; Y487-F491 AromaticContact CZ-CD2 3.67Å; Y487-F491 AromaticContact CZ-CE2 3.97Å; Y487-F491 WeakPolarHBondContact O-CD2 3.24Å; Y487-F491 PolarHBondContact O-N 3.13Å; Y487-L495 HydrophobicContact CE1-CD2 4.44Å
488V96.4Very high94.7Very high0 Ų025.7 Ų25.70%013%0.131CC..Hα-helixtrans-58.2-44.8175.5173.40000110.7F461 I465 L469 A484 I485 R492 L500 A503 L507 L529F461-V488 HydrophobicContact CD2-CG2 4.26Å; F461-V488 HydrophobicContact CE2-CG2 3.59Å; I465-V488 HydrophobicContact CG2-CG2 4.36Å; L469-V488 HydrophobicContact CD1-CG2 3.89Å; A484-V488 PolarHBondContact O-N 3.3Å; I485-V488 PolarHBondContact O-N 3.48Å; V488-R492 WeakPolarHBondContact O-CA 3.31Å; V488-R492 WeakPolarHBondContact O-CB 3.11Å; V488-R492 PolarHBondContact O-N 2.98Å; V488-L500 HydrophobicContact CG1-CD2 4.26Å; V488-A503 HydrophobicContact CG1-CB 4.21Å; V488-A503 HydrophobicContact CG2-CB 4.42Å; V488-L507 HydrophobicContact CG1-CD1 4.5Å; V488-L529 HydrophobicContact CG1-CD1 4.46Å
489M94.1Very high94.7Very high11 Ų1125.1 Ų25.15%0.05413%0.125CC..Hα-helixtrans-61.9-50.7178.6177.5-179.873.100111.6L374 I485 K486 Y487 R492 H524 A525L374-M489 HydrophobicContact CD2-CE 3.4Å; L374-M489 VanDerWaalsContact CD2-CE 3.4Å; L374-M489 HydrophobicContact CD2-SD 4.15Å; I485-M489 WeakPolarHBondContact O-CB 3.42Å; I485-M489 PolarHBondContact O-N 3.14Å; K486-M489 HydrophobicContact CB-CE 4.41Å; K486-M489 HydrophobicContact CG-CE 3.99Å; K486-M489 WeakPolarHBondContact O-CB 3.25Å; K486-M489 PolarHBondContact O-N 2.97Å; Y487-M489 VanDerWaalsContact C-N 3.28Å; Y487-M489 PolarHBondContact O-N 2.56Å; M489-R492 WeakPolarHBondContact O-CB 3.16Å; M489-R492 WeakPolarHBondContact O-CD 3.35Å; M489-R492 WeakPolarHBondContact O-CG 3.2Å; M489-R492 PolarHBondContact O-NH1 3.12Å; M489-H524 HydrophobicContact SD-CB 4.44Å; M489-H524 PolarHBondContact SD-CD2 3Å; M489-A525 HydrophobicContact CB-CB 4.16Å
490I92.6Very high94.6Very high29 Ų2924.8 Ų24.815%0.14912%0.124CC..Hα-helixtrans-66-45.5-176.3-74178000111.3T435 I448 K486 Y487 R492T435-I490 HydrophobicContact CG2-CD1 4.21Å; T435-I490 HydrophobicContact CG2-CG2 4.22Å; I448-I490 HydrophobicContact CD1-CG2 3.76Å; I448-I490 HydrophobicContact CG1-CG2 3.4Å; I448-I490 PolarHBondContact N-O 2.81Å; K486-I490 HydrophobicContact CD-CD1 4.22Å; K486-I490 HydrophobicContact CG-CD1 3.64Å; K486-I490 HydrophobicContact CG-CG1 4.18Å; K486-I490 WeakPolarHBondContact O-CB 3.23Å; K486-I490 WeakPolarHBondContact O-CG1 3.27Å; K486-I490 PolarHBondContact O-N 2.9Å; Y487-I490 PolarHBondContact O-N 2.78Å; I490-R492 VanDerWaalsContact C-N 3.35Å; I490-R492 PolarHBondContact O-N 2.77Å
491F94.8Very high94.5Very high0 Ų027.3 Ų27.30%014%0.137CC..THydrogen-bonded Turntrans-91.413.1-177.7-66.8-70.2000114.4T435 A438 I448 L457 Y487 S493 K494 L495T435-F491 HydrophobicContact CG2-CE2 3.83Å; T435-F491 HydrophobicContact CG2-CZ 4.07Å; A438-F491 HydrophobicContact CB-CE1 3.93Å; A438-F491 HydrophobicContact CB-CZ 3.81Å; I448-F491 HydrophobicContact CB-CD1 3.98Å; I448-F491 HydrophobicContact CB-CE1 4.15Å; I448-F491 HydrophobicContact CG1-CD1 3.79Å; I448-F491 HydrophobicContact CG1-CE1 3.68Å; I448-F491 HydrophobicContact CG1-CZ 4.36Å; I448-F491 HydrophobicContact CG2-CD1 4.27Å; I448-F491 HydrophobicContact CG2-CE1 4.13Å; L457-F491 HydrophobicContact CD1-CD1 3.57Å; L457-F491 HydrophobicContact CD1-CE1 3.84Å; L457-F491 HydrophobicContact CD1-CG 4.31Å; L457-F491 HydrophobicContact CD2-CD1 3.9Å; L457-F491 HydrophobicContact CD2-CD2 4.31Å; L457-F491 HydrophobicContact CD2-CE1 3.67Å; L457-F491 HydrophobicContact CD2-CE2 4.1Å; L457-F491 HydrophobicContact CD2-CG 4.22Å; L457-F491 HydrophobicContact CD2-CZ 3.8Å; L457-F491 HydrophobicContact CG-CD1 4.39Å; L457-F491 HydrophobicContact CG-CE1 4.43Å; Y487-F491 AromaticContact CD1-CD2 3.94Å; Y487-F491 HydrophobicContact CD1-CD2 3.94Å; Y487-F491 AromaticContact CD2-CD2 3.74Å; Y487-F491 HydrophobicContact CD2-CD2 3.74Å; Y487-F491 AromaticContact CD2-CE2 3.74Å; Y487-F491 HydrophobicContact CD2-CE2 3.74Å; Y487-F491 HydrophobicContact CE1-CB 4.5Å; Y487-F491 AromaticContact CE1-CD2 3.82Å; Y487-F491 HydrophobicContact CE1-CD2 3.82Å; Y487-F491 HydrophobicContact CE1-CG 4.46Å; Y487-F491 AromaticContact CE2-CD2 3.61Å; Y487-F491 HydrophobicContact CE2-CD2 3.61Å; Y487-F491 AromaticContact CE2-CE2 3.51Å; Y487-F491 HydrophobicContact CE2-CE2 3.51Å; Y487-F491 AromaticContact CG-CD2 3.91Å; Y487-F491 HydrophobicContact CG-CD2 3.91Å; Y487-F491 HydrophobicContact CG-CE2 4.36Å; Y487-F491 AromaticContact CZ-CD2 3.67Å; Y487-F491 AromaticContact CZ-CE2 3.97Å; Y487-F491 WeakPolarHBondContact O-CD2 3.24Å; Y487-F491 PolarHBondContact O-N 3.13Å; F491-S493 PolarHBondContact O-N 3.45Å; F491-K494 WeakPolarHBondContact O-CA 3.33Å; F491-K494 PolarHBondContact O-N 3.33Å; F491-L495 HydrophobicContact CB-CD1 4.32Å; F491-L495 HydrophobicContact CB-CG 4.11Å; F491-L495 PolarHBondContact O-N 3.16Å
492R93.4Very high94.5Very high12 Ų1231 Ų315%0.04515%0.154CC..THydrogen-bonded Turntrans-51.1-32.5-176.466-170.6178.2-90.88.4115.4Q444 K445 G447 V488 M489 I490 L500 L529 M532Q444-R492 PolarHBondContact O-NH2 2.79Å; K445-R492 VanDerWaalsContact C-NH2 3.29Å; K445-R492 PolarHBondContact O-NH2 2.99Å; G447-R492 VanDerWaalsContact N-CZ 3.31Å; V488-R492 WeakPolarHBondContact O-CA 3.31Å; V488-R492 WeakPolarHBondContact O-CB 3.11Å; V488-R492 PolarHBondContact O-N 2.98Å; M489-R492 WeakPolarHBondContact O-CB 3.16Å; M489-R492 WeakPolarHBondContact O-CD 3.35Å; M489-R492 WeakPolarHBondContact O-CG 3.2Å; M489-R492 PolarHBondContact O-NH1 3.12Å; I490-R492 VanDerWaalsContact C-N 3.35Å; I490-R492 PolarHBondContact O-N 2.77Å; R492-L500 VanDerWaalsContact O-CD1 3.31Å; R492-L500 WeakPolarHBondContact O-CD1 3.37Å; R492-L529 HydrophobicContact CB-CD2 3.92Å; R492-M532 HydrophobicContact CB-CE 4.33Å; R492-M532 HydrophobicContact CB-SD 3.73Å; R492-M532 HydrophobicContact CG-CE 4.27Å; R492-M532 HydrophobicContact CG-SD 3.84Å; R492-M532 WeakPolarHBondContact O-CE 3.39Å
493S91.8Very high94.4Very high46 Ų4630.9 Ų30.932%0.32215%0.153SC..THydrogen-bonded Turntrans-88.1-5.5177.855.60000114.4H446 I448 F491H446-S493 VanDerWaalsContact O-CB 3.26Å; H446-S493 WeakPolarHBondContact O-CB 3.35Å; H446-S493 PolarHBondContact O-OG 3.29Å; I448-S493 PolarHBondContact O-OG 3.09Å; F491-S493 PolarHBondContact O-N 3.45Å
494K92.6Very high94.5Very high83 Ų8330.4 Ų30.436%0.36115%0.151SC..THydrogen-bonded Turntrans-108.4-25.8177.9-59.8-57.2176.5-173.90113.2I448 T449 A451 L457 F491I448-K494 HydrophobicContact CB-CG 4.48Å; I448-K494 HydrophobicContact CG2-CG 4.34Å; I448-K494 WeakPolarHBondContact O-CE 3.21Å; I448-K494 WeakPolarHBondContact O-CG 3.42Å; T449-K494 WeakPolarHBondContact O-CE 3.33Å; T449-K494 PolarHBondContact O-NZ 3.24Å; A451-K494 HydrophobicContact CB-CG 4.44Å; L457-K494 HydrophobicContact CD1-CB 3.97Å; L457-K494 HydrophobicContact CD1-CG 4.47Å; F491-K494 WeakPolarHBondContact O-CA 3.33Å; F491-K494 PolarHBondContact O-N 3.33Å
495L93.1Very high94.5Very high10 Ų1032 Ų325%0.05216%0.161CC..SBendtrans-72.7139174.3-65.8172.9000111F461 Y487 F491 L500F461-L495 HydrophobicContact CB-CD2 3.99Å; F461-L495 HydrophobicContact CD2-CD1 4.27Å; F461-L495 HydrophobicContact CG-CD2 4.17Å; Y487-L495 HydrophobicContact CE1-CD2 4.44Å; F491-L495 HydrophobicContact CB-CD1 4.32Å; F491-L495 HydrophobicContact CB-CG 4.11Å; F491-L495 PolarHBondContact O-N 3.16Å; L495-L500 HydrophobicContact CB-CD2 3.86Å; L495-L500 HydrophobicContact CB-CG 4.21Å; L495-L500 HydrophobicContact CD1-CD2 4.07Å
496P93.1Very high94.5Very high47 Ų4733.5 Ų33.531%0.30517%0.169SC..  trans-55.7147.4171.6-25.333.5000112.9T458 E498 Q499 L500T458-P496 HydrophobicContact CG2-CG 4.36Å; P496-E498 WeakPolarHBondContact CB-OE2 3.23Å; P496-E498 PolarHBondContact O-N 3.02Å; P496-Q499 HydrophobicContact CB-CG 4.47Å; P496-Q499 PolarHBondContact O-N 3.34Å; P496-L500 PolarHBondContact O-N 2.82Å
497K92.4Very high94.6Very high71 Ų7132.2 Ų32.231%0.30916%0.163SC..Hα-helixtrans-55.8-38-179176.1174.8168.21630111.8Q499 L500 L501 L540 E545K497-Q499 VanDerWaalsContact C-N 3.3Å; K497-Q499 PolarHBondContact O-N 3.12Å; K497-L500 PolarHBondContact O-N 3.24Å; K497-L501 HydrophobicContact CG-CD1 4.13Å; K497-L501 HydrophobicContact CG-CG 4.29Å; K497-L501 WeakPolarHBondContact O-CG 3.29Å; K497-L501 PolarHBondContact O-N 3.21Å; K497-L540 HydrophobicContact CB-CD1 4.41Å; K497-L540 HydrophobicContact CD-CD1 3.94Å; K497-L540 HydrophobicContact CD-CG 4.49Å; K497-L540 WeakPolarHBondContact CE-O 3.3Å; K497-L540 HydrophobicContact CG-CD1 4.23Å; K497-L540 PolarHBondContact NZ-O 3.43Å; K497-E545 WeakPolarHBondContact CE-OE1 3.4Å; K497-E545 IonicContact NZ-OE1 3.16Å; K497-E545 PolarHBondContact NZ-OE1 3.14Å; K497-E545 IonicContact NZ-OE2 2.74Å
498E93.4Very high94.7Very high138 Ų13832.1 Ų32.165%0.64516%0.163SC*.Hα-helixtrans-61.4-39.5-179.9-60.976.4-166.600111.8P496 Q502P496-E498 WeakPolarHBondContact CB-OE2 3.23Å; P496-E498 PolarHBondContact O-N 3.02Å; E498-Q502 WeakPolarHBondContact O-CB 3.43Å; E498-Q502 PolarHBondContact O-N 3.46Å
499Q94.3Very high94.8Very high22 Ų2234.5 Ų34.510%0.10318%0.177CC..Hα-helixtrans-71.3-38.7178.1-67.1-171.4-21.500111.6F461 P496 K497 Q502 A503F461-Q499 HydrophobicContact CD1-CB 4.15Å; F461-Q499 HydrophobicContact CD1-CG 4.12Å; F461-Q499 HydrophobicContact CE1-CB 3.74Å; F461-Q499 HydrophobicContact CE1-CG 4Å; F461-Q499 HydrophobicContact CZ-CB 4.42Å; P496-Q499 HydrophobicContact CB-CG 4.47Å; P496-Q499 PolarHBondContact O-N 3.34Å; K497-Q499 VanDerWaalsContact C-N 3.3Å; K497-Q499 PolarHBondContact O-N 3.12Å; Q499-Q502 WeakPolarHBondContact O-CB 3.45Å; Q499-Q502 PolarHBondContact O-N 3.13Å; Q499-A503 PolarHBondContact O-N 3.19Å
500L94.7Very high94.9Very high2 Ų234 Ų341%0.0118%0.175CC..Hα-helixtrans-63.4-45.1174.6-61.1176.7000111.2V488 R492 L495 P496 K497 Q502 A503 V504 L529 M532 L540V488-L500 HydrophobicContact CG1-CD2 4.26Å; R492-L500 VanDerWaalsContact O-CD1 3.31Å; R492-L500 WeakPolarHBondContact O-CD1 3.37Å; L495-L500 HydrophobicContact CB-CD2 3.86Å; L495-L500 HydrophobicContact CB-CG 4.21Å; L495-L500 HydrophobicContact CD1-CD2 4.07Å; P496-L500 PolarHBondContact O-N 2.82Å; K497-L500 PolarHBondContact O-N 3.24Å; L500-Q502 VanDerWaalsContact C-N 3.28Å; L500-Q502 PolarHBondContact O-N 2.92Å; L500-A503 PolarHBondContact O-N 2.8Å; L500-A503 VanDerWaalsContact O-N 3.09Å; L500-V504 WeakPolarHBondContact O-CG2 3.15Å; L500-V504 PolarHBondContact O-N 3.5Å; L500-V504 VanDerWaalsContact O-N 3.11Å; L500-L529 HydrophobicContact CD1-CD2 4.35Å; L500-L529 HydrophobicContact CD2-CD2 3.89Å; L500-L529 HydrophobicContact CG-CD2 4.49Å; L500-M532 HydrophobicContact CD1-SD 4.34Å; L500-L540 HydrophobicContact CD1-CD2 3.82Å
501L94Very high95.2Very high56 Ų5632.7 Ų32.729%0.29317%0.168SC..Hα-helixtrans-62.2-35.5175.5-73.3177.6000112.1K497 A503 P505 I541 E545K497-L501 HydrophobicContact CG-CD1 4.13Å; K497-L501 HydrophobicContact CG-CG 4.29Å; K497-L501 WeakPolarHBondContact O-CG 3.29Å; K497-L501 PolarHBondContact O-N 3.21Å; L501-A503 VanDerWaalsContact C-N 3.34Å; L501-P505 VanDerWaalsContact O-CD 3.27Å; L501-P505 WeakPolarHBondContact O-CD 3.4Å; L501-I541 HydrophobicContact CD2-CG1 4.2Å; L501-I541 HydrophobicContact CD2-CG2 4.44Å; L501-E545 HydrophobicContact CD2-CB 4.25Å; L501-E545 HydrophobicContact CD2-CG 4.46Å
502Q94.9Very high95.3Very high80 Ų8036.2 Ų36.237%0.37419%0.185SC..Hα-helixtrans-66.8-34.8173-175.4176.334.200112.4L466 E498 Q499 L500 P505L466-Q502 HydrophobicContact CD1-CG 4.28Å; E498-Q502 WeakPolarHBondContact O-CB 3.43Å; E498-Q502 PolarHBondContact O-N 3.46Å; Q499-Q502 WeakPolarHBondContact O-CB 3.45Å; Q499-Q502 PolarHBondContact O-N 3.13Å; L500-Q502 VanDerWaalsContact C-N 3.28Å; L500-Q502 PolarHBondContact O-N 2.92Å; Q502-P505 WeakPolarHBondContact O-CD 3.43Å
503A96.4Very high95.4Very high0 Ų035.7 Ų35.70%018%0.183CC..Hα-helixtrans-73.1-34.1-179.700000112.9V488 Q499 L500 L501 L506 L507V488-A503 HydrophobicContact CG1-CB 4.21Å; V488-A503 HydrophobicContact CG2-CB 4.42Å; Q499-A503 PolarHBondContact O-N 3.19Å; L500-A503 PolarHBondContact O-N 2.8Å; L500-A503 VanDerWaalsContact O-N 3.09Å; L501-A503 VanDerWaalsContact C-N 3.34Å; A503-L506 WeakPolarHBondContact O-CA 3.44Å; A503-L506 WeakPolarHBondContact O-CB 2.95Å; A503-L506 PolarHBondContact O-N 2.97Å; A503-L507 WeakPolarHBondContact O-CG 3.35Å; A503-L507 PolarHBondContact O-N 3.03Å
504V96.5Very high95.6Very high3 Ų340.3 Ų40.32%0.01820%0.199CC..Hα-helixtrans-48.4-55.3-176.9168.60000114.6L500 L506 L507 I508 L526 L529 I541 M546L500-V504 WeakPolarHBondContact O-CG2 3.15Å; L500-V504 PolarHBondContact O-N 3.5Å; L500-V504 VanDerWaalsContact O-N 3.11Å; V504-L506 PolarHBondContact O-N 3.13Å; V504-L507 PolarHBondContact O-N 3.21Å; V504-I508 HydrophobicContact CG1-CD1 3.98Å; V504-I508 WeakPolarHBondContact O-CG1 3.21Å; V504-I508 PolarHBondContact O-N 3.01Å; V504-L526 HydrophobicContact CG1-CD2 4.34Å; V504-L529 HydrophobicContact CG2-CD1 4.33Å; V504-I541 HydrophobicContact CG2-CD1 3.83Å; V504-M546 HydrophobicContact CG1-CE 3.77Å; V504-M546 HydrophobicContact CG1-SD 3.66Å
505P96.9Very high95.7Very high32 Ų3237.5 Ų37.521%0.20819%0.19CC..Hα-helixtrans-64.8-28.3-179.924.9-34.8000113.2L501 Q502 T509 F549L501-P505 VanDerWaalsContact O-CD 3.27Å; L501-P505 WeakPolarHBondContact O-CD 3.4Å; Q502-P505 WeakPolarHBondContact O-CD 3.43Å; P505-T509 PolarHBondContact O-N 3.28Å; P505-T509 PolarHBondContact O-OG1 2.82Å; P505-F549 HydrophobicContact CB-CD1 4.14Å; P505-F549 HydrophobicContact CB-CE1 3.81Å; P505-F549 HydrophobicContact CB-CZ 4.11Å; P505-F549 HydrophobicContact CG-CE1 4.47Å; P505-F549 HydrophobicContact CG-CZ 4.31Å
506L97.8Very high95.9Very high32 Ų3238.1 Ų38.117%0.16819%0.194CC..Hα-helixtrans-69.5-47.5174.7-54.4177.3000110L466 L469 K470 A503 V504 I508 T509 H510L466-L506 HydrophobicContact CD1-CD1 3.85Å; L469-L506 HydrophobicContact CB-CB 4.19Å; L469-L506 HydrophobicContact CB-CD1 3.72Å; K470-L506 HydrophobicContact CG-CD1 3.81Å; K470-L506 HydrophobicContact CG-CD2 4.17Å; A503-L506 WeakPolarHBondContact O-CA 3.44Å; A503-L506 WeakPolarHBondContact O-CB 2.95Å; A503-L506 PolarHBondContact O-N 2.97Å; V504-L506 PolarHBondContact O-N 3.13Å; L506-I508 VanDerWaalsContact C-N 3.28Å; L506-I508 PolarHBondContact O-N 2.88Å; L506-T509 WeakPolarHBondContact O-CA 3.38Å; L506-T509 VanDerWaalsContact O-CB 3.32Å; L506-T509 WeakPolarHBondContact O-CB 2.97Å; L506-T509 PolarHBondContact O-N 2.92Å; L506-H510 PolarHBondContact O-CD2 3.26Å; L506-H510 PolarHBondContact O-N 2.58Å
507L98.1Very high96.1Very high0 Ų035.9 Ų35.90%018%0.18CC..Hα-helixtrans-57.7-40174.8-64.2176.2000111.9I485 V488 A503 V504 T509 H510 L511 A525 L526 L529I485-L507 HydrophobicContact CB-CD2 4.22Å; I485-L507 HydrophobicContact CG1-CD2 3.81Å; I485-L507 HydrophobicContact CG2-CD2 3.76Å; V488-L507 HydrophobicContact CG1-CD1 4.5Å; A503-L507 WeakPolarHBondContact O-CG 3.35Å; A503-L507 PolarHBondContact O-N 3.03Å; V504-L507 PolarHBondContact O-N 3.21Å; L507-T509 PolarHBondContact O-N 3.27Å; L507-H510 PolarHBondContact O-N 3.05Å; L507-L511 PolarHBondContact O-N 3.36Å; L507-A525 HydrophobicContact CD1-CB 3.96Å; L507-A525 HydrophobicContact CD2-CB 4.26Å; L507-L526 HydrophobicContact CB-CD1 4.34Å; L507-L526 HydrophobicContact CB-CD2 3.87Å; L507-L526 HydrophobicContact CB-CG 3.94Å; L507-L526 HydrophobicContact CD1-CD2 4.23Å; L507-L526 HydrophobicContact CD1-CG 4.43Å; L507-L529 HydrophobicContact CD1-CD1 3.62Å
508I98.2Very high96.3Very high0 Ų032.5 Ų32.50%017%0.165CC..Hα-helixtrans-60.7-36.5174.3-69.4168.6000111.4V504 L506 L511 L526 M546 F549 Q552 L553 N556V504-I508 HydrophobicContact CG1-CD1 3.98Å; V504-I508 WeakPolarHBondContact O-CG1 3.21Å; V504-I508 PolarHBondContact O-N 3.01Å; L506-I508 VanDerWaalsContact C-N 3.28Å; L506-I508 PolarHBondContact O-N 2.88Å; I508-L511 WeakPolarHBondContact O-CB 3.28Å; I508-L526 HydrophobicContact CG1-CD1 4.14Å; I508-L526 HydrophobicContact CG1-CD2 4.18Å; I508-M546 HydrophobicContact CD1-CE 4.08Å; I508-F549 HydrophobicContact CD1-CB 3.73Å; I508-F549 HydrophobicContact CD1-CG 4.41Å; I508-Q552 HydrophobicContact CG2-CB 4.3Å; I508-Q552 HydrophobicContact CG2-CG 3.81Å; I508-L553 HydrophobicContact CD1-CB 4.02Å; I508-L553 HydrophobicContact CD1-CD1 4.27Å; I508-L553 HydrophobicContact CG1-CB 4.33Å; I508-L553 HydrophobicContact CG1-CD1 3.89Å; I508-N556 PolarHBondContact O-ND2 3.31Å
509T97.3Very high96.5Very high50 Ų5025.9 Ų25.931%0.30713%0.134SC..Hα-helixtrans-70.9-40.4178.4-550000111.1V474 P505 L506 L507 L511 Q512V474-T509 HydrophobicContact CG1-CG2 3.93Å; P505-T509 PolarHBondContact O-N 3.28Å; P505-T509 PolarHBondContact O-OG1 2.82Å; L506-T509 WeakPolarHBondContact O-CA 3.38Å; L506-T509 VanDerWaalsContact O-CB 3.32Å; L506-T509 WeakPolarHBondContact O-CB 2.97Å; L506-T509 PolarHBondContact O-N 2.92Å; L507-T509 PolarHBondContact O-N 3.27Å; T509-L511 PolarHBondContact O-N 3.44Å; T509-Q512 WeakPolarHBondContact O-CB 3.21Å; T509-Q512 PolarHBondContact O-N 2.88Å
510H97.5Very high96.6Very high2 Ų224.9 Ų24.91%0.00913%0.129CC..Hα-helixtrans-65.6-14.4176.7-73.3-73.2000114.6L469 I485 L506 L507 Q512 A513 E518 H519 A522L469-H510 PolarHBondContact O-NE2 2.78Å; I485-H510 HydrophobicContact CD1-CB 3.99Å; L506-H510 PolarHBondContact O-CD2 3.26Å; L506-H510 PolarHBondContact O-N 2.58Å; L507-H510 PolarHBondContact O-N 3.05Å; H510-Q512 PolarHBondContact O-N 3.42Å; H510-Q512 VanDerWaalsContact O-N 3.11Å; H510-A513 VanDerWaalsContact O-CB 3.32Å; H510-A513 WeakPolarHBondContact O-CB 3.31Å; H510-A513 PolarHBondContact O-N 2.88Å; H510-A513 VanDerWaalsContact O-N 3.11Å; H510-E518 IonicContact CE1-OE1 3.11Å; H510-E518 IonicContact CG-OE1 3.78Å; H510-E518 IonicContact ND1-OE1 3.68Å; H510-E518 PolarHBondContact ND1-OE1 3.33Å; H510-H519 WeakPolarHBondContact O-CB 3.48Å; H510-A522 HydrophobicContact CB-CB 3.89Å
511L97.8Very high96.8Very high1 Ų124.9 Ų24.91%0.00513%0.129CC..THydrogen-bonded Turntrans-60.9-15.4167.7-68.1172.9000113.3L507 I508 T509 A522 A523 L526 L553 N556 L557L507-L511 PolarHBondContact O-N 3.36Å; I508-L511 WeakPolarHBondContact O-CB 3.28Å; T509-L511 PolarHBondContact O-N 3.44Å; L511-A522 HydrophobicContact CD2-CB 4.06Å; L511-A522 HydrophobicContact CG-CB 4.38Å; L511-A523 HydrophobicContact CD2-CB 3.77Å; L511-L526 HydrophobicContact CD1-CD1 3.87Å; L511-L526 HydrophobicContact CD2-CD1 4.39Å; L511-L526 HydrophobicContact CG-CD1 4.22Å; L511-L553 HydrophobicContact CD1-CD1 4.35Å; L511-N556 HydrophobicContact CB-CB 3.86Å; L511-N556 HydrophobicContact CD1-CB 3.89Å; L511-L557 HydrophobicContact CD1-CD2 3.72Å; L511-L557 HydrophobicContact CD1-CG 3.8Å; L511-L557 HydrophobicContact CD2-CD2 3.89Å; L511-L557 HydrophobicContact CG-CD2 4.49Å
512Q96.3Very high97Very high74 Ų7422.2 Ų22.235%0.34612%0.115SC..THydrogen-bonded Turntrans-92.5-1.2178.2-56.3-176.6-0.900113.6T509 H510 N556T509-Q512 WeakPolarHBondContact O-CB 3.21Å; T509-Q512 PolarHBondContact O-N 2.88Å; H510-Q512 PolarHBondContact O-N 3.42Å; H510-Q512 VanDerWaalsContact O-N 3.11Å; Q512-N556 HydrophobicContact CG-CB 4.49Å; Q512-N556 VanDerWaalsContact NE2-CG 3.32Å; Q512-N556 PolarHBondContact NE2-ND2 2.78Å; Q512-N556 VanDerWaalsContact NE2-ND2 3.14Å; Q512-N556 PolarHBondContact NE2-OD1 3.1Å
513A96.5Very high97.1Very high0 Ų018.4 Ų18.40%010%0.097CC..  trans-59.2148.6179.200000111.3N475 H510 E518 H519 L563N475-A513 WeakPolarHBondContact OD1-CA 3.23Å; H510-A513 VanDerWaalsContact O-CB 3.32Å; H510-A513 WeakPolarHBondContact O-CB 3.31Å; H510-A513 PolarHBondContact O-N 2.88Å; H510-A513 VanDerWaalsContact O-N 3.11Å; A513-E518 HydrophobicContact CB-CB 3.93Å; A513-E518 HydrophobicContact CB-CG 3.83Å; A513-E518 WeakPolarHBondContact CB-OE1 3.49Å; A513-H519 HydrophobicContact CB-CB 4.4Å; A513-H519 PolarHBondContact O-ND1 3.1Å; A513-L563 VanDerWaalsContact O-CD1 3.29Å; A513-L563 WeakPolarHBondContact O-CD1 3.35Å
514E95.5Very high97.2Very high144 Ų14418.8 Ų18.867%0.67310%0.099SC*.SBendtrans-78-26.4175.5-70.7174.1-161.700111.8N475 T516N475-E514 VanDerWaalsContact ND2-CD 3.34Å; N475-E514 PolarHBondContact ND2-OE1 2.83Å; N475-E514 VanDerWaalsContact ND2-OE1 3.17Å; N475-E514 PolarHBondContact OD1-N 2.92Å; E514-T516 PolarHBondContact O-N 3.5Å
515S96Very high97.2Very high24 Ų2418.7 Ų18.717%0.16810%0.099CC..SBendtrans-71.2120.1177.51730000111.3F362 V517 E518 H519F362-S515 WeakPolarHBondContact CE1-OG 3.37Å; S515-V517 PolarHBondContact O-N 2.91Å; S515-V517 PolarHBondContact OG-N 3.34Å; S515-E518 PolarHBondContact O-N 3.35Å; S515-E518 VanDerWaalsContact O-N 3.13Å; S515-H519 PolarHBondContact O-CE1 3.38Å; S515-H519 PolarHBondContact O-N 3.38Å; S515-H519 PolarHBondContact O-ND1 3.33Å
516T96.6Very high97.2Very high22 Ų2217.2 Ų17.214%0.1359%0.089CC..Hα-helixtrans-50.4-43.2174.3-57.40000112.8S366 I370 E514 H519 T520S366-T516 WeakPolarHBondContact OG-CB 3.45Å; S366-T516 WeakPolarHBondContact OG-CG2 3.45Å; I370-T516 HydrophobicContact CD1-CG2 4.13Å; E514-T516 PolarHBondContact O-N 3.5Å; T516-H519 WeakPolarHBondContact CA-CE1 3Å; T516-T520 WeakPolarHBondContact O-CB 3.39Å; T516-T520 PolarHBondContact O-N 3.46Å; T516-T520 PolarHBondContact O-OG1 2.69Å
517V96.7Very high97.1Very high0 Ų015.9 Ų15.90%08%0.082CC..Hα-helixtrans-65.9-46.4-178.9-174.80000111.1F362 Y369 I370 A482 S515 T520 Y521F362-V517 HydrophobicContact CD1-CG2 4.36Å; F362-V517 HydrophobicContact CD2-CB 3.98Å; F362-V517 HydrophobicContact CD2-CG1 3.96Å; F362-V517 HydrophobicContact CD2-CG2 3.75Å; F362-V517 HydrophobicContact CE1-CB 4.32Å; F362-V517 HydrophobicContact CE1-CG2 4.37Å; F362-V517 HydrophobicContact CE2-CB 3.46Å; F362-V517 VanDerWaalsContact CE2-CB 3.46Å; F362-V517 HydrophobicContact CE2-CG1 3.42Å; F362-V517 VanDerWaalsContact CE2-CG1 3.42Å; F362-V517 HydrophobicContact CE2-CG2 3.79Å; F362-V517 HydrophobicContact CG-CG2 4.05Å; F362-V517 HydrophobicContact CZ-CB 3.65Å; F362-V517 HydrophobicContact CZ-CG1 4.07Å; F362-V517 HydrophobicContact CZ-CG2 4.1Å; Y369-V517 HydrophobicContact CD1-CG1 4Å; Y369-V517 HydrophobicContact CD1-CG2 4.09Å; Y369-V517 HydrophobicContact CE1-CG1 4.01Å; I370-V517 HydrophobicContact CD1-CG2 4.38Å; I370-V517 HydrophobicContact CG1-CB 4.38Å; I370-V517 HydrophobicContact CG1-CG1 4.16Å; I370-V517 HydrophobicContact CG1-CG2 4.16Å; A482-V517 HydrophobicContact CB-CG1 4.23Å; S515-V517 PolarHBondContact O-N 2.91Å; S515-V517 PolarHBondContact OG-N 3.34Å; V517-T520 PolarHBondContact O-N 3.28Å; V517-Y521 HydrophobicContact CG1-CD1 4.12Å; V517-Y521 HydrophobicContact CG1-CD2 4.42Å; V517-Y521 HydrophobicContact CG1-CE1 3.85Å; V517-Y521 HydrophobicContact CG1-CE2 4.19Å; V517-Y521 HydrophobicContact CG1-CG 4.39Å; V517-Y521 WeakPolarHBondContact O-CB 3.47Å; V517-Y521 WeakPolarHBondContact O-CD1 3.33Å; V517-Y521 PolarHBondContact O-N 3.4Å
518E96.3Very high96.9Very high0 Ų018.2 Ų18.20%09%0.091CC..Hα-helixtrans-62.8-54.3-175-172.3-177.2147.200112.5V474 K481 I485 H510 A513 S515 T520 Y521 A522V474-E518 VanDerWaalsContact O-OE1 3.04Å; K481-E518 HydrophobicContact CB-CG 4.05Å; K481-E518 WeakPolarHBondContact CD-OE1 3.28Å; K481-E518 WeakPolarHBondContact CD-OE2 3.41Å; I485-E518 HydrophobicContact CD1-CG 3.85Å; H510-E518 IonicContact CE1-OE1 3.11Å; H510-E518 IonicContact CG-OE1 3.78Å; H510-E518 IonicContact ND1-OE1 3.68Å; H510-E518 PolarHBondContact ND1-OE1 3.33Å; A513-E518 HydrophobicContact CB-CB 3.93Å; A513-E518 HydrophobicContact CB-CG 3.83Å; A513-E518 WeakPolarHBondContact CB-OE1 3.49Å; S515-E518 PolarHBondContact O-N 3.35Å; S515-E518 VanDerWaalsContact O-N 3.13Å; E518-T520 VanDerWaalsContact C-N 3.26Å; E518-T520 PolarHBondContact O-N 2.86Å; E518-Y521 PolarHBondContact O-N 3.04Å; E518-A522 PolarHBondContact O-N 3.44Å
519H97.6Very high96.7Very high0 Ų018.2 Ų18.20%09%0.091CC..Hα-helixtrans-70.4-25.9-178.962.5-115.3000112.3H510 A513 S515 T516 A522 A523 L563 S566H510-H519 WeakPolarHBondContact O-CB 3.48Å; A513-H519 HydrophobicContact CB-CB 4.4Å; A513-H519 PolarHBondContact O-ND1 3.1Å; S515-H519 PolarHBondContact O-CE1 3.38Å; S515-H519 PolarHBondContact O-N 3.38Å; S515-H519 PolarHBondContact O-ND1 3.33Å; T516-H519 WeakPolarHBondContact CA-CE1 3Å; H519-A522 PolarHBondContact O-N 3.14Å; H519-A523 WeakPolarHBondContact O-CB 3.45Å; H519-A523 PolarHBondContact O-N 3.41Å; H519-L563 WeakPolarHBondContact ND1-CD1 3.43Å; H519-S566 PolarHBondContact CE1-OG 3.36Å; H519-S566 PolarHBondContact NE2-OG 2.94Å
520T97.8Very high96.4Very high0 Ų016.1 Ų16.10%08%0.078CC..Hα-helixtrans-68.2-44.6172.6-59.80000111I370 T516 V517 E518 A522 A523 H524 N569 Y571I370-T520 HydrophobicContact CD1-CG2 3.82Å; I370-T520 HydrophobicContact CG1-CG2 4.37Å; I370-T520 HydrophobicContact CG2-CG2 3.94Å; T516-T520 WeakPolarHBondContact O-CB 3.39Å; T516-T520 PolarHBondContact O-N 3.46Å; T516-T520 PolarHBondContact O-OG1 2.69Å; V517-T520 PolarHBondContact O-N 3.28Å; E518-T520 VanDerWaalsContact C-N 3.26Å; E518-T520 PolarHBondContact O-N 2.86Å; T520-A522 VanDerWaalsContact C-N 3.3Å; T520-A522 PolarHBondContact O-N 3.12Å; T520-A523 PolarHBondContact O-N 2.85Å; T520-H524 WeakPolarHBondContact O-CB 3.3Å; T520-H524 PolarHBondContact O-N 3.04Å; T520-N569 PolarHBondContact OG1-ND2 2.74Å; T520-Y571 HydrophobicContact CG2-CD2 3.59Å; T520-Y571 HydrophobicContact CG2-CE2 4.46Å; T520-Y571 HydrophobicContact CG2-CG 3.78Å
521Y97.9Very high96Very high2 Ų218 Ų181%0.0089%0.089CC..Hα-helixtrans-63.9-39.1175.7-82.523000110.8I370 D373 L374 A482 I485 K486 V517 E518 H524 A525I370-Y521 HydrophobicContact CB-CE1 4.43Å; I370-Y521 HydrophobicContact CG1-CE1 4.03Å; I370-Y521 HydrophobicContact CG2-CE1 4.24Å; D373-Y521 VanDerWaalsContact CB-OH 3.23Å; D373-Y521 WeakPolarHBondContact CB-OH 3.23Å; D373-Y521 PolarHBondContact OD2-OH 3.24Å; L374-Y521 HydrophobicContact CD1-CD1 4.16Å; L374-Y521 HydrophobicContact CD1-CE1 3.96Å; L374-Y521 HydrophobicContact CD2-CD1 4.35Å; L374-Y521 HydrophobicContact CD2-CE1 3.89Å; L374-Y521 HydrophobicContact CG-CD1 4.47Å; L374-Y521 HydrophobicContact CG-CE1 3.85Å; A482-Y521 HydrophobicContact CB-CD2 4Å; A482-Y521 HydrophobicContact CB-CE2 4.32Å; I485-Y521 VanDerWaalsContact CG2-C 3.46Å; I485-Y521 WeakPolarHBondContact CG2-O 3.46Å; K486-Y521 HydrophobicContact CB-CD2 4.08Å; K486-Y521 HydrophobicContact CB-CE2 4.12Å; K486-Y521 HydrophobicContact CD-CE2 4.13Å; K486-Y521 HydrophobicContact CG-CE2 4.47Å; V517-Y521 HydrophobicContact CG1-CD1 4.12Å; V517-Y521 HydrophobicContact CG1-CD2 4.42Å; V517-Y521 HydrophobicContact CG1-CE1 3.85Å; V517-Y521 HydrophobicContact CG1-CE2 4.19Å; V517-Y521 HydrophobicContact CG1-CG 4.39Å; V517-Y521 WeakPolarHBondContact O-CB 3.47Å; V517-Y521 WeakPolarHBondContact O-CD1 3.33Å; V517-Y521 PolarHBondContact O-N 3.4Å; E518-Y521 PolarHBondContact O-N 3.04Å; Y521-H524 PolarHBondContact O-N 2.89Å; Y521-A525 VanDerWaalsContact O-CB 3.26Å; Y521-A525 WeakPolarHBondContact O-CB 3.45Å; Y521-A525 PolarHBondContact O-N 3Å
522A98.1Very high95.6Very high0 Ų019.2 Ų19.20%010%0.095CC..Hα-helixtrans-60.5-48174.700000111.5I485 H510 L511 E518 H519 T520 H524 A525 L526I485-A522 HydrophobicContact CD1-CB 4.17Å; H510-A522 HydrophobicContact CB-CB 3.89Å; L511-A522 HydrophobicContact CD2-CB 4.06Å; L511-A522 HydrophobicContact CG-CB 4.38Å; E518-A522 PolarHBondContact O-N 3.44Å; H519-A522 PolarHBondContact O-N 3.14Å; T520-A522 VanDerWaalsContact C-N 3.3Å; T520-A522 PolarHBondContact O-N 3.12Å; A522-H524 PolarHBondContact O-N 3.33Å; A522-A525 PolarHBondContact O-N 2.85Å; A522-L526 VanDerWaalsContact O-CG 3.3Å; A522-L526 WeakPolarHBondContact O-CG 3.44Å; A522-L526 PolarHBondContact O-N 3.36Å
523A98.2Very high95.1Very high0 Ų021.5 Ų21.50%010%0.101CC..Hα-helixtrans-60.6-44.3175.700000111.9L511 H519 T520 L526 E527 L557 I572 A575L511-A523 HydrophobicContact CD2-CB 3.77Å; H519-A523 WeakPolarHBondContact O-CB 3.45Å; H519-A523 PolarHBondContact O-N 3.41Å; T520-A523 PolarHBondContact O-N 2.85Å; A523-L526 PolarHBondContact O-N 3.49Å; A523-E527 PolarHBondContact O-N 3.14Å; A523-L557 HydrophobicContact CB-CD2 4.39Å; A523-I572 HydrophobicContact CB-CB 4.46Å; A523-I572 HydrophobicContact CB-CG1 3.96Å; A523-A575 HydrophobicContact CB-CB 3.93Å; A523-A575 WeakPolarHBondContact O-CB 3.45Å
524H96.8Very high94.3Very high9 Ų922.5 Ų22.54%0.04211%0.11CC..Hα-helixtrans-65.9-43.6178.8-164.448.2000112.2L374 M489 T520 Y521 A522 L526 E527 R528 Y571L374-H524 HydrophobicContact CD1-CB 4.33Å; M489-H524 HydrophobicContact SD-CB 4.44Å; M489-H524 PolarHBondContact SD-CD2 3Å; T520-H524 WeakPolarHBondContact O-CB 3.3Å; T520-H524 PolarHBondContact O-N 3.04Å; Y521-H524 PolarHBondContact O-N 2.89Å; A522-H524 PolarHBondContact O-N 3.33Å; H524-L526 VanDerWaalsContact C-N 3.34Å; H524-L526 PolarHBondContact O-N 3.17Å; H524-E527 IonicContact CE1-OE1 3.43Å; H524-E527 IonicContact ND1-OE1 2.74Å; H524-E527 WeakPolarHBondContact O-CG 3.29Å; H524-E527 PolarHBondContact O-N 3.22Å; H524-R528 PolarHBondContact CE1-NE 3.29Å; H524-R528 PolarHBondContact CE1-NH2 2.75Å; H524-R528 VanDerWaalsContact CE1-NH2 3.34Å; H524-R528 PolarHBondContact NE2-NE 2.9Å; H524-R528 PolarHBondContact NE2-NH2 3.5Å; H524-R528 VanDerWaalsContact O-CG 3.29Å; H524-R528 WeakPolarHBondContact O-CG 3.45Å; H524-R528 PolarHBondContact O-N 3.13Å; H524-Y571 HydrophobicContact CB-CD1 4.16Å; H524-Y571 AromaticContact CG-CD1 3.87Å; H524-Y571 AromaticContact ND1-CD1 3.61Å
525A97.1Very high93.2Very high1 Ų122.5 Ų22.51%0.00812%0.123CC..Hα-helixtrans-58.5-46.1175.700000111.1I485 M489 L507 Y521 A522 E527 R528 L529I485-A525 HydrophobicContact CG2-CB 3.76Å; M489-A525 HydrophobicContact CB-CB 4.16Å; L507-A525 HydrophobicContact CD1-CB 3.96Å; L507-A525 HydrophobicContact CD2-CB 4.26Å; Y521-A525 VanDerWaalsContact O-CB 3.26Å; Y521-A525 WeakPolarHBondContact O-CB 3.45Å; Y521-A525 PolarHBondContact O-N 3Å; A522-A525 PolarHBondContact O-N 2.85Å; A525-E527 PolarHBondContact O-N 3.43Å; A525-R528 PolarHBondContact O-N 3.08Å; A525-L529 WeakPolarHBondContact O-CB 3.5Å; A525-L529 VanDerWaalsContact O-CG 3.23Å; A525-L529 WeakPolarHBondContact O-CG 3.25Å; A525-L529 PolarHBondContact O-N 3.08Å
526L97.6Very high92.3Very high1 Ų128.5 Ų28.51%0.00515%0.153CC..Hα-helixtrans-59.2-47.6176.7-72.6167.4000112.2V504 L507 I508 L511 A522 A523 H524 R528 L529 F530 L553V504-L526 HydrophobicContact CG1-CD2 4.34Å; L507-L526 HydrophobicContact CB-CD1 4.34Å; L507-L526 HydrophobicContact CB-CD2 3.87Å; L507-L526 HydrophobicContact CB-CG 3.94Å; L507-L526 HydrophobicContact CD1-CD2 4.23Å; L507-L526 HydrophobicContact CD1-CG 4.43Å; I508-L526 HydrophobicContact CG1-CD1 4.14Å; I508-L526 HydrophobicContact CG1-CD2 4.18Å; L511-L526 HydrophobicContact CD1-CD1 3.87Å; L511-L526 HydrophobicContact CD2-CD1 4.39Å; L511-L526 HydrophobicContact CG-CD1 4.22Å; A522-L526 VanDerWaalsContact O-CG 3.3Å; A522-L526 WeakPolarHBondContact O-CG 3.44Å; A522-L526 PolarHBondContact O-N 3.36Å; A523-L526 PolarHBondContact O-N 3.49Å; H524-L526 VanDerWaalsContact C-N 3.34Å; H524-L526 PolarHBondContact O-N 3.17Å; L526-R528 VanDerWaalsContact C-N 3.31Å; L526-R528 PolarHBondContact O-N 3.26Å; L526-L529 PolarHBondContact O-N 3.07Å; L526-F530 HydrophobicContact CB-CE2 4.16Å; L526-F530 HydrophobicContact CB-CZ 4.23Å; L526-F530 HydrophobicContact CD2-CE1 4.33Å; L526-F530 HydrophobicContact CD2-CZ 3.93Å; L526-F530 WeakPolarHBondContact O-CD1 3.39Å; L526-F530 WeakPolarHBondContact O-CD2 3.29Å; L526-F530 WeakPolarHBondContact O-CG 3.24Å; L526-F530 PolarHBondContact O-N 3.18Å; L526-L553 HydrophobicContact CD1-CD1 3.98Å
527E94.4Very high91.4Very high3 Ų333.4 Ų33.41%0.01418%0.178CC..Hα-helixtrans-61.5-40.3179.396.582.3-173.700111.9A523 H524 A525 F530 T531 K574 A575 R578A523-E527 PolarHBondContact O-N 3.14Å; H524-E527 IonicContact CE1-OE1 3.43Å; H524-E527 IonicContact ND1-OE1 2.74Å; H524-E527 WeakPolarHBondContact O-CG 3.29Å; H524-E527 PolarHBondContact O-N 3.22Å; A525-E527 PolarHBondContact O-N 3.43Å; E527-F530 PolarHBondContact O-N 2.82Å; E527-T531 WeakPolarHBondContact O-CG2 3.39Å; E527-T531 PolarHBondContact O-N 2.97Å; E527-T531 PolarHBondContact O-OG1 3.2Å; E527-K574 HydrophobicContact CG-CD 4.35Å; E527-K574 HydrophobicContact CG-CG 4.45Å; E527-K574 WeakPolarHBondContact OE1-CE 3.42Å; E527-K574 IonicContact OE1-NZ 3.88Å; E527-A575 HydrophobicContact CB-CB 4.23Å; E527-R578 HydrophobicContact CB-CB 4.19Å; E527-R578 HydrophobicContact CB-CG 3.96Å; E527-R578 WeakPolarHBondContact OE2-CG 3.4Å; E527-R578 IonicContact OE2-NE 2.86Å; E527-R578 PolarHBondContact OE2-NE 2.82Å
528R93.8Very high90.5Very high49 Ų4936.2 Ų36.219%0.18520%0.202CC..Hα-helixtrans-65.6-42.5176.6-67.1-60-174.5179.4-2.2111.8Q444 H524 A525 L526 T531 M532Q444-R528 PolarHBondContact O-NH1 3.47Å; H524-R528 PolarHBondContact CE1-NE 3.29Å; H524-R528 PolarHBondContact CE1-NH2 2.75Å; H524-R528 VanDerWaalsContact CE1-NH2 3.34Å; H524-R528 PolarHBondContact NE2-NE 2.9Å; H524-R528 PolarHBondContact NE2-NH2 3.5Å; H524-R528 VanDerWaalsContact O-CG 3.29Å; H524-R528 WeakPolarHBondContact O-CG 3.45Å; H524-R528 PolarHBondContact O-N 3.13Å; A525-R528 PolarHBondContact O-N 3.08Å; L526-R528 VanDerWaalsContact C-N 3.31Å; L526-R528 PolarHBondContact O-N 3.26Å; R528-T531 PolarHBondContact O-N 3.48Å; R528-T531 PolarHBondContact O-OG1 2.98Å; R528-M532 WeakPolarHBondContact O-CG 3.34Å; R528-M532 PolarHBondContact O-N 3.49Å
529L94.2Very high89.9Confident0 Ų038.6 Ų38.60%022%0.217CC..Hα-helixtrans-64.2-40.2177.7-70175.7000111.9V488 R492 L500 V504 L507 A525 L526 T531 M532 I541V488-L529 HydrophobicContact CG1-CD1 4.46Å; R492-L529 HydrophobicContact CB-CD2 3.92Å; L500-L529 HydrophobicContact CD1-CD2 4.35Å; L500-L529 HydrophobicContact CD2-CD2 3.89Å; L500-L529 HydrophobicContact CG-CD2 4.49Å; V504-L529 HydrophobicContact CG2-CD1 4.33Å; L507-L529 HydrophobicContact CD1-CD1 3.62Å; A525-L529 WeakPolarHBondContact O-CB 3.5Å; A525-L529 VanDerWaalsContact O-CG 3.23Å; A525-L529 WeakPolarHBondContact O-CG 3.25Å; A525-L529 PolarHBondContact O-N 3.08Å; L526-L529 PolarHBondContact O-N 3.07Å; L529-T531 PolarHBondContact O-N 3.31Å; L529-M532 HydrophobicContact CD2-SD 3.89Å; L529-M532 WeakPolarHBondContact O-CB 3.41Å; L529-M532 PolarHBondContact O-N 3.31Å; L529-I541 HydrophobicContact CB-CD1 3.82Å
530F92.1Very high89.5Confident7 Ų740 Ų403%0.03122%0.224CC..Hα-helixtrans-68.8-18.7179.8-62.2-17.5000114.1L526 E527 I541 M546 L553 L582L526-F530 HydrophobicContact CB-CE2 4.16Å; L526-F530 HydrophobicContact CB-CZ 4.23Å; L526-F530 HydrophobicContact CD2-CE1 4.33Å; L526-F530 HydrophobicContact CD2-CZ 3.93Å; L526-F530 WeakPolarHBondContact O-CD1 3.39Å; L526-F530 WeakPolarHBondContact O-CD2 3.29Å; L526-F530 WeakPolarHBondContact O-CG 3.24Å; L526-F530 PolarHBondContact O-N 3.18Å; E527-F530 PolarHBondContact O-N 2.82Å; F530-I541 HydrophobicContact CD1-CG2 4.46Å; F530-M546 HydrophobicContact CE1-CE 3.88Å; F530-M546 HydrophobicContact CE1-CG 4.44Å; F530-M546 HydrophobicContact CE1-SD 3.84Å; F530-M546 HydrophobicContact CZ-CE 3.69Å; F530-M546 HydrophobicContact CZ-SD 4.29Å; F530-L553 HydrophobicContact CE2-CD2 4.04Å; F530-L553 HydrophobicContact CZ-CD2 3.99Å; F530-L582 HydrophobicContact CB-CD2 3.94Å; F530-L582 HydrophobicContact CD1-CD2 3.44Å; F530-L582 VanDerWaalsContact CD1-CD2 3.44Å; F530-L582 HydrophobicContact CD2-CD2 4.06Å; F530-L582 HydrophobicContact CE1-CD2 3.89Å; F530-L582 HydrophobicContact CE2-CD2 4.46Å; F530-L582 HydrophobicContact CG-CD2 3.54Å; F530-L582 HydrophobicContact CZ-CD2 4.38Å
531T89.6Confident89.2Confident40 Ų4040.1 Ų40.125%0.24522%0.224CC..Hα-helixtrans-96.2-5.5177.955.70000113.6E527 R528 L529 R533 R578E527-T531 WeakPolarHBondContact O-CG2 3.39Å; E527-T531 PolarHBondContact O-N 2.97Å; E527-T531 PolarHBondContact O-OG1 3.2Å; R528-T531 PolarHBondContact O-N 3.48Å; R528-T531 PolarHBondContact O-OG1 2.98Å; L529-T531 PolarHBondContact O-N 3.31Å; T531-R533 PolarHBondContact O-NH1 3.09Å; T531-R578 HydrophobicContact CG2-CG 4.34Å; T531-R578 VanDerWaalsContact CG2-NE 3.34Å
532M89.2Confident88.9Confident27 Ų2742.5 Ų42.513%0.13324%0.239CC..  trans-63.3145.2178.9-72.7-172.272.200112.5R492 L500 R528 L529 L540R492-M532 HydrophobicContact CB-CE 4.33Å; R492-M532 HydrophobicContact CB-SD 3.73Å; R492-M532 HydrophobicContact CG-CE 4.27Å; R492-M532 HydrophobicContact CG-SD 3.84Å; R492-M532 WeakPolarHBondContact O-CE 3.39Å; L500-M532 HydrophobicContact CD1-SD 4.34Å; R528-M532 WeakPolarHBondContact O-CG 3.34Å; R528-M532 PolarHBondContact O-N 3.49Å; L529-M532 HydrophobicContact CD2-SD 3.89Å; L529-M532 WeakPolarHBondContact O-CB 3.41Å; L529-M532 PolarHBondContact O-N 3.31Å; M532-L540 HydrophobicContact CB-CB 3.86Å; M532-L540 HydrophobicContact CB-CD2 3.98Å; M532-L540 HydrophobicContact CE-CD2 3.64Å; M532-L540 PolarHBondContact O-N 3.33Å; M532-L540 HydrophobicContact SD-CD2 3.88Å
533R85.1Confident88.6Confident123 Ų12344.4 Ų44.446%0.46425%0.253SS..BIsolated β-bridgetrans-121.5134.5178.2-60.4-61.6-173.7-115.58.5109.6T531 N537 A538 T539T531-R533 PolarHBondContact O-NH1 3.09Å; R533-N537 WeakPolarHBondContact CD-O 3.5Å; R533-A538 CarbonylContact C-O 3.4Å; R533-A538 WeakPolarHBondContact CA-O 3.33Å; R533-T539 PolarHBondContact NH1-OG1 3.18Å
534G78.9Confident88.4Confident20 Ų2048.2 Ų48.221%0.20628%0.284CS..  trans-81.5-175.5173.400000112.9N536 N537 A538G534-N536 PolarHBondContact O-N 2.95Å; G534-N537 PolarHBondContact O-N 3.35Å; G534-A538 PolarHBondContact N-O 3Å
535P74.1Confident88.2Confident144 Ų14450.5 Ų50.594%0.93530%0.295SS*.THydrogen-bonded Turntrans-56-27.7-174.5-26.634.6000115.3
536N75.8Confident88.1Confident151 Ų15150.6 Ų50.681%0.80730%0.295SS*.THydrogen-bonded Turntrans-98.319.3179.1-64.5-14.5000113.3G534 A538G534-N536 PolarHBondContact O-N 2.95Å; N536-A538 PolarHBondContact O-N 3.49Å
537N77.4Confident88Confident124 Ų12453.5 Ų53.566%0.66332%0.32SS*.SBendtrans58.115-171.6-158.329.8000114.4R533 G534R533-N537 WeakPolarHBondContact CD-O 3.5Å; G534-N537 PolarHBondContact O-N 3.35Å
538A79.4Confident88Confident60 Ų6058.3 Ų58.350%0.49635%0.351SS..  trans-76.5147.2171.900000110.3R533 G534 N536 L540R533-A538 CarbonylContact C-O 3.4Å; R533-A538 WeakPolarHBondContact CA-O 3.33Å; G534-A538 PolarHBondContact N-O 3Å; N536-A538 PolarHBondContact O-N 3.49Å; A538-L540 PolarHBondContact O-N 3.01Å
539T83.5Confident88.2Confident50 Ų5059 Ų5931%0.30736%0.355SS..BIsolated β-bridgetrans-60.1129.8175.4-46.60000110.2R533 I541 L582R533-T539 PolarHBondContact NH1-OG1 3.18Å; T539-I541 WeakPolarHBondContact CG2-O 3.14Å; T539-L582 HydrophobicContact CG2-CD1 4.1Å
540L88Confident88.2Confident30 Ų3059.3 Ų59.316%0.15736%0.357CS..SBendtrans-66.7-45.7-175.7-175.466.7000112.2K497 L500 M532 A538K497-L540 HydrophobicContact CB-CD1 4.41Å; K497-L540 HydrophobicContact CD-CD1 3.94Å; K497-L540 HydrophobicContact CD-CG 4.49Å; K497-L540 WeakPolarHBondContact CE-O 3.3Å; K497-L540 HydrophobicContact CG-CD1 4.23Å; K497-L540 PolarHBondContact NZ-O 3.43Å; L500-L540 HydrophobicContact CD1-CD2 3.82Å; M532-L540 HydrophobicContact CB-CB 3.86Å; M532-L540 HydrophobicContact CB-CD2 3.98Å; M532-L540 HydrophobicContact CE-CD2 3.64Å; M532-L540 PolarHBondContact O-N 3.33Å; M532-L540 HydrophobicContact SD-CD2 3.88Å; A538-L540 PolarHBondContact O-N 3.01Å
541I91.8Very high88.4Confident1 Ų164.9 Ų64.91%0.00538%0.383CS..SBendtrans-104.7126173.9-59.8175.3000108L501 V504 L529 F530 T539 E545 M546 L582L501-I541 HydrophobicContact CD2-CG1 4.2Å; L501-I541 HydrophobicContact CD2-CG2 4.44Å; V504-I541 HydrophobicContact CG2-CD1 3.83Å; L529-I541 HydrophobicContact CB-CD1 3.82Å; F530-I541 HydrophobicContact CD1-CG2 4.46Å; T539-I541 WeakPolarHBondContact CG2-O 3.14Å; I541-E545 WeakPolarHBondContact CA-OE2 3.37Å; I541-M546 HydrophobicContact CG2-CG 3.86Å; I541-M546 HydrophobicContact CG2-SD 3.84Å; I541-L582 WeakPolarHBondContact O-CD1 3.44Å
542T92.1Very high88.8Confident53 Ų5366.7 Ų66.733%0.32539%0.389SS..  trans-104.4161.3-173.262.60000112.1A544 E545 M546T542-A544 PolarHBondContact O-N 3Å; T542-E545 PolarHBondContact N-OE2 3.29Å; T542-E545 PolarHBondContact O-N 3.06Å; T542-E545 WeakPolarHBondContact OG1-CG 3.31Å; T542-E545 PolarHBondContact OG1-N 3.25Å; T542-E545 PolarHBondContact OG1-OE2 3.24Å; T542-M546 PolarHBondContact O-N 2.79Å
543S92Very high89.2Confident40 Ų4065.4 Ų65.428%0.2838%0.383SS..Hα-helixtrans-58-30.3173.4-175.20000112.8M546 A547 L583S543-M546 PolarHBondContact O-N 3.24Å; S543-A547 PolarHBondContact O-N 2.94Å; S543-A547 VanDerWaalsContact O-N 3.14Å; S543-L583 PolarHBondContact OG-O 3.03Å
544A92.6Very high89.8Confident80 Ų8059.7 Ų59.766%0.66136%0.362SS*.Hα-helixtrans-68.9-40.9178.400000111.9T542 M546 A547T542-A544 PolarHBondContact O-N 3Å; A544-M546 VanDerWaalsContact C-N 3.26Å; A544-M546 PolarHBondContact O-N 3.44Å; A544-A547 WeakPolarHBondContact O-CB 3.48Å; A544-A547 PolarHBondContact O-N 3.26Å
545E94.2Very high90.7Very high57 Ų5762.6 Ų62.627%0.26638%0.375SS..Hα-helixtrans-67.6-28.9176.1-70.2160.6146.300111.9K497 L501 I541 T542K497-E545 WeakPolarHBondContact CE-OE1 3.4Å; K497-E545 IonicContact NZ-OE1 3.16Å; K497-E545 PolarHBondContact NZ-OE1 3.14Å; K497-E545 IonicContact NZ-OE2 2.74Å; L501-E545 HydrophobicContact CD2-CB 4.25Å; L501-E545 HydrophobicContact CD2-CG 4.46Å; I541-E545 WeakPolarHBondContact CA-OE2 3.37Å; T542-E545 PolarHBondContact N-OE2 3.29Å; T542-E545 PolarHBondContact O-N 3.06Å; T542-E545 WeakPolarHBondContact OG1-CG 3.31Å; T542-E545 PolarHBondContact OG1-N 3.25Å; T542-E545 PolarHBondContact OG1-OE2 3.24Å
546M95.4Very high91.8Very high2 Ų256 Ų561%0.0133%0.332CS..Hα-helixtrans-85-10.7177.4-66.3-55.2-6000114.6V504 I508 F530 I541 T542 S543 A544 P548 F549 T550 L553 L582 L583V504-M546 HydrophobicContact CG1-CE 3.77Å; V504-M546 HydrophobicContact CG1-SD 3.66Å; I508-M546 HydrophobicContact CD1-CE 4.08Å; F530-M546 HydrophobicContact CE1-CE 3.88Å; F530-M546 HydrophobicContact CE1-CG 4.44Å; F530-M546 HydrophobicContact CE1-SD 3.84Å; F530-M546 HydrophobicContact CZ-CE 3.69Å; F530-M546 HydrophobicContact CZ-SD 4.29Å; I541-M546 HydrophobicContact CG2-CG 3.86Å; I541-M546 HydrophobicContact CG2-SD 3.84Å; T542-M546 PolarHBondContact O-N 2.79Å; S543-M546 PolarHBondContact O-N 3.24Å; A544-M546 VanDerWaalsContact C-N 3.26Å; A544-M546 PolarHBondContact O-N 3.44Å; M546-P548 VanDerWaalsContact C-CD 3.42Å; M546-F549 HydrophobicContact CE-CB 4.46Å; M546-F549 PolarHBondContact O-N 3.1Å; M546-T550 PolarHBondContact O-N 3.25Å; M546-T550 PolarHBondContact O-OG1 3.28Å; M546-L553 HydrophobicContact CE-CD2 3.89Å; M546-L582 HydrophobicContact CG-CD2 3.82Å; M546-L583 HydrophobicContact CB-CD2 3.74Å
547A93.9Very high92.9Very high63 Ų6348.9 Ų48.952%0.52129%0.294SS..G310 helixtrans-53.4-42.8-175.400000113.7S543 A544 F549S543-A547 PolarHBondContact O-N 2.94Å; S543-A547 VanDerWaalsContact O-N 3.14Å; A544-A547 WeakPolarHBondContact O-CB 3.48Å; A544-A547 PolarHBondContact O-N 3.26Å; A547-F549 PolarHBondContact O-N 3.46Å
548P95.9Very high93.8Very high103 Ų10343.5 Ų43.567%0.66927%0.265SS*.G310 helixtrans-66.5-20.4179.2-20.333.8000114.5M546M546-P548 VanDerWaalsContact C-CD 3.42Å
549F96.3Very high94.6Very high63 Ų6345.6 Ų45.628%0.27626%0.263SS..G310 helixtrans-112.62.7-170.5-48.6-67.1000113P505 I508 M546 A547 E551 Q552 L553P505-F549 HydrophobicContact CB-CD1 4.14Å; P505-F549 HydrophobicContact CB-CE1 3.81Å; P505-F549 HydrophobicContact CB-CZ 4.11Å; P505-F549 HydrophobicContact CG-CE1 4.47Å; P505-F549 HydrophobicContact CG-CZ 4.31Å; I508-F549 HydrophobicContact CD1-CB 3.73Å; I508-F549 HydrophobicContact CD1-CG 4.41Å; M546-F549 HydrophobicContact CE-CB 4.46Å; M546-F549 PolarHBondContact O-N 3.1Å; A547-F549 PolarHBondContact O-N 3.46Å; F549-E551 PolarHBondContact O-N 3.43Å; F549-Q552 PolarHBondContact O-N 3.29Å; F549-L553 VanDerWaalsContact O-CB 3.25Å; F549-L553 WeakPolarHBondContact O-CB 3.45Å; F549-L553 PolarHBondContact O-N 2.84Å
550T95.8Very high95.2Very high8 Ų843.2 Ų43.25%0.04925%0.248CC..Hα-helixtrans-60.3-50.9-170.9-67.30000112.3M546 Q552 L553 L554 L583 Y590M546-T550 PolarHBondContact O-N 3.25Å; M546-T550 PolarHBondContact O-OG1 3.28Å; T550-Q552 PolarHBondContact O-N 2.88Å; T550-L553 PolarHBondContact O-N 3.35Å; T550-L554 HydrophobicContact CG2-CD1 3.94Å; T550-L554 VanDerWaalsContact O-CG 3.27Å; T550-L554 WeakPolarHBondContact O-CG 3.28Å; T550-L554 PolarHBondContact O-N 3.01Å; T550-L583 HydrophobicContact CG2-CD1 3.92Å; T550-L583 HydrophobicContact CG2-CD2 4.49Å; T550-Y590 HydrophobicContact CG2-CD2 4.47Å; T550-Y590 HydrophobicContact CG2-CE2 3.92Å
551E96.1Very high95.6Very high123 Ų12342 Ų4258%0.57524%0.242SC*.Hα-helixtrans-62.2-44.1179.6-176.4174.6170.500112.1F549 L554 T555 Y590F549-E551 PolarHBondContact O-N 3.43Å; E551-L554 PolarHBondContact O-N 3.13Å; E551-T555 VanDerWaalsContact O-CB 3.26Å; E551-T555 WeakPolarHBondContact O-CB 3.22Å; E551-T555 PolarHBondContact O-N 3.28Å; E551-T555 PolarHBondContact O-OG1 2.99Å; E551-Y590 HydrophobicContact CB-CE1 3.96Å; E551-Y590 HydrophobicContact CG-CE1 3.94Å
552Q97.3Very high95.8Very high78 Ų7846.5 Ų46.536%0.36427%0.27SS..Hα-helixtrans-66-43.7-179.9-168.4-177.39.500111.6I508 F549 T550 T555 N556I508-Q552 HydrophobicContact CG2-CB 4.3Å; I508-Q552 HydrophobicContact CG2-CG 3.81Å; F549-Q552 PolarHBondContact O-N 3.29Å; T550-Q552 PolarHBondContact O-N 2.88Å; Q552-T555 PolarHBondContact O-N 3Å; Q552-N556 VanDerWaalsContact O-CB 3.24Å; Q552-N556 WeakPolarHBondContact O-CB 3.39Å; Q552-N556 PolarHBondContact O-N 2.91Å
553L98Very high95.9Very high1 Ų145.4 Ų45.41%0.00526%0.261CS..Hα-helixtrans-57.3-52.8175.9172.365000111.1I508 L511 L526 F530 M546 F549 T550 N556 L557 L583I508-L553 HydrophobicContact CD1-CB 4.02Å; I508-L553 HydrophobicContact CD1-CD1 4.27Å; I508-L553 HydrophobicContact CG1-CB 4.33Å; I508-L553 HydrophobicContact CG1-CD1 3.89Å; L511-L553 HydrophobicContact CD1-CD1 4.35Å; L526-L553 HydrophobicContact CD1-CD1 3.98Å; F530-L553 HydrophobicContact CE2-CD2 4.04Å; F530-L553 HydrophobicContact CZ-CD2 3.99Å; M546-L553 HydrophobicContact CE-CD2 3.89Å; F549-L553 VanDerWaalsContact O-CB 3.25Å; F549-L553 WeakPolarHBondContact O-CB 3.45Å; F549-L553 PolarHBondContact O-N 2.84Å; T550-L553 PolarHBondContact O-N 3.35Å; L553-N556 PolarHBondContact O-N 3.35Å; L553-L557 HydrophobicContact CD1-CD1 3.71Å; L553-L557 HydrophobicContact CD1-CG 4.06Å; L553-L557 HydrophobicContact CG-CD1 3.98Å; L553-L557 WeakPolarHBondContact O-CB 3.36Å; L553-L557 VanDerWaalsContact O-CG 3.29Å; L553-L557 WeakPolarHBondContact O-CG 3.27Å; L553-L557 PolarHBondContact O-N 3Å; L553-L583 HydrophobicContact CD2-CD1 4.37Å
554L97.5Very high95.9Very high3 Ų348.9 Ų48.92%0.01628%0.283CS..Hα-helixtrans-64.1-45.9-177.8-66.4174.8000111T550 E551 N556 L557 F558 F580 I587 Y590 L594T550-L554 HydrophobicContact CG2-CD1 3.94Å; T550-L554 VanDerWaalsContact O-CG 3.27Å; T550-L554 WeakPolarHBondContact O-CG 3.28Å; T550-L554 PolarHBondContact O-N 3.01Å; E551-L554 PolarHBondContact O-N 3.13Å; L554-N556 PolarHBondContact O-N 3.25Å; L554-L557 PolarHBondContact O-N 3.34Å; L554-F558 VanDerWaalsContact O-CD2 3.31Å; L554-F558 WeakPolarHBondContact O-CD2 3.2Å; L554-F558 PolarHBondContact O-N 2.97Å; L554-F558 VanDerWaalsContact O-N 3.17Å; L554-F580 HydrophobicContact CD2-CD1 4.13Å; L554-F580 HydrophobicContact CD2-CE1 3.75Å; L554-I587 HydrophobicContact CD1-CG2 4.43Å; L554-Y590 HydrophobicContact CD1-CD2 4.04Å; L554-Y590 HydrophobicContact CD1-CG 4.02Å; L554-L594 HydrophobicContact CD1-CD1 4.2Å; L554-L594 HydrophobicContact CD2-CD1 4.32Å
555T96.9Very high95.6Very high81 Ų8148.7 Ų48.750%0.49729%0.289SS..Hα-helixtrans-59.9-46.2178.3-58.90000111.4E551 Q552 K559E551-T555 VanDerWaalsContact O-CB 3.26Å; E551-T555 WeakPolarHBondContact O-CB 3.22Å; E551-T555 PolarHBondContact O-N 3.28Å; E551-T555 PolarHBondContact O-OG1 2.99Å; Q552-T555 PolarHBondContact O-N 3Å; T555-K559 VanDerWaalsContact O-CB 3.28Å; T555-K559 WeakPolarHBondContact O-CB 3.44Å; T555-K559 PolarHBondContact O-N 3.11Å
556N97.9Very high95.6Very high6 Ų646 Ų463%0.03228%0.276CS..Hα-helixtrans-70.1-39.7-177.4-72.8-2.7000112.7I508 L511 Q512 Q552 L553 L554 F558 K559 A560I508-N556 PolarHBondContact O-ND2 3.31Å; L511-N556 HydrophobicContact CB-CB 3.86Å; L511-N556 HydrophobicContact CD1-CB 3.89Å; Q512-N556 HydrophobicContact CG-CB 4.49Å; Q512-N556 VanDerWaalsContact NE2-CG 3.32Å; Q512-N556 PolarHBondContact NE2-ND2 2.78Å; Q512-N556 VanDerWaalsContact NE2-ND2 3.14Å; Q512-N556 PolarHBondContact NE2-OD1 3.1Å; Q552-N556 VanDerWaalsContact O-CB 3.24Å; Q552-N556 WeakPolarHBondContact O-CB 3.39Å; Q552-N556 PolarHBondContact O-N 2.91Å; L553-N556 PolarHBondContact O-N 3.35Å; L554-N556 PolarHBondContact O-N 3.25Å; N556-F558 PolarHBondContact O-N 3.28Å; N556-K559 PolarHBondContact O-N 3.45Å; N556-A560 WeakPolarHBondContact O-CB 3.48Å; N556-A560 PolarHBondContact O-N 3.2Å
557L98.2Very high95.5Very high0 Ų048 Ų480%029%0.293CS..Hα-helixtrans-60.9-45.1176.3-77.1172.2000112L511 A523 L553 L554 A560 L561 I572 A575 I576 S579L511-L557 HydrophobicContact CD1-CD2 3.72Å; L511-L557 HydrophobicContact CD1-CG 3.8Å; L511-L557 HydrophobicContact CD2-CD2 3.89Å; L511-L557 HydrophobicContact CG-CD2 4.49Å; A523-L557 HydrophobicContact CB-CD2 4.39Å; L553-L557 HydrophobicContact CD1-CD1 3.71Å; L553-L557 HydrophobicContact CD1-CG 4.06Å; L553-L557 HydrophobicContact CG-CD1 3.98Å; L553-L557 WeakPolarHBondContact O-CB 3.36Å; L553-L557 VanDerWaalsContact O-CG 3.29Å; L553-L557 WeakPolarHBondContact O-CG 3.27Å; L553-L557 PolarHBondContact O-N 3Å; L554-L557 PolarHBondContact O-N 3.34Å; L557-A560 PolarHBondContact O-N 3.37Å; L557-L561 PolarHBondContact O-N 2.95Å; L557-I572 HydrophobicContact CD2-CG2 4.34Å; L557-I572 WeakPolarHBondContact O-CG2 3.16Å; L557-A575 HydrophobicContact CD2-CB 3.75Å; L557-I576 HydrophobicContact CB-CD1 4.35Å; L557-I576 HydrophobicContact CB-CG1 3.75Å; L557-I576 HydrophobicContact CD1-CG1 4.05Å; L557-I576 HydrophobicContact CG-CG1 4.37Å; L557-S579 WeakPolarHBondContact CD1-OG 3.29Å
558F97Very high95.5Very high12 Ų1248 Ų485%0.05328%0.283CS..Hα-helixtrans-71.8-34.4178-82.7-96.3000112.2L554 N556 A560 L561 I576 F580 L594 Q597 L598L554-F558 VanDerWaalsContact O-CD2 3.31Å; L554-F558 WeakPolarHBondContact O-CD2 3.2Å; L554-F558 PolarHBondContact O-N 2.97Å; L554-F558 VanDerWaalsContact O-N 3.17Å; N556-F558 PolarHBondContact O-N 3.28Å; F558-A560 VanDerWaalsContact C-N 3.31Å; F558-A560 PolarHBondContact O-N 3.23Å; F558-L561 PolarHBondContact O-N 3.37Å; F558-I576 HydrophobicContact CD2-CD1 4.05Å; F558-I576 HydrophobicContact CD2-CG1 4.36Å; F558-I576 HydrophobicContact CE1-CD1 4.44Å; F558-I576 HydrophobicContact CE2-CD1 3.93Å; F558-I576 HydrophobicContact CE2-CG1 4.12Å; F558-I576 HydrophobicContact CE2-CG2 3.81Å; F558-I576 HydrophobicContact CG-CD1 4.37Å; F558-I576 HydrophobicContact CZ-CD1 4.15Å; F558-I576 HydrophobicContact CZ-CG2 3.95Å; F558-F580 HydrophobicContact CE2-CE1 4.36Å; F558-F580 HydrophobicContact CE2-CZ 4.17Å; F558-F580 HydrophobicContact CZ-CZ 4.14Å; F558-L594 HydrophobicContact CD2-CD2 3.8Å; F558-L594 HydrophobicContact CE1-CD2 4.39Å; F558-L594 HydrophobicContact CE2-CB 4.48Å; F558-L594 HydrophobicContact CE2-CD1 4.2Å; F558-L594 HydrophobicContact CE2-CD2 3.63Å; F558-L594 HydrophobicContact CE2-CG 4.3Å; F558-L594 HydrophobicContact CG-CD2 4.25Å; F558-L594 HydrophobicContact CZ-CB 4.09Å; F558-L594 HydrophobicContact CZ-CD2 3.93Å; F558-L594 HydrophobicContact CZ-CG 4.39Å; F558-Q597 VanDerWaalsContact CB-OE1 3.32Å; F558-Q597 HydrophobicContact CD1-CB 3.91Å; F558-Q597 HydrophobicContact CE1-CB 3.97Å; F558-L598 HydrophobicContact CE1-CD2 3.74Å; F558-L598 HydrophobicContact CE1-CG 3.89Å; F558-L598 HydrophobicContact CZ-CD1 4.41Å; F558-L598 HydrophobicContact CZ-CD2 3.83Å; F558-L598 HydrophobicContact CZ-CG 3.97Å
559K96.3Very high95.5Very high104 Ų10443.9 Ų43.945%0.45226%0.255SS..Hα-helixtrans-62.7-38171.4-173.1-178.2176.7-170.10111.6T555 N556 L561 T562 L563T555-K559 VanDerWaalsContact O-CB 3.28Å; T555-K559 WeakPolarHBondContact O-CB 3.44Å; T555-K559 PolarHBondContact O-N 3.11Å; N556-K559 PolarHBondContact O-N 3.45Å; K559-L561 PolarHBondContact O-N 2.9Å; K559-T562 WeakPolarHBondContact O-CA 3.48Å; K559-T562 WeakPolarHBondContact O-CB 3.49Å; K559-T562 PolarHBondContact O-N 3.38Å; K559-T562 PolarHBondContact O-OG1 3.43Å; K559-L563 PolarHBondContact O-N 3.18Å
560A97.2Very high95.4Very high0 Ų042.7 Ų42.70%025%0.25CS..Hα-helixtrans-62-32.5178.400000112.3N556 L557 F558 T562 L563 S566 I572N556-A560 WeakPolarHBondContact O-CB 3.48Å; N556-A560 PolarHBondContact O-N 3.2Å; L557-A560 PolarHBondContact O-N 3.37Å; F558-A560 VanDerWaalsContact C-N 3.31Å; F558-A560 PolarHBondContact O-N 3.23Å; A560-T562 PolarHBondContact O-N 3.48Å; A560-L563 HydrophobicContact CB-CD1 4.4Å; A560-L563 WeakPolarHBondContact O-CB 3.39Å; A560-L563 PolarHBondContact O-N 2.91Å; A560-L563 VanDerWaalsContact O-N 3.16Å; A560-S566 WeakPolarHBondContact O-CB 3.31Å; A560-I572 HydrophobicContact CB-CD1 3.78Å; A560-I572 HydrophobicContact CB-CG2 4.26Å
561L96.3Very high95.5Very high3 Ų343.5 Ų43.52%0.01625%0.252CS..THydrogen-bonded Turntrans-70-3.8170.6-65.2178.1000114.6L557 F558 K559 A567 I572 M573 I576 F614L557-L561 PolarHBondContact O-N 2.95Å; F558-L561 PolarHBondContact O-N 3.37Å; K559-L561 PolarHBondContact O-N 2.9Å; L561-A567 WeakPolarHBondContact O-CA 3.41Å; L561-I572 HydrophobicContact CD2-CB 3.87Å; L561-I572 HydrophobicContact CD2-CD1 4.41Å; L561-I572 HydrophobicContact CD2-CG2 3.69Å; L561-I572 HydrophobicContact CG-CB 4.49Å; L561-I572 HydrophobicContact CG-CG2 3.75Å; L561-M573 HydrophobicContact CD1-CE 3.67Å; L561-I576 HydrophobicContact CD1-CD1 3.6Å; L561-I576 HydrophobicContact CG-CD1 4.39Å; L561-F614 HydrophobicContact CD2-CE2 3.92Å
562T94.8Very high95.6Very high97 Ų9737.6 Ų37.660%0.59523%0.225SC*.THydrogen-bonded Turntrans-102.7-8.9173.571.50000112.6K559 A560K559-T562 WeakPolarHBondContact O-CA 3.48Å; K559-T562 WeakPolarHBondContact O-CB 3.49Å; K559-T562 PolarHBondContact O-N 3.38Å; K559-T562 PolarHBondContact O-OG1 3.43Å; A560-T562 PolarHBondContact O-N 3.48Å
563L94.8Very high95.6Very high29 Ų2933.9 Ų33.915%0.15221%0.208CC..SBendtrans-70.4146.9177.7-64.2173.5000110.9A513 H519 K559 A560 G565 S566A513-L563 VanDerWaalsContact O-CD1 3.29Å; A513-L563 WeakPolarHBondContact O-CD1 3.35Å; H519-L563 WeakPolarHBondContact ND1-CD1 3.43Å; K559-L563 PolarHBondContact O-N 3.18Å; A560-L563 HydrophobicContact CB-CD1 4.4Å; A560-L563 WeakPolarHBondContact O-CB 3.39Å; A560-L563 PolarHBondContact O-N 2.91Å; A560-L563 VanDerWaalsContact O-N 3.16Å; L563-G565 PolarHBondContact O-N 2.85Å; L563-S566 PolarHBondContact O-N 3.37Å; L563-S566 VanDerWaalsContact O-N 3.1Å
564P90.8Very high95.6Very high113 Ų11335.5 Ų35.573%0.73421%0.214SC*.THydrogen-bonded Turntrans-51.5140.2173.7-2534.7000111.6S566P564-S566 PolarHBondContact O-N 2.91Å; P564-S566 VanDerWaalsContact O-N 3.09Å
565G87.9Confident95.6Very high76 Ų7635.4 Ų35.478%0.78421%0.214SC*.THydrogen-bonded Turntrans71.5-4.8-178.900000115.8L563L563-G565 PolarHBondContact O-N 2.85Å
566S94.1Very high95.6Very high0 Ų031.5 Ų31.50%019%0.19CC..  trans-119.57.2-170.9-62.10000115.4H519 A560 L563 P564 E568 N569H519-S566 PolarHBondContact CE1-OG 3.36Å; H519-S566 PolarHBondContact NE2-OG 2.94Å; A560-S566 WeakPolarHBondContact O-CB 3.31Å; L563-S566 PolarHBondContact O-N 3.37Å; L563-S566 VanDerWaalsContact O-N 3.1Å; P564-S566 PolarHBondContact O-N 2.91Å; P564-S566 VanDerWaalsContact O-N 3.09Å; S566-E568 VanDerWaalsContact C-N 3.28Å; S566-E568 PolarHBondContact O-N 3.48Å; S566-N569 WeakPolarHBondContact O-CB 3.4Å; S566-N569 PolarHBondContact O-N 3.47Å
567A93.1Very high95.6Very high44 Ų4431.5 Ų31.536%0.36419%0.19SC..THydrogen-bonded Turntrans-61.4-32.9-176.800000114.4L561L561-A567 WeakPolarHBondContact O-CA 3.41Å
568E94Very high95.4Very high65 Ų6535.3 Ų35.330%0.30420%0.204SC..THydrogen-bonded Turntrans-116.429.7178.2-65.5-178.7-137.100111.6S566 E570 V605 S610 K611 F614S566-E568 VanDerWaalsContact C-N 3.28Å; S566-E568 PolarHBondContact O-N 3.48Å; E568-E570 PolarHBondContact O-N 2.84Å; E568-V605 HydrophobicContact CG-CG1 3.85Å; E568-S610 PolarHBondContact OE2-OG 3.36Å; E568-S610 VanDerWaalsContact OE2-OG 3.14Å; E568-K611 HydrophobicContact CB-CB 4.42Å; E568-K611 HydrophobicContact CB-CG 3.9Å; E568-F614 HydrophobicContact CB-CD1 4.36Å; E568-F614 HydrophobicContact CB-CG 4.32Å; E568-F614 HydrophobicContact CG-CE1 4.44Å; E568-F614 WeakPolarHBondContact O-CD2 3.37Å
569N95.6Very high95.4Very high16 Ų1634.7 Ų34.79%0.08620%0.202CC..  trans-74.3112.4-178.2-172.8-49.3000112T520 S566 Y571 I572 M573 F614T520-N569 PolarHBondContact OG1-ND2 2.74Å; S566-N569 WeakPolarHBondContact O-CB 3.4Å; S566-N569 PolarHBondContact O-N 3.47Å; N569-Y571 VanDerWaalsContact C-N 3.34Å; N569-Y571 PolarHBondContact O-N 3.19Å; N569-Y571 WeakPolarHBondContact OD1-CB 3.21Å; N569-Y571 PolarHBondContact OD1-N 2.97Å; N569-Y571 VanDerWaalsContact OD1-N 3.1Å; N569-I572 HydrophobicContact CB-CB 4.4Å; N569-I572 HydrophobicContact CB-CD1 3.75Å; N569-I572 HydrophobicContact CB-CG1 4.06Å; N569-I572 PolarHBondContact O-N 3.39Å; N569-I572 PolarHBondContact OD1-N 3.27Å; N569-M573 PolarHBondContact O-N 3.2Å; N569-F614 WeakPolarHBondContact O-CD2 3.41Å
570E94.9Very high95.4Very high38 Ų3829.8 Ų29.818%0.17818%0.18CC..Hα-helixtrans-64.8-32.8-174.159.5174.8-116.200114.3E568 M573 K574 H613 F614E568-E570 PolarHBondContact O-N 2.84Å; E570-M573 PolarHBondContact O-N 3.36Å; E570-K574 VanDerWaalsContact O-CB 3.28Å; E570-K574 WeakPolarHBondContact O-CB 3.47Å; E570-K574 PolarHBondContact O-N 3.4Å; E570-H613 HydrophobicContact CB-CB 4.13Å; E570-H613 VanDerWaalsContact OE2-CB 3.23Å; E570-H613 WeakPolarHBondContact OE2-CB 3.37Å; E570-H613 IonicContact OE2-CD2 3.72Å; E570-H613 IonicContact OE2-CG 2.69Å; E570-F614 HydrophobicContact CB-CB 4.11Å
571Y96.3Very high95.2Very high24 Ų2431.4 Ų31.49%0.09419%0.192CC..Hα-helixtrans-69.1-37.7-179.6-61.1-86.5000111I370 L374 E375 T520 H524 N569 K574 A575I370-Y571 HydrophobicContact CG2-CD2 4.13Å; I370-Y571 HydrophobicContact CG2-CE2 3.61Å; L374-Y571 HydrophobicContact CB-CE1 4.48Å; L374-Y571 HydrophobicContact CD1-CD1 4.01Å; L374-Y571 HydrophobicContact CD1-CE1 3.55Å; E375-Y571 PolarHBondContact OE1-OH 3.48Å; T520-Y571 HydrophobicContact CG2-CD2 3.59Å; T520-Y571 HydrophobicContact CG2-CE2 4.46Å; T520-Y571 HydrophobicContact CG2-CG 3.78Å; H524-Y571 HydrophobicContact CB-CD1 4.16Å; H524-Y571 AromaticContact CG-CD1 3.87Å; H524-Y571 AromaticContact ND1-CD1 3.61Å; N569-Y571 VanDerWaalsContact C-N 3.34Å; N569-Y571 PolarHBondContact O-N 3.19Å; N569-Y571 WeakPolarHBondContact OD1-CB 3.21Å; N569-Y571 PolarHBondContact OD1-N 2.97Å; N569-Y571 VanDerWaalsContact OD1-N 3.1Å; Y571-K574 PolarHBondContact O-N 3.49Å; Y571-A575 WeakPolarHBondContact O-CB 3.25Å; Y571-A575 PolarHBondContact O-N 3.42Å
572I98.3Very high95Very high0 Ų032.2 Ų32.20%020%0.196CC..Hα-helixtrans-67.2-47175.2-57.6174.5000110.2A523 L557 A560 L561 N569 K574 A575 I576A523-I572 HydrophobicContact CB-CB 4.46Å; A523-I572 HydrophobicContact CB-CG1 3.96Å; L557-I572 HydrophobicContact CD2-CG2 4.34Å; L557-I572 WeakPolarHBondContact O-CG2 3.16Å; A560-I572 HydrophobicContact CB-CD1 3.78Å; A560-I572 HydrophobicContact CB-CG2 4.26Å; L561-I572 HydrophobicContact CD2-CB 3.87Å; L561-I572 HydrophobicContact CD2-CD1 4.41Å; L561-I572 HydrophobicContact CD2-CG2 3.69Å; L561-I572 HydrophobicContact CG-CB 4.49Å; L561-I572 HydrophobicContact CG-CG2 3.75Å; N569-I572 HydrophobicContact CB-CB 4.4Å; N569-I572 HydrophobicContact CB-CD1 3.75Å; N569-I572 HydrophobicContact CB-CG1 4.06Å; N569-I572 PolarHBondContact O-N 3.39Å; N569-I572 PolarHBondContact OD1-N 3.27Å; I572-K574 VanDerWaalsContact C-N 3.29Å; I572-K574 PolarHBondContact O-N 3.15Å; I572-A575 WeakPolarHBondContact O-CB 3.37Å; I572-A575 PolarHBondContact O-N 2.95Å; I572-A575 VanDerWaalsContact O-N 3.1Å; I572-I576 HydrophobicContact CG2-CD1 4.42Å; I572-I576 WeakPolarHBondContact O-CG1 3.39Å; I572-I576 PolarHBondContact O-N 3.16Å
573M98.2Very high95Very high0 Ų027.7 Ų27.70%017%0.168CC..Hα-helixtrans-63-37.4177.9-171.256.268.900112.1L561 N569 E570 I576 M577 L598 F614 L618L561-M573 HydrophobicContact CD1-CE 3.67Å; N569-M573 PolarHBondContact O-N 3.2Å; E570-M573 PolarHBondContact O-N 3.36Å; M573-I576 WeakPolarHBondContact O-CB 3.41Å; M573-I576 PolarHBondContact O-N 3.44Å; M573-I576 HydrophobicContact SD-CB 4.48Å; M573-I576 HydrophobicContact SD-CD1 4.26Å; M573-M577 PolarHBondContact O-N 2.88Å; M573-L598 HydrophobicContact CE-CD2 4.32Å; M573-L598 HydrophobicContact SD-CD2 4.24Å; M573-F614 HydrophobicContact CB-CD2 3.66Å; M573-F614 HydrophobicContact CB-CE2 3.73Å; M573-F614 HydrophobicContact CE-CE1 4.34Å; M573-F614 HydrophobicContact CE-CE2 3.6Å; M573-F614 HydrophobicContact CE-CZ 3.49Å; M573-F614 VanDerWaalsContact CE-CZ 3.49Å; M573-F614 HydrophobicContact CG-CD2 4.27Å; M573-F614 HydrophobicContact CG-CE2 4.21Å; M573-L618 HydrophobicContact CE-CB 4.15Å; M573-L618 HydrophobicContact CE-CD1 3.77Å; M573-L618 HydrophobicContact CE-CG 4.47Å; M573-L618 HydrophobicContact CG-CB 4.07Å; M573-L618 VanDerWaalsContact CG-N 3.32Å; M573-L618 HydrophobicContact SD-CB 4.1Å; M573-L618 HydrophobicContact SD-CD1 4.1Å
574K96.6Very high94.8Very high34 Ų3430.2 Ų30.215%0.14818%0.179CC..Hα-helixtrans-63.9-40.8172.3-169.6177.6-171.5160.40112.1E527 E570 Y571 I572 I576 M577 R578 Y617E527-K574 HydrophobicContact CG-CD 4.35Å; E527-K574 HydrophobicContact CG-CG 4.45Å; E527-K574 WeakPolarHBondContact OE1-CE 3.42Å; E527-K574 IonicContact OE1-NZ 3.88Å; E570-K574 VanDerWaalsContact O-CB 3.28Å; E570-K574 WeakPolarHBondContact O-CB 3.47Å; E570-K574 PolarHBondContact O-N 3.4Å; Y571-K574 PolarHBondContact O-N 3.49Å; I572-K574 VanDerWaalsContact C-N 3.29Å; I572-K574 PolarHBondContact O-N 3.15Å; K574-I576 VanDerWaalsContact C-N 3.34Å; K574-M577 HydrophobicContact CG-CE 4.21Å; K574-M577 WeakPolarHBondContact O-CB 3.45Å; K574-M577 PolarHBondContact O-N 3.05Å; K574-R578 WeakPolarHBondContact O-CG 3.4Å; K574-R578 PolarHBondContact O-N 3.33Å; K574-Y617 HydrophobicContact CB-CD1 4.24Å; K574-Y617 HydrophobicContact CB-CD2 3.73Å; K574-Y617 HydrophobicContact CB-CE1 4.35Å; K574-Y617 HydrophobicContact CB-CE2 3.87Å; K574-Y617 HydrophobicContact CB-CG 3.94Å; K574-Y617 HydrophobicContact CD-CE1 4Å; K574-Y617 HydrophobicContact CD-CE2 3.86Å; K574-Y617 WeakPolarHBondContact CE-OH 3.28Å; K574-Y617 HydrophobicContact CG-CD1 4.09Å; K574-Y617 HydrophobicContact CG-CD2 4.27Å; K574-Y617 HydrophobicContact CG-CE1 3.85Å; K574-Y617 HydrophobicContact CG-CE2 4.07Å; K574-Y617 HydrophobicContact CG-CG 4.3Å; K574-Y617 PolarHBondContact NZ-OH 2.59Å
575A97.9Very high94.9Very high1 Ų130.5 Ų30.51%0.00817%0.171CC..Hα-helixtrans-64.3-37.5175.100000112A523 E527 L557 Y571 I572 R578 S579A523-A575 HydrophobicContact CB-CB 3.93Å; A523-A575 WeakPolarHBondContact O-CB 3.45Å; E527-A575 HydrophobicContact CB-CB 4.23Å; L557-A575 HydrophobicContact CD2-CB 3.75Å; Y571-A575 WeakPolarHBondContact O-CB 3.25Å; Y571-A575 PolarHBondContact O-N 3.42Å; I572-A575 WeakPolarHBondContact O-CB 3.37Å; I572-A575 PolarHBondContact O-N 2.95Å; I572-A575 VanDerWaalsContact O-N 3.1Å; A575-R578 PolarHBondContact O-N 3.48Å; A575-S579 VanDerWaalsContact O-CB 3.3Å; A575-S579 WeakPolarHBondContact O-CB 2.86Å; A575-S579 PolarHBondContact O-N 2.94Å; A575-S579 PolarHBondContact O-OG 2.95Å
576I98.3Very high95.1Very high0 Ų028.9 Ų28.90%015%0.15CC..Hα-helixtrans-59.5-53.4170.9-68.6168.5000110.2L557 F558 L561 I572 M573 K574 R578 S579 F580L557-I576 HydrophobicContact CB-CD1 4.35Å; L557-I576 HydrophobicContact CB-CG1 3.75Å; L557-I576 HydrophobicContact CD1-CG1 4.05Å; L557-I576 HydrophobicContact CG-CG1 4.37Å; F558-I576 HydrophobicContact CD2-CD1 4.05Å; F558-I576 HydrophobicContact CD2-CG1 4.36Å; F558-I576 HydrophobicContact CE1-CD1 4.44Å; F558-I576 HydrophobicContact CE2-CD1 3.93Å; F558-I576 HydrophobicContact CE2-CG1 4.12Å; F558-I576 HydrophobicContact CE2-CG2 3.81Å; F558-I576 HydrophobicContact CG-CD1 4.37Å; F558-I576 HydrophobicContact CZ-CD1 4.15Å; F558-I576 HydrophobicContact CZ-CG2 3.95Å; L561-I576 HydrophobicContact CD1-CD1 3.6Å; L561-I576 HydrophobicContact CG-CD1 4.39Å; I572-I576 HydrophobicContact CG2-CD1 4.42Å; I572-I576 WeakPolarHBondContact O-CG1 3.39Å; I572-I576 PolarHBondContact O-N 3.16Å; M573-I576 WeakPolarHBondContact O-CB 3.41Å; M573-I576 PolarHBondContact O-N 3.44Å; M573-I576 HydrophobicContact SD-CB 4.48Å; M573-I576 HydrophobicContact SD-CD1 4.26Å; K574-I576 VanDerWaalsContact C-N 3.34Å; I576-R578 VanDerWaalsContact C-N 3.32Å; I576-R578 PolarHBondContact O-N 3.33Å; I576-S579 WeakPolarHBondContact O-CB 3.43Å; I576-S579 PolarHBondContact O-N 3.31Å; I576-S579 VanDerWaalsContact O-N 3.12Å; I576-F580 HydrophobicContact CG2-CD1 4.33Å; I576-F580 HydrophobicContact CG2-CE1 3.8Å; I576-F580 HydrophobicContact CG2-CE2 4.13Å; I576-F580 HydrophobicContact CG2-CZ 3.7Å; I576-F580 WeakPolarHBondContact O-CD1 3.4Å; I576-F580 PolarHBondContact O-N 3.35Å
577M96.8Very high95.1Very high6 Ų628.9 Ų28.93%0.0315%0.15CC..Hα-helixtrans-54.8-46.4177.8-176.6-159.166.500111.8M573 K574 F580 S581 Y617 E620 S621 L624 F908M573-M577 PolarHBondContact O-N 2.88Å; K574-M577 HydrophobicContact CG-CE 4.21Å; K574-M577 WeakPolarHBondContact O-CB 3.45Å; K574-M577 PolarHBondContact O-N 3.05Å; M577-F580 PolarHBondContact O-N 2.98Å; M577-S581 WeakPolarHBondContact O-CB 3.29Å; M577-S581 PolarHBondContact O-N 3.38Å; M577-Y617 HydrophobicContact CE-CD1 4.01Å; M577-Y617 HydrophobicContact CE-CE1 4.28Å; M577-Y617 HydrophobicContact SD-CD1 3.78Å; M577-Y617 HydrophobicContact SD-CE1 4.5Å; M577-E620 HydrophobicContact CG-CB 3.84Å; M577-E620 HydrophobicContact SD-CB 3.46Å; M577-E620 WeakPolarHBondContact SD-CB 3.27Å; M577-E620 HydrophobicContact SD-CG 3.92Å; M577-S621 WeakPolarHBondContact CA-OG 3.14Å; M577-S621 WeakPolarHBondContact CB-OG 3.42Å; M577-S621 PolarHBondContact N-OG 3.34Å; M577-L624 HydrophobicContact CG-CD1 3.73Å; M577-L624 VanDerWaalsContact O-CD1 3.24Å; M577-L624 WeakPolarHBondContact O-CD1 3.27Å; M577-F908 HydrophobicContact CG-CE2 3.99Å; M577-F908 HydrophobicContact SD-CE2 3.9Å
578R95.1Very high95.1Very high79 Ų7928.9 Ų28.930%0.29815%0.145SC..Hα-helixtrans-67.1-36.7178-72.9-56.1-171.7-164.2-5.5113.1E527 T531 K574 A575 I576 F580 S581 L582E527-R578 HydrophobicContact CB-CB 4.19Å; E527-R578 HydrophobicContact CB-CG 3.96Å; E527-R578 WeakPolarHBondContact OE2-CG 3.4Å; E527-R578 IonicContact OE2-NE 2.86Å; E527-R578 PolarHBondContact OE2-NE 2.82Å; T531-R578 HydrophobicContact CG2-CG 4.34Å; T531-R578 VanDerWaalsContact CG2-NE 3.34Å; K574-R578 WeakPolarHBondContact O-CG 3.4Å; K574-R578 PolarHBondContact O-N 3.33Å; A575-R578 PolarHBondContact O-N 3.48Å; I576-R578 VanDerWaalsContact C-N 3.32Å; I576-R578 PolarHBondContact O-N 3.33Å; R578-F580 VanDerWaalsContact C-N 3.35Å; R578-S581 PolarHBondContact O-N 2.67Å; R578-L582 WeakPolarHBondContact O-CB 3.37Å; R578-L582 PolarHBondContact O-N 2.98Å
579S96.4Very high95.1Very high0 Ų030.6 Ų30.60%016%0.162CC..Hα-helixtrans-62.4-44.3175-59.20000110.6L557 A575 I576 S581 L582 L583L557-S579 WeakPolarHBondContact CD1-OG 3.29Å; A575-S579 VanDerWaalsContact O-CB 3.3Å; A575-S579 WeakPolarHBondContact O-CB 2.86Å; A575-S579 PolarHBondContact O-N 2.94Å; A575-S579 PolarHBondContact O-OG 2.95Å; I576-S579 WeakPolarHBondContact O-CB 3.43Å; I576-S579 PolarHBondContact O-N 3.31Å; I576-S579 VanDerWaalsContact O-N 3.12Å; S579-S581 VanDerWaalsContact C-N 3.34Å; S579-S581 PolarHBondContact O-N 3.48Å; S579-L582 PolarHBondContact O-N 3.3Å; S579-L583 VanDerWaalsContact O-CB 3.27Å; S579-L583 WeakPolarHBondContact O-CB 3.38Å; S579-L583 VanDerWaalsContact O-CG 3.27Å; S579-L583 WeakPolarHBondContact O-CG 3.49Å; S579-L583 PolarHBondContact O-N 2.98Å
580F95.2Very high95.1Very high0 Ų033.4 Ų33.40%017%0.172CC..Hα-helixtrans-61.9-43.9175.5-70.19.2000111.3L554 F558 I576 M577 R578 L582 Q584 I587 L594 L598 L624 S625 I628L554-F580 HydrophobicContact CD2-CD1 4.13Å; L554-F580 HydrophobicContact CD2-CE1 3.75Å; F558-F580 HydrophobicContact CE2-CE1 4.36Å; F558-F580 HydrophobicContact CE2-CZ 4.17Å; F558-F580 HydrophobicContact CZ-CZ 4.14Å; I576-F580 HydrophobicContact CG2-CD1 4.33Å; I576-F580 HydrophobicContact CG2-CE1 3.8Å; I576-F580 HydrophobicContact CG2-CE2 4.13Å; I576-F580 HydrophobicContact CG2-CZ 3.7Å; I576-F580 WeakPolarHBondContact O-CD1 3.4Å; I576-F580 PolarHBondContact O-N 3.35Å; M577-F580 PolarHBondContact O-N 2.98Å; R578-F580 VanDerWaalsContact C-N 3.35Å; F580-L582 VanDerWaalsContact C-N 3.35Å; F580-L582 PolarHBondContact O-N 3.47Å; F580-Q584 PolarHBondContact O-N 3.26Å; F580-I587 HydrophobicContact CB-CD1 3.69Å; F580-I587 HydrophobicContact CD1-CD1 3.84Å; F580-I587 HydrophobicContact CD2-CD1 4.08Å; F580-I587 HydrophobicContact CG-CD1 3.59Å; F580-L594 HydrophobicContact CE1-CD1 3.79Å; F580-L594 HydrophobicContact CZ-CD1 3.77Å; F580-L598 HydrophobicContact CE2-CD1 4.11Å; F580-L598 HydrophobicContact CZ-CD1 4.45Å; F580-L624 HydrophobicContact CB-CB 4.27Å; F580-L624 HydrophobicContact CB-CD1 4.01Å; F580-L624 HydrophobicContact CD2-CB 4.37Å; F580-S625 VanDerWaalsContact CE2-OG 3.23Å; F580-S625 WeakPolarHBondContact CE2-OG 3.45Å; F580-I628 HydrophobicContact CB-CD1 4.43Å; F580-I628 WeakPolarHBondContact O-CD1 3.39Å
581S93.1Very high95Very high34 Ų3431.9 Ų31.924%0.23817%0.165CC..Hα-helixtrans-64.7-34.2177.6-176.60000113.2M577 R578 S579 Q584M577-S581 WeakPolarHBondContact O-CB 3.29Å; M577-S581 PolarHBondContact O-N 3.38Å; R578-S581 PolarHBondContact O-N 2.67Å; S579-S581 VanDerWaalsContact C-N 3.34Å; S579-S581 PolarHBondContact O-N 3.48Å; S581-Q584 PolarHBondContact O-NE2 2.9Å
582L93.3Very high94.7Very high21 Ų2135.3 Ų35.311%0.1119%0.19CC..Hα-helixtrans-75.6-46.6176.9175.963.5000112.1F530 T539 I541 M546 R578 S579 F580F530-L582 HydrophobicContact CB-CD2 3.94Å; F530-L582 HydrophobicContact CD1-CD2 3.44Å; F530-L582 VanDerWaalsContact CD1-CD2 3.44Å; F530-L582 HydrophobicContact CD2-CD2 4.06Å; F530-L582 HydrophobicContact CE1-CD2 3.89Å; F530-L582 HydrophobicContact CE2-CD2 4.46Å; F530-L582 HydrophobicContact CG-CD2 3.54Å; F530-L582 HydrophobicContact CZ-CD2 4.38Å; T539-L582 HydrophobicContact CG2-CD1 4.1Å; I541-L582 WeakPolarHBondContact O-CD1 3.44Å; M546-L582 HydrophobicContact CG-CD2 3.82Å; R578-L582 WeakPolarHBondContact O-CB 3.37Å; R578-L582 PolarHBondContact O-N 2.98Å; S579-L582 PolarHBondContact O-N 3.3Å; F580-L582 VanDerWaalsContact C-N 3.35Å; F580-L582 PolarHBondContact O-N 3.47Å
583L93.8Very high94.4Very high2 Ų239.8 Ų39.81%0.0122%0.218CC..Hα-helixtrans-80.5-24.2-170-68.5170.6000113.5S543 M546 T550 L553 S579 E585 A586 I587S543-L583 PolarHBondContact OG-O 3.03Å; M546-L583 HydrophobicContact CB-CD2 3.74Å; T550-L583 HydrophobicContact CG2-CD1 3.92Å; T550-L583 HydrophobicContact CG2-CD2 4.49Å; L553-L583 HydrophobicContact CD2-CD1 4.37Å; S579-L583 VanDerWaalsContact O-CB 3.27Å; S579-L583 WeakPolarHBondContact O-CB 3.38Å; S579-L583 VanDerWaalsContact O-CG 3.27Å; S579-L583 WeakPolarHBondContact O-CG 3.49Å; S579-L583 PolarHBondContact O-N 2.98Å; L583-E585 PolarHBondContact O-N 3.39Å; L583-A586 HydrophobicContact CB-CB 4.33Å; L583-A586 VanDerWaalsContact O-CB 3.28Å; L583-A586 WeakPolarHBondContact O-CB 3.37Å; L583-A586 PolarHBondContact O-N 3.48Å; L583-I587 HydrophobicContact CB-CG2 3.39Å; L583-I587 HydrophobicContact CD1-CG2 3.78Å; L583-I587 HydrophobicContact CG-CG2 4.25Å
584Q92.1Very high94.2Very high81 Ų8140.3 Ų40.338%0.37922%0.221SC..G310 helixtrans48.6-125.9176.4-63.4-67.9-41.900111.5F580 S581 A586 I587 I628F580-Q584 PolarHBondContact O-N 3.26Å; S581-Q584 PolarHBondContact O-NE2 2.9Å; Q584-A586 PolarHBondContact O-N 3.4Å; Q584-I587 WeakPolarHBondContact O-CG1 3.41Å; Q584-I587 PolarHBondContact O-N 3.19Å; Q584-I587 VanDerWaalsContact O-N 3.13Å; Q584-I628 VanDerWaalsContact O-CG2 3.32Å; Q584-I628 WeakPolarHBondContact O-CG2 3.42Å
585E92.3Very high94Very high120 Ų12039.7 Ų39.756%0.56122%0.219SC*.G310 helixtrans-57.4-22.2-176.2-66.8171.2-164.100113.9L583 I587 V588 K631L583-E585 PolarHBondContact O-N 3.39Å; E585-I587 PolarHBondContact O-N 3.01Å; E585-V588 WeakPolarHBondContact O-CB 3.38Å; E585-V588 WeakPolarHBondContact O-CG2 3.5Å; E585-V588 PolarHBondContact O-N 3.42Å; E585-K631 IonicContact OE1-NZ 2.68Å
586A92.9Very high93.7Very high42 Ų4241.7 Ų41.735%0.34724%0.239SC..G310 helixtrans-64.7-20.2178.300000113.6L583 Q584L583-A586 HydrophobicContact CB-CB 4.33Å; L583-A586 VanDerWaalsContact O-CB 3.28Å; L583-A586 WeakPolarHBondContact O-CB 3.37Å; L583-A586 PolarHBondContact O-N 3.48Å; Q584-A586 PolarHBondContact O-N 3.4Å
587I93.6Very high93.5Very high0 Ų045.6 Ų45.60%026%0.258CS..G310 helixtrans-85.9-15.2178.377.9-173.7000113.4L554 F580 L583 Q584 E585 P589 Y590 I591 I628L554-I587 HydrophobicContact CD1-CG2 4.43Å; F580-I587 HydrophobicContact CB-CD1 3.69Å; F580-I587 HydrophobicContact CD1-CD1 3.84Å; F580-I587 HydrophobicContact CD2-CD1 4.08Å; F580-I587 HydrophobicContact CG-CD1 3.59Å; L583-I587 HydrophobicContact CB-CG2 3.39Å; L583-I587 HydrophobicContact CD1-CG2 3.78Å; L583-I587 HydrophobicContact CG-CG2 4.25Å; Q584-I587 WeakPolarHBondContact O-CG1 3.41Å; Q584-I587 PolarHBondContact O-N 3.19Å; Q584-I587 VanDerWaalsContact O-N 3.13Å; E585-I587 PolarHBondContact O-N 3.01Å; I587-P589 VanDerWaalsContact C-CD 3.41Å; I587-P589 VanDerWaalsContact C-N 3.32Å; I587-Y590 WeakPolarHBondContact O-CA 3.24Å; I587-Y590 WeakPolarHBondContact O-CB 3.26Å; I587-Y590 PolarHBondContact O-N 3.43Å; I587-I591 HydrophobicContact CD1-CD1 3.77Å; I587-I591 HydrophobicContact CD1-CG1 4.45Å; I587-I591 HydrophobicContact CG1-CD1 3.81Å; I587-I591 HydrophobicContact CG1-CG1 3.98Å; I587-I591 PolarHBondContact O-N 3.45Å; I587-I628 HydrophobicContact CD1-CD1 3.55Å; I587-I628 HydrophobicContact CD1-CG2 4.43Å; I587-I628 HydrophobicContact CG1-CD1 4.39Å; I587-I628 HydrophobicContact CG1-CG2 4.2Å
588V93.5Very high93.4Very high43 Ų4345.3 Ų45.326%0.26126%0.256SS..THydrogen-bonded Turntrans-51.4-42.8-172.6173.10000113.1E585 Y590 I591 I628E585-V588 WeakPolarHBondContact O-CB 3.38Å; E585-V588 WeakPolarHBondContact O-CG2 3.5Å; E585-V588 PolarHBondContact O-N 3.42Å; V588-Y590 PolarHBondContact O-N 3.32Å; V588-I591 PolarHBondContact O-N 2.87Å; V588-I628 HydrophobicContact CG2-CG2 3.78Å
589P94.1Very high93.3Very high102 Ų10242.4 Ų42.466%0.66225%0.247SC*.THydrogen-bonded Turntrans-61.6-25.4177.1-2435.7000114.5I587I587-P589 VanDerWaalsContact C-CD 3.41Å; I587-P589 VanDerWaalsContact C-N 3.32Å
590Y94.7Very high93.2Very high74 Ų7447.5 Ų47.529%0.2927%0.271SS..THydrogen-bonded Turntrans-93.3-22.3-175.8-55-84.8000112.6T550 E551 L554 I587 V588 P592 T593 L594T550-Y590 HydrophobicContact CG2-CD2 4.47Å; T550-Y590 HydrophobicContact CG2-CE2 3.92Å; E551-Y590 HydrophobicContact CB-CE1 3.96Å; E551-Y590 HydrophobicContact CG-CE1 3.94Å; L554-Y590 HydrophobicContact CD1-CD2 4.04Å; L554-Y590 HydrophobicContact CD1-CG 4.02Å; I587-Y590 WeakPolarHBondContact O-CA 3.24Å; I587-Y590 WeakPolarHBondContact O-CB 3.26Å; I587-Y590 PolarHBondContact O-N 3.43Å; V588-Y590 PolarHBondContact O-N 3.32Å; Y590-P592 VanDerWaalsContact C-CD 3.43Å; Y590-T593 PolarHBondContact O-N 3.12Å; Y590-T593 VanDerWaalsContact O-N 3.08Å; Y590-L594 WeakPolarHBondContact O-CG 3.39Å; Y590-L594 PolarHBondContact O-N 3.13Å; Y590-L594 VanDerWaalsContact O-N 3.11Å
591I91.9Very high93.2Very high6 Ų649.5 Ų49.53%0.03128%0.28CS..Hα-helixtrans-51.2-43-175.9-69.9-58.9000114.2I587 V588 T593 L594 I595 F640I587-I591 HydrophobicContact CD1-CD1 3.77Å; I587-I591 HydrophobicContact CD1-CG1 4.45Å; I587-I591 HydrophobicContact CG1-CD1 3.81Å; I587-I591 HydrophobicContact CG1-CG1 3.98Å; I587-I591 PolarHBondContact O-N 3.45Å; V588-I591 PolarHBondContact O-N 2.87Å; I591-T593 PolarHBondContact O-N 3.44Å; I591-L594 PolarHBondContact O-N 3.45Å; I591-L594 VanDerWaalsContact O-N 3.15Å; I591-I595 WeakPolarHBondContact O-CB 3.44Å; I591-I595 WeakPolarHBondContact O-CG2 3.39Å; I591-I595 PolarHBondContact O-N 3.47Å; I591-F640 HydrophobicContact CG2-CE1 4.25Å; I591-F640 HydrophobicContact CG2-CZ 3.75Å
592P90.4Very high93.3Very high96 Ų9647.9 Ų47.962%0.62327%0.268SS*.Hα-helixtrans-56.7-33.9180-27.336.2000113.8Y590 I595Y590-P592 VanDerWaalsContact C-CD 3.43Å; P592-I595 WeakPolarHBondContact O-CG2 3.36Å
593T91.9Very high93.3Very high94 Ų9449.1 Ų49.158%0.57728%0.275SS*.Hα-helixtrans-80.7-43.9175.5-55.20000111.4Y590 I591 I595 G596 Q597Y590-T593 PolarHBondContact O-N 3.12Å; Y590-T593 VanDerWaalsContact O-N 3.08Å; I591-T593 PolarHBondContact O-N 3.44Å; T593-I595 PolarHBondContact O-N 3.28Å; T593-G596 PolarHBondContact O-N 3.24Å; T593-Q597 PolarHBondContact O-N 2.84Å
594L93.7Very high93.2Very high12 Ų1252.6 Ų52.66%0.06329%0.293CS..Hα-helixtrans-66.4-37.1-176.3-60.1-177.7000112.4L554 F558 F580 Y590 I591 G596 Q597 L598L554-L594 HydrophobicContact CD1-CD1 4.2Å; L554-L594 HydrophobicContact CD2-CD1 4.32Å; F558-L594 HydrophobicContact CD2-CD2 3.8Å; F558-L594 HydrophobicContact CE1-CD2 4.39Å; F558-L594 HydrophobicContact CE2-CB 4.48Å; F558-L594 HydrophobicContact CE2-CD1 4.2Å; F558-L594 HydrophobicContact CE2-CD2 3.63Å; F558-L594 HydrophobicContact CE2-CG 4.3Å; F558-L594 HydrophobicContact CG-CD2 4.25Å; F558-L594 HydrophobicContact CZ-CB 4.09Å; F558-L594 HydrophobicContact CZ-CD2 3.93Å; F558-L594 HydrophobicContact CZ-CG 4.39Å; F580-L594 HydrophobicContact CE1-CD1 3.79Å; F580-L594 HydrophobicContact CZ-CD1 3.77Å; Y590-L594 WeakPolarHBondContact O-CG 3.39Å; Y590-L594 PolarHBondContact O-N 3.13Å; Y590-L594 VanDerWaalsContact O-N 3.11Å; I591-L594 PolarHBondContact O-N 3.45Å; I591-L594 VanDerWaalsContact O-N 3.15Å; L594-G596 VanDerWaalsContact C-N 3.32Å; L594-G596 PolarHBondContact O-N 3.12Å; L594-Q597 PolarHBondContact O-N 2.99Å; L594-Q597 VanDerWaalsContact O-N 3.15Å; L594-L598 WeakPolarHBondContact O-CG 3.39Å; L594-L598 PolarHBondContact O-N 3Å
595I92.4Very high93.3Very high20 Ų2049 Ų4910%0.10328%0.276CS..Hα-helixtrans-63.4-38.8179.5-166.158000111.6I591 P592 T593 Q597 L598 T599 L622 F640I591-I595 WeakPolarHBondContact O-CB 3.44Å; I591-I595 WeakPolarHBondContact O-CG2 3.39Å; I591-I595 PolarHBondContact O-N 3.47Å; P592-I595 WeakPolarHBondContact O-CG2 3.36Å; T593-I595 PolarHBondContact O-N 3.28Å; I595-Q597 VanDerWaalsContact C-N 3.29Å; I595-Q597 PolarHBondContact O-N 3.01Å; I595-L598 PolarHBondContact O-N 2.9Å; I595-T599 WeakPolarHBondContact O-CB 3.11Å; I595-T599 PolarHBondContact O-N 3.42Å; I595-T599 PolarHBondContact O-OG1 3.11Å; I595-L622 HydrophobicContact CD1-CD2 3.41Å; I595-L622 VanDerWaalsContact CD1-CD2 3.41Å; I595-F640 HydrophobicContact CB-CE1 4.5Å; I595-F640 HydrophobicContact CD1-CD1 3.87Å; I595-F640 HydrophobicContact CD1-CE1 3.74Å; I595-F640 HydrophobicContact CG1-CD1 3.93Å; I595-F640 HydrophobicContact CG1-CE1 3.88Å
596G91.9Very high93.2Very high43 Ų4343.5 Ų43.544%0.44325%0.251SS..Hα-helixtrans-60.3-40.117500000112.2T593 L594 H600T593-G596 PolarHBondContact O-N 3.24Å; L594-G596 VanDerWaalsContact C-N 3.32Å; L594-G596 PolarHBondContact O-N 3.12Å; G596-H600 WeakPolarHBondContact O-CB 3.37Å; G596-H600 PolarHBondContact O-N 3.11Å
597Q94.1Very high93.1Very high82 Ų8248.6 Ų48.638%0.38327%0.266SS..Hα-helixtrans-70.2-43.7177.2-61.2-175.819.700112.1F558 T593 L594 I595 H600 K601F558-Q597 VanDerWaalsContact CB-OE1 3.32Å; F558-Q597 HydrophobicContact CD1-CB 3.91Å; F558-Q597 HydrophobicContact CE1-CB 3.97Å; T593-Q597 PolarHBondContact O-N 2.84Å; L594-Q597 PolarHBondContact O-N 2.99Å; L594-Q597 VanDerWaalsContact O-N 3.15Å; I595-Q597 VanDerWaalsContact C-N 3.29Å; I595-Q597 PolarHBondContact O-N 3.01Å; Q597-H600 PolarHBondContact O-N 3.21Å; Q597-K601 PolarHBondContact O-N 3.31Å
598L95.4Very high92.8Very high1 Ų154 Ų541%0.00529%0.294CS..Hα-helixtrans-63-44.3177.2-67.8172.3000111.6F558 M573 F580 L594 I595 K601 L602 L618 L622F558-L598 HydrophobicContact CE1-CD2 3.74Å; F558-L598 HydrophobicContact CE1-CG 3.89Å; F558-L598 HydrophobicContact CZ-CD1 4.41Å; F558-L598 HydrophobicContact CZ-CD2 3.83Å; F558-L598 HydrophobicContact CZ-CG 3.97Å; M573-L598 HydrophobicContact CE-CD2 4.32Å; M573-L598 HydrophobicContact SD-CD2 4.24Å; F580-L598 HydrophobicContact CE2-CD1 4.11Å; F580-L598 HydrophobicContact CZ-CD1 4.45Å; L594-L598 WeakPolarHBondContact O-CG 3.39Å; L594-L598 PolarHBondContact O-N 3Å; I595-L598 PolarHBondContact O-N 2.9Å; L598-K601 PolarHBondContact O-N 3.23Å; L598-L602 WeakPolarHBondContact O-CB 3.42Å; L598-L602 PolarHBondContact O-N 3.09Å; L598-L618 HydrophobicContact CB-CD1 4.22Å; L598-L618 HydrophobicContact CD2-CD1 3.67Å; L598-L622 HydrophobicContact CB-CD2 3.69Å; L598-L622 HydrophobicContact CB-CG 4.5Å; L598-L622 HydrophobicContact CD1-CD2 4.03Å; L598-L622 HydrophobicContact CG-CD2 4.49Å
599T93.6Very high92.6Very high17 Ų1753.3 Ų53.310%0.10429%0.291CS..Hα-helixtrans-64.8-41.3177.2-61.10000111.7I595 K601 L602 L603 A643 V647I595-T599 WeakPolarHBondContact O-CB 3.11Å; I595-T599 PolarHBondContact O-N 3.42Å; I595-T599 PolarHBondContact O-OG1 3.11Å; T599-K601 VanDerWaalsContact C-N 3.34Å; T599-K601 PolarHBondContact O-N 3.18Å; T599-L602 PolarHBondContact O-N 3.35Å; T599-L603 PolarHBondContact O-N 3.4Å; T599-A643 VanDerWaalsContact CG2-O 3.31Å; T599-A643 WeakPolarHBondContact CG2-O 3.09Å; T599-V647 HydrophobicContact CG2-CG2 3.58Å
600H93.1Very high92.2Very high107 Ų10751.3 Ų51.350%0.49528%0.28SS..Hα-helixtrans-61.6-42.7174.617967.9000111.7G596 Q597 L603 L604G596-H600 WeakPolarHBondContact O-CB 3.37Å; G596-H600 PolarHBondContact O-N 3.11Å; Q597-H600 PolarHBondContact O-N 3.21Å; H600-L603 PolarHBondContact O-N 3.47Å; H600-L604 WeakPolarHBondContact NE2-CD1 3.48Å; H600-L604 WeakPolarHBondContact O-CG 3.45Å; H600-L604 PolarHBondContact O-N 2.94Å; H600-L604 VanDerWaalsContact O-N 3.12Å
601K94.4Very high92Very high43 Ų4350.5 Ų50.519%0.18728%0.278CS..Hα-helixtrans-64.4-44174.4-73.2-47.3-170-173.90112.4Q597 L598 T599 L603 L604 V605Q597-K601 PolarHBondContact O-N 3.31Å; L598-K601 PolarHBondContact O-N 3.23Å; T599-K601 VanDerWaalsContact C-N 3.34Å; T599-K601 PolarHBondContact O-N 3.18Å; K601-L603 VanDerWaalsContact C-N 3.28Å; K601-L603 PolarHBondContact O-N 2.99Å; K601-L604 HydrophobicContact CD-CD1 4.1Å; K601-L604 PolarHBondContact O-N 3.4Å; K601-L604 VanDerWaalsContact O-N 3.08Å; K601-V605 WeakPolarHBondContact O-CG2 3.49Å; K601-V605 PolarHBondContact O-N 3.29Å
602L95.3Very high91.9Very high0 Ų054.5 Ų54.50%030%0.304CS..Hα-helixtrans-54.8-45175.7179.562.2000111.7L598 T599 L604 V605 S606 L618 F619 L622 V647 F648 I651 F659L598-L602 WeakPolarHBondContact O-CB 3.42Å; L598-L602 PolarHBondContact O-N 3.09Å; T599-L602 PolarHBondContact O-N 3.35Å; L602-L604 PolarHBondContact O-N 3.48Å; L602-V605 WeakPolarHBondContact O-CG2 3.4Å; L602-S606 WeakPolarHBondContact O-CB 3.14Å; L602-S606 PolarHBondContact O-N 2.69Å; L602-L618 HydrophobicContact CB-CD2 4.11Å; L602-L618 HydrophobicContact CD1-CD2 4.15Å; L602-F619 HydrophobicContact CD1-CE1 4.15Å; L602-F619 HydrophobicContact CD1-CE2 3.85Å; L602-F619 HydrophobicContact CD1-CZ 3.56Å; L602-F619 HydrophobicContact CD2-CE1 4.32Å; L602-F619 HydrophobicContact CD2-CZ 4.45Å; L602-L622 HydrophobicContact CD2-CD1 3.99Å; L602-V647 HydrophobicContact CD2-CG1 3.95Å; L602-V647 HydrophobicContact CG-CG1 3.9Å; L602-F648 HydrophobicContact CD2-CE1 4.03Å; L602-I651 HydrophobicContact CD1-CD1 4.45Å; L602-I651 HydrophobicContact CG-CD1 4.43Å; L602-F659 HydrophobicContact CD1-CD2 4.1Å; L602-F659 HydrophobicContact CD1-CE2 3.91Å
603L93.2Very high91.9Very high46 Ų4654.7 Ų54.724%0.24130%0.296CS..Hα-helixtrans-61.5-43.8176.5179.161.9000112T599 H600 K601 S606 V647 E650T599-L603 PolarHBondContact O-N 3.4Å; H600-L603 PolarHBondContact O-N 3.47Å; K601-L603 VanDerWaalsContact C-N 3.28Å; K601-L603 PolarHBondContact O-N 2.99Å; L603-S606 PolarHBondContact O-N 3.39Å; L603-S606 PolarHBondContact O-OG 3.09Å; L603-V647 HydrophobicContact CB-CG1 4.21Å; L603-V647 HydrophobicContact CB-CG2 4.26Å; L603-V647 HydrophobicContact CD1-CG1 4.37Å; L603-E650 WeakPolarHBondContact CD1-OE2 3.4Å
604L92.4Very high92.1Very high75 Ų7550.2 Ų50.239%0.39327%0.269SS..Hα-helixtrans-62.6-50178.3-72.4174.4000112.1H600 K601 L602 S606 K607H600-L604 WeakPolarHBondContact NE2-CD1 3.48Å; H600-L604 WeakPolarHBondContact O-CG 3.45Å; H600-L604 PolarHBondContact O-N 2.94Å; H600-L604 VanDerWaalsContact O-N 3.12Å; K601-L604 HydrophobicContact CD-CD1 4.1Å; K601-L604 PolarHBondContact O-N 3.4Å; K601-L604 VanDerWaalsContact O-N 3.08Å; L602-L604 PolarHBondContact O-N 3.48Å; L604-S606 VanDerWaalsContact C-N 3.27Å; L604-S606 PolarHBondContact O-N 2.99Å; L604-K607 PolarHBondContact O-N 3.4Å
605V93.4Very high92.2Very high5 Ų549.9 Ų49.93%0.0327%0.267CS..Hα-helixtrans-71-23.7-177.9-60.80000112.7E568 K601 L602 K607 N608 P609 F614 L618 F659E568-V605 HydrophobicContact CG-CG1 3.85Å; K601-V605 WeakPolarHBondContact O-CG2 3.49Å; K601-V605 PolarHBondContact O-N 3.29Å; L602-V605 WeakPolarHBondContact O-CG2 3.4Å; V605-K607 PolarHBondContact O-N 3.14Å; V605-N608 CarbonylContact O-C 3.34Å; V605-N608 PolarHBondContact O-N 3.43Å; V605-N608 VanDerWaalsContact O-N 3.16Å; V605-P609 WeakPolarHBondContact O-CA 3.42Å; V605-P609 VanDerWaalsContact O-N 3.1Å; V605-F614 HydrophobicContact CG1-CD1 4.42Å; V605-F614 HydrophobicContact CG1-CE1 3.9Å; V605-L618 HydrophobicContact CG2-CD2 4.02Å; V605-F659 HydrophobicContact CB-CZ 4.27Å; V605-F659 HydrophobicContact CG2-CE2 3.83Å; V605-F659 HydrophobicContact CG2-CZ 3.7Å
606S92.1Very high92.3Very high6 Ų650.7 Ų50.74%0.04227%0.27CS..Hα-helixtrans-64.4-21.7175.9740000113.9L602 L603 L604 N608 F659L602-S606 WeakPolarHBondContact O-CB 3.14Å; L602-S606 PolarHBondContact O-N 2.69Å; L603-S606 PolarHBondContact O-N 3.39Å; L603-S606 PolarHBondContact O-OG 3.09Å; L604-S606 VanDerWaalsContact C-N 3.27Å; L604-S606 PolarHBondContact O-N 2.99Å; S606-N608 VanDerWaalsContact C-N 3.34Å; S606-F659 VanDerWaalsContact CA-CE2 3.41Å
607K90.4Very high92.5Very high148 Ų14850.4 Ų50.464%0.64326%0.256SS*.THydrogen-bonded Turntrans-74.6-26.9177.1-63.9179.7-179.8-178.80112.6L604 V605L604-K607 PolarHBondContact O-N 3.4Å; V605-K607 PolarHBondContact O-N 3.14Å
608N87.3Confident92.6Very high113 Ų11346.5 Ų46.560%0.60424%0.238SC*.SBendtrans-15578.7178.9-174.741.2000110.6V605 S606 S610V605-N608 CarbonylContact O-C 3.34Å; V605-N608 PolarHBondContact O-N 3.43Å; V605-N608 VanDerWaalsContact O-N 3.16Å; S606-N608 VanDerWaalsContact C-N 3.34Å; N608-S610 PolarHBondContact O-N 2.95Å
609P88.1Confident92.7Very high30 Ų3046.4 Ų46.420%0.19524%0.238CC..  trans-70.792.7-176.228.6-35.3000111V605 V656 E658 F659V605-P609 WeakPolarHBondContact O-CA 3.42Å; V605-P609 VanDerWaalsContact O-N 3.1Å; P609-V656 HydrophobicContact CG-CG1 3.87Å; P609-E658 HydrophobicContact CB-CB 3.97Å; P609-E658 HydrophobicContact CB-CG 4.01Å; P609-E658 HydrophobicContact CG-CB 4Å; P609-E658 VanDerWaalsContact CG-CD 3.49Å; P609-E658 HydrophobicContact CG-CG 3.75Å; P609-E658 VanDerWaalsContact CG-OE2 3.32Å; P609-E658 WeakPolarHBondContact CG-OE2 3.47Å; P609-F659 HydrophobicContact CB-CD1 4.32Å; P609-F659 HydrophobicContact CB-CE1 3.61Å; P609-F659 HydrophobicContact CB-CZ 3.8Å
610S86.8Confident92.7Very high60 Ų6046 Ų4642%0.4223%0.234SC..  trans-103.3-26.6-172.977.60000114.8E568 N608 P612E568-S610 PolarHBondContact OE2-OG 3.36Å; E568-S610 VanDerWaalsContact OE2-OG 3.14Å; N608-S610 PolarHBondContact O-N 2.95Å; S610-P612 WeakPolarHBondContact O-CD 3.46Å
611K90Very high92.9Very high57 Ų5740.9 Ų40.925%0.24821%0.211CC..  trans-114.594.6-175.4-58.5-59.8-174.2173.70112.3E367 E568 H613 F614 N615E367-K611 IonicContact OE1-NZ 3.95Å; E367-K611 PolarHBondContact OE1-NZ 2.93Å; E367-K611 IonicContact OE2-NZ 3.58Å; E367-K611 PolarHBondContact OE2-NZ 3.26Å; E568-K611 HydrophobicContact CB-CB 4.42Å; E568-K611 HydrophobicContact CB-CG 3.9Å; K611-H613 PolarHBondContact O-N 2.95Å; K611-F614 HydrophobicContact CB-CB 3.83Å; K611-F614 PolarHBondContact O-N 3.31Å; K611-N615 PolarHBondContact O-N 2.9Å; K611-N615 VanDerWaalsContact O-N 3.09Å; K611-N615 PolarHBondContact O-ND2 2.77Å
612P90.6Very high93Very high90 Ų9038.8 Ų38.858%0.58420%0.202SC*.Hα-helixtrans-64.2-40.1-171.223.2-33.2000114.4S610 N615 H616S610-P612 WeakPolarHBondContact O-CD 3.46Å; P612-N615 PolarHBondContact O-N 3.01Å; P612-H616 WeakPolarHBondContact O-CB 3.43Å; P612-H616 PolarHBondContact O-N 3.45Å
613H90.6Very high92.9Very high100 Ų10038.8 Ų38.846%0.46320%0.202SC..Hα-helixtrans-68.9-40.7178.5-66.2-50.4000112.4E570 K611 N615 H616 Y617E570-H613 HydrophobicContact CB-CB 4.13Å; E570-H613 VanDerWaalsContact OE2-CB 3.23Å; E570-H613 WeakPolarHBondContact OE2-CB 3.37Å; E570-H613 IonicContact OE2-CD2 3.72Å; E570-H613 IonicContact OE2-CG 2.69Å; K611-H613 PolarHBondContact O-N 2.95Å; H613-N615 VanDerWaalsContact C-N 3.32Å; H613-N615 PolarHBondContact O-N 3.25Å; H613-H616 WeakPolarHBondContact O-CB 3.36Å; H613-H616 PolarHBondContact O-N 2.74Å; H613-Y617 HydrophobicContact CB-CE2 4.12Å; H613-Y617 WeakPolarHBondContact O-CD2 3.36Å; H613-Y617 PolarHBondContact O-N 3.38Å
614F95.6Very high92.9Very high0 Ų036.9 Ų36.90%019%0.191CC..Hα-helixtrans-55.4-50.1171.6176.2-92.1000111L561 E568 N569 E570 M573 V605 K611 H616 Y617 L618L561-F614 HydrophobicContact CD2-CE2 3.92Å; E568-F614 HydrophobicContact CB-CD1 4.36Å; E568-F614 HydrophobicContact CB-CG 4.32Å; E568-F614 HydrophobicContact CG-CE1 4.44Å; E568-F614 WeakPolarHBondContact O-CD2 3.37Å; N569-F614 WeakPolarHBondContact O-CD2 3.41Å; E570-F614 HydrophobicContact CB-CB 4.11Å; M573-F614 HydrophobicContact CB-CD2 3.66Å; M573-F614 HydrophobicContact CB-CE2 3.73Å; M573-F614 HydrophobicContact CE-CE1 4.34Å; M573-F614 HydrophobicContact CE-CE2 3.6Å; M573-F614 HydrophobicContact CE-CZ 3.49Å; M573-F614 VanDerWaalsContact CE-CZ 3.49Å; M573-F614 HydrophobicContact CG-CD2 4.27Å; M573-F614 HydrophobicContact CG-CE2 4.21Å; V605-F614 HydrophobicContact CG1-CD1 4.42Å; V605-F614 HydrophobicContact CG1-CE1 3.9Å; K611-F614 HydrophobicContact CB-CB 3.83Å; K611-F614 PolarHBondContact O-N 3.31Å; F614-H616 VanDerWaalsContact C-N 3.32Å; F614-H616 PolarHBondContact O-N 3.46Å; F614-Y617 PolarHBondContact O-N 3.48Å; F614-L618 HydrophobicContact CE1-CD2 4.15Å; F614-L618 WeakPolarHBondContact O-CB 3.44Å; F614-L618 PolarHBondContact O-N 3.22Å
615N94.8Very high93Very high5 Ų533.3 Ų33.33%0.02717%0.173CC..Hα-helixtrans-59.7-43.3179.6-66.8-33.3000111.6K611 P612 H613 L618 F619 F659K611-N615 PolarHBondContact O-N 2.9Å; K611-N615 VanDerWaalsContact O-N 3.09Å; K611-N615 PolarHBondContact O-ND2 2.77Å; P612-N615 PolarHBondContact O-N 3.01Å; H613-N615 VanDerWaalsContact C-N 3.32Å; H613-N615 PolarHBondContact O-N 3.25Å; N615-L618 WeakPolarHBondContact O-CB 3.24Å; N615-L618 PolarHBondContact O-N 3.24Å; N615-F619 VanDerWaalsContact O-CD2 3.28Å; N615-F619 WeakPolarHBondContact O-CD2 3.4Å; N615-F619 PolarHBondContact O-N 3.1Å; N615-F659 HydrophobicContact CB-CE1 3.75Å; N615-F659 HydrophobicContact CB-CZ 4.21Å; N615-F659 VanDerWaalsContact CG-CE1 3.4Å; N615-F659 WeakPolarHBondContact ND2-CE1 3.45Å; N615-F659 WeakPolarHBondContact OD1-CZ 3.27Å
616H94.7Very high93.1Very high37 Ų3733.1 Ų33.117%0.17117%0.172CC..Hα-helixtrans-56.9-52.9175.2-176.680.7000112P612 H613 F614 L618 F619 E620 Y662 Q905P612-H616 WeakPolarHBondContact O-CB 3.43Å; P612-H616 PolarHBondContact O-N 3.45Å; H613-H616 WeakPolarHBondContact O-CB 3.36Å; H613-H616 PolarHBondContact O-N 2.74Å; F614-H616 VanDerWaalsContact C-N 3.32Å; F614-H616 PolarHBondContact O-N 3.46Å; H616-L618 VanDerWaalsContact C-N 3.28Å; H616-L618 PolarHBondContact O-N 3.28Å; H616-F619 PolarHBondContact O-N 3.3Å; H616-E620 IonicContact NE2-OE1 3.88Å; H616-E620 WeakPolarHBondContact O-CG 3.36Å; H616-E620 PolarHBondContact O-N 3Å; H616-Y662 WeakPolarHBondContact CB-OH 3.48Å; H616-Y662 AromaticContact ND1-CE1 3.54Å; H616-Y662 AromaticContact ND1-CZ 3.69Å; H616-Y662 PolarHBondContact ND1-OH 3.47Å; H616-Q905 PolarHBondContact CE1-O 2.94Å
617Y95.7Very high93Very high36 Ų3638.3 Ų38.314%0.14119%0.19CC..Hα-helixtrans-67.6-27.7-179.6-61.1-51.8000113.2K574 M577 H613 F614 S621K574-Y617 HydrophobicContact CB-CD1 4.24Å; K574-Y617 HydrophobicContact CB-CD2 3.73Å; K574-Y617 HydrophobicContact CB-CE1 4.35Å; K574-Y617 HydrophobicContact CB-CE2 3.87Å; K574-Y617 HydrophobicContact CB-CG 3.94Å; K574-Y617 HydrophobicContact CD-CE1 4Å; K574-Y617 HydrophobicContact CD-CE2 3.86Å; K574-Y617 WeakPolarHBondContact CE-OH 3.28Å; K574-Y617 HydrophobicContact CG-CD1 4.09Å; K574-Y617 HydrophobicContact CG-CD2 4.27Å; K574-Y617 HydrophobicContact CG-CE1 3.85Å; K574-Y617 HydrophobicContact CG-CE2 4.07Å; K574-Y617 HydrophobicContact CG-CG 4.3Å; K574-Y617 PolarHBondContact NZ-OH 2.59Å; M577-Y617 HydrophobicContact CE-CD1 4.01Å; M577-Y617 HydrophobicContact CE-CE1 4.28Å; M577-Y617 HydrophobicContact SD-CD1 3.78Å; M577-Y617 HydrophobicContact SD-CE1 4.5Å; H613-Y617 HydrophobicContact CB-CE2 4.12Å; H613-Y617 WeakPolarHBondContact O-CD2 3.36Å; H613-Y617 PolarHBondContact O-N 3.38Å; F614-Y617 PolarHBondContact O-N 3.48Å; Y617-S621 WeakPolarHBondContact O-CB 3.46Å; Y617-S621 PolarHBondContact O-N 2.98Å; Y617-S621 PolarHBondContact O-OG 3.32Å
618L97.3Very high93.1Very high0 Ų031.5 Ų31.50%016%0.161CC..Hα-helixtrans-64-49.6172.417359.1000110.7M573 L598 L602 V605 F614 N615 H616 E620 S621 L622M573-L618 HydrophobicContact CE-CB 4.15Å; M573-L618 HydrophobicContact CE-CD1 3.77Å; M573-L618 HydrophobicContact CE-CG 4.47Å; M573-L618 HydrophobicContact CG-CB 4.07Å; M573-L618 VanDerWaalsContact CG-N 3.32Å; M573-L618 HydrophobicContact SD-CB 4.1Å; M573-L618 HydrophobicContact SD-CD1 4.1Å; L598-L618 HydrophobicContact CB-CD1 4.22Å; L598-L618 HydrophobicContact CD2-CD1 3.67Å; L602-L618 HydrophobicContact CB-CD2 4.11Å; L602-L618 HydrophobicContact CD1-CD2 4.15Å; V605-L618 HydrophobicContact CG2-CD2 4.02Å; F614-L618 HydrophobicContact CE1-CD2 4.15Å; F614-L618 WeakPolarHBondContact O-CB 3.44Å; F614-L618 PolarHBondContact O-N 3.22Å; N615-L618 WeakPolarHBondContact O-CB 3.24Å; N615-L618 PolarHBondContact O-N 3.24Å; H616-L618 VanDerWaalsContact C-N 3.28Å; H616-L618 PolarHBondContact O-N 3.28Å; L618-E620 PolarHBondContact O-N 3.24Å; L618-S621 WeakPolarHBondContact O-CB 3.32Å; L618-S621 PolarHBondContact O-N 3.04Å; L618-L622 WeakPolarHBondContact O-CG 3.35Å; L618-L622 PolarHBondContact O-N 3.09Å
619F96.6Very high93.3Very high0 Ų026.8 Ų26.80%014%0.136CC..Hα-helixtrans-64.1-38.6175.6-82.6-73.3000112.6L602 N615 H616 S621 L622 C623 F648 F659 Y662 V663 V666 L906L602-F619 HydrophobicContact CD1-CE1 4.15Å; L602-F619 HydrophobicContact CD1-CE2 3.85Å; L602-F619 HydrophobicContact CD1-CZ 3.56Å; L602-F619 HydrophobicContact CD2-CE1 4.32Å; L602-F619 HydrophobicContact CD2-CZ 4.45Å; N615-F619 VanDerWaalsContact O-CD2 3.28Å; N615-F619 WeakPolarHBondContact O-CD2 3.4Å; N615-F619 PolarHBondContact O-N 3.1Å; H616-F619 PolarHBondContact O-N 3.3Å; F619-S621 VanDerWaalsContact C-N 3.33Å; F619-S621 PolarHBondContact O-N 2.96Å; F619-L622 HydrophobicContact CD1-CD1 4.29Å; F619-L622 WeakPolarHBondContact O-CB 3.4Å; F619-L622 PolarHBondContact O-N 3.49Å; F619-C623 PolarHBondContact O-N 3.45Å; F619-C623 PolarHBondContact O-SG 3.3Å; F619-F648 HydrophobicContact CE1-CE1 4.36Å; F619-F659 HydrophobicContact CE2-CB 4.37Å; F619-F659 HydrophobicContact CE2-CD1 4.1Å; F619-F659 HydrophobicContact CE2-CD2 4.28Å; F619-F659 HydrophobicContact CE2-CG 4Å; F619-F659 HydrophobicContact CZ-CB 4.26Å; F619-F659 HydrophobicContact CZ-CD2 4.35Å; F619-F659 HydrophobicContact CZ-CG 4.23Å; F619-Y662 HydrophobicContact CB-CD1 4.05Å; F619-Y662 HydrophobicContact CB-CG 4.29Å; F619-Y662 HydrophobicContact CD1-CG 4.44Å; F619-Y662 VanDerWaalsContact CD2-CB 3.45Å; F619-Y662 HydrophobicContact CD2-CD1 4.09Å; F619-Y662 AromaticContact CD2-CD2 3.73Å; F619-Y662 HydrophobicContact CD2-CD2 3.73Å; F619-Y662 HydrophobicContact CD2-CE2 4.47Å; F619-Y662 AromaticContact CD2-CG 3.5Å; F619-Y662 HydrophobicContact CD2-CG 3.5Å; F619-Y662 VanDerWaalsContact CD2-CG 3.5Å; F619-Y662 VanDerWaalsContact CE2-CB 3.48Å; F619-Y662 AromaticContact CE2-CD2 3.84Å; F619-Y662 HydrophobicContact CE2-CD2 3.84Å; F619-Y662 AromaticContact CE2-CG 3.83Å; F619-Y662 HydrophobicContact CE2-CG 3.83Å; F619-Y662 HydrophobicContact CG-CD1 4.13Å; F619-Y662 AromaticContact CG-CG 3.84Å; F619-Y662 HydrophobicContact CG-CG 3.84Å; F619-Y662 HydrophobicContact CZ-CG 4.41Å; F619-V663 HydrophobicContact CE1-CG2 4.33Å; F619-V663 HydrophobicContact CZ-CG2 4.26Å; F619-V666 HydrophobicContact CD1-CG2 3.8Å; F619-V666 HydrophobicContact CE1-CG2 4.33Å; F619-L906 HydrophobicContact CB-CD1 3.98Å; F619-L906 HydrophobicContact CB-CD2 3.74Å
620E94.7Very high93.5Very high7 Ų725.7 Ų25.73%0.03313%0.129CC..Hα-helixtrans-61.4-41173.3-72.7-73.4-150.100112.2M577 H616 L618 L622 C623 L624 L906 A907 F908M577-E620 HydrophobicContact CG-CB 3.84Å; M577-E620 HydrophobicContact SD-CB 3.46Å; M577-E620 WeakPolarHBondContact SD-CB 3.27Å; M577-E620 HydrophobicContact SD-CG 3.92Å; H616-E620 IonicContact NE2-OE1 3.88Å; H616-E620 WeakPolarHBondContact O-CG 3.36Å; H616-E620 PolarHBondContact O-N 3Å; L618-E620 PolarHBondContact O-N 3.24Å; E620-L622 VanDerWaalsContact C-N 3.33Å; E620-L622 PolarHBondContact O-N 3.13Å; E620-C623 PolarHBondContact O-N 3.18Å; E620-L624 WeakPolarHBondContact O-CB 3.27Å; E620-L624 PolarHBondContact O-N 3.02Å; E620-L906 HydrophobicContact CB-CD2 4.5Å; E620-L906 HydrophobicContact CG-CD2 3.65Å; E620-L906 WeakPolarHBondContact OE1-CA 3.22Å; E620-A907 WeakPolarHBondContact OE1-CB 3.42Å; E620-A907 PolarHBondContact OE1-N 3.38Å; E620-A907 PolarHBondContact OE2-N 3.36Å; E620-F908 HydrophobicContact CB-CD2 4.07Å; E620-F908 HydrophobicContact CG-CD2 4.41Å; E620-F908 WeakPolarHBondContact OE2-CB 3.38Å; E620-F908 WeakPolarHBondContact OE2-CD2 3.18Å; E620-F908 PolarHBondContact OE2-N 3.21Å
621S96.5Very high93.6Very high0 Ų030 Ų300%014%0.141CC..Hα-helixtrans-64.2-38.4176.6-60.70000111.8M577 Y617 L618 F619 S625M577-S621 WeakPolarHBondContact CA-OG 3.14Å; M577-S621 WeakPolarHBondContact CB-OG 3.42Å; M577-S621 PolarHBondContact N-OG 3.34Å; Y617-S621 WeakPolarHBondContact O-CB 3.46Å; Y617-S621 PolarHBondContact O-N 2.98Å; Y617-S621 PolarHBondContact O-OG 3.32Å; L618-S621 WeakPolarHBondContact O-CB 3.32Å; L618-S621 PolarHBondContact O-N 3.04Å; F619-S621 VanDerWaalsContact C-N 3.33Å; F619-S621 PolarHBondContact O-N 2.96Å; S621-S625 WeakPolarHBondContact O-CB 3.28Å; S621-S625 PolarHBondContact O-N 3.06Å; S621-S625 PolarHBondContact O-OG 3.46Å
622L96.6Very high93.3Very high0 Ų030.3 Ų30.30%015%0.154CC..Hα-helixtrans-63.2-47.9172.2-69.8172.8000111.3I595 L598 L602 L618 F619 E620 L624 S625 V626 L644I595-L622 HydrophobicContact CD1-CD2 3.41Å; I595-L622 VanDerWaalsContact CD1-CD2 3.41Å; L598-L622 HydrophobicContact CB-CD2 3.69Å; L598-L622 HydrophobicContact CB-CG 4.5Å; L598-L622 HydrophobicContact CD1-CD2 4.03Å; L598-L622 HydrophobicContact CG-CD2 4.49Å; L602-L622 HydrophobicContact CD2-CD1 3.99Å; L618-L622 WeakPolarHBondContact O-CG 3.35Å; L618-L622 PolarHBondContact O-N 3.09Å; F619-L622 HydrophobicContact CD1-CD1 4.29Å; F619-L622 WeakPolarHBondContact O-CB 3.4Å; F619-L622 PolarHBondContact O-N 3.49Å; E620-L622 VanDerWaalsContact C-N 3.33Å; E620-L622 PolarHBondContact O-N 3.13Å; L622-L624 PolarHBondContact O-N 3.16Å; L622-S625 WeakPolarHBondContact O-CB 3.26Å; L622-S625 PolarHBondContact O-N 3.5Å; L622-V626 WeakPolarHBondContact O-CG2 3.2Å; L622-V626 PolarHBondContact O-N 3.43Å; L622-L644 HydrophobicContact CD1-CD2 4.22Å; L622-L644 HydrophobicContact CD2-CD2 4.09Å
623C94.3Very high93.2Very high0 Ų029.5 Ų29.50%014%0.144CC..Hα-helixtrans-61-41.6177.6-740000112.9F619 E620 V626 R627 L669 F908F619-C623 PolarHBondContact O-N 3.45Å; F619-C623 PolarHBondContact O-SG 3.3Å; E620-C623 PolarHBondContact O-N 3.18Å; C623-V626 PolarHBondContact O-N 2.86Å; C623-R627 WeakPolarHBondContact O-CB 3.38Å; C623-R627 WeakPolarHBondContact O-CG 3.4Å; C623-R627 PolarHBondContact O-N 3.31Å; C623-L669 HydrophobicContact CB-CD2 3.91Å; C623-F908 HydrophobicContact CB-CB 3.86Å
624L93.1Very high93Very high5 Ų528.3 Ų28.33%0.02615%0.145CC..Hα-helixtrans-60.9-45.9173.7-85.9172.8000112M577 F580 E620 L622 V626 R627 I628 F908M577-L624 HydrophobicContact CG-CD1 3.73Å; M577-L624 VanDerWaalsContact O-CD1 3.24Å; M577-L624 WeakPolarHBondContact O-CD1 3.27Å; F580-L624 HydrophobicContact CB-CB 4.27Å; F580-L624 HydrophobicContact CB-CD1 4.01Å; F580-L624 HydrophobicContact CD2-CB 4.37Å; E620-L624 WeakPolarHBondContact O-CB 3.27Å; E620-L624 PolarHBondContact O-N 3.02Å; L622-L624 PolarHBondContact O-N 3.16Å; L624-V626 VanDerWaalsContact C-N 3.3Å; L624-V626 PolarHBondContact O-N 3.49Å; L624-R627 PolarHBondContact O-N 3.5Å; L624-I628 HydrophobicContact CB-CD1 4.45Å; L624-I628 HydrophobicContact CD2-CD1 4.38Å; L624-I628 WeakPolarHBondContact O-CB 3.43Å; L624-I628 VanDerWaalsContact O-CG1 3.29Å; L624-I628 WeakPolarHBondContact O-CG1 3.28Å; L624-I628 PolarHBondContact O-N 3.42Å; L624-F908 HydrophobicContact CD1-CD1 4.45Å; L624-F908 HydrophobicContact CD1-CD2 3.65Å; L624-F908 HydrophobicContact CD1-CE1 4.34Å; L624-F908 HydrophobicContact CD1-CE2 3.53Å; L624-F908 HydrophobicContact CD1-CG 4.13Å; L624-F908 HydrophobicContact CD1-CZ 3.89Å; L624-F908 HydrophobicContact CD2-CB 4.22Å; L624-F908 HydrophobicContact CD2-CD1 3.34Å; L624-F908 HydrophobicContact CD2-CD2 3.98Å; L624-F908 HydrophobicContact CD2-CE1 3.57Å; L624-F908 HydrophobicContact CD2-CE2 4.19Å; L624-F908 HydrophobicContact CD2-CG 3.56Å; L624-F908 HydrophobicContact CD2-CZ 3.99Å; L624-F908 HydrophobicContact CG-CB 3.99Å; L624-F908 HydrophobicContact CG-CD1 3.81Å; L624-F908 HydrophobicContact CG-CD2 3.46Å; L624-F908 VanDerWaalsContact CG-CD2 3.46Å; L624-F908 HydrophobicContact CG-CE1 4.15Å; L624-F908 HydrophobicContact CG-CE2 3.84Å; L624-F908 HydrophobicContact CG-CG 3.45Å; L624-F908 VanDerWaalsContact CG-CG 3.45Å; L624-F908 HydrophobicContact CG-CZ 4.16Å
625S94.8Very high92.6Very high1 Ų133.2 Ų33.21%0.00718%0.175CC..Hα-helixtrans-57.9-44.6178-580000111.4F580 S621 L622 T629 F640F580-S625 VanDerWaalsContact CE2-OG 3.23Å; F580-S625 WeakPolarHBondContact CE2-OG 3.45Å; S621-S625 WeakPolarHBondContact O-CB 3.28Å; S621-S625 PolarHBondContact O-N 3.06Å; S621-S625 PolarHBondContact O-OG 3.46Å; L622-S625 WeakPolarHBondContact O-CB 3.26Å; L622-S625 PolarHBondContact O-N 3.5Å; S625-T629 WeakPolarHBondContact O-CB 3.41Å; S625-T629 PolarHBondContact O-N 2.92Å; S625-T629 PolarHBondContact O-OG1 3.17Å; S625-F640 WeakPolarHBondContact O-CZ 3.44Å
626V94.1Very high92.4Very high0 Ų034.3 Ų34.30%018%0.183CC..Hα-helixtrans-61.6-51.1175.4170.70000110.5L622 C623 L624 C630 F640 L669 L670 I673L622-V626 WeakPolarHBondContact O-CG2 3.2Å; L622-V626 PolarHBondContact O-N 3.43Å; C623-V626 PolarHBondContact O-N 2.86Å; L624-V626 VanDerWaalsContact C-N 3.3Å; L624-V626 PolarHBondContact O-N 3.49Å; V626-C630 WeakPolarHBondContact O-CB 3.35Å; V626-C630 PolarHBondContact O-N 2.93Å; V626-C630 PolarHBondContact O-SG 3.49Å; V626-F640 HydrophobicContact CG2-CB 4.26Å; V626-F640 HydrophobicContact CG2-CD1 3.62Å; V626-F640 HydrophobicContact CG2-CD2 4.23Å; V626-F640 HydrophobicContact CG2-CE1 3.9Å; V626-F640 HydrophobicContact CG2-CE2 4.49Å; V626-F640 HydrophobicContact CG2-CG 3.79Å; V626-F640 HydrophobicContact CG2-CZ 4.32Å; V626-L669 HydrophobicContact CB-CD2 4.16Å; V626-L669 HydrophobicContact CG1-CD2 3.95Å; V626-L669 HydrophobicContact CG1-CG 4.1Å; V626-L670 HydrophobicContact CG1-CD2 3.76Å; V626-L670 HydrophobicContact CG2-CD2 3.88Å; V626-I673 HydrophobicContact CG1-CD1 3.48Å; V626-I673 VanDerWaalsContact CG1-CD1 3.48Å
627R91.8Very high92.2Very high115 Ų11532.8 Ų32.843%0.43418%0.176SC..Hα-helixtrans-64.1-45.7-175.9-79.5-177.265.7166.44.6113.3C623 L624 K631 L669 F908C623-R627 WeakPolarHBondContact O-CB 3.38Å; C623-R627 WeakPolarHBondContact O-CG 3.4Å; C623-R627 PolarHBondContact O-N 3.31Å; L624-R627 PolarHBondContact O-N 3.5Å; R627-K631 WeakPolarHBondContact O-CB 3.31Å; R627-K631 PolarHBondContact O-N 3.06Å; R627-L669 HydrophobicContact CG-CD1 3.98Å; R627-L669 HydrophobicContact CG-CD2 4.2Å; R627-F908 WeakPolarHBondContact CD-O 3.17Å; R627-F908 PolarHBondContact NH1-O 2.96Å
628I91.6Very high92Very high6 Ų633.6 Ų33.63%0.03119%0.186CC..Hα-helixtrans-64.1-50.5-177.7-69.3166.2000109.4F580 Q584 I587 V588 L624 A632F580-I628 HydrophobicContact CB-CD1 4.43Å; F580-I628 WeakPolarHBondContact O-CD1 3.39Å; Q584-I628 VanDerWaalsContact O-CG2 3.32Å; Q584-I628 WeakPolarHBondContact O-CG2 3.42Å; I587-I628 HydrophobicContact CD1-CD1 3.55Å; I587-I628 HydrophobicContact CD1-CG2 4.43Å; I587-I628 HydrophobicContact CG1-CD1 4.39Å; I587-I628 HydrophobicContact CG1-CG2 4.2Å; V588-I628 HydrophobicContact CG2-CG2 3.78Å; L624-I628 HydrophobicContact CB-CD1 4.45Å; L624-I628 HydrophobicContact CD2-CD1 4.38Å; L624-I628 WeakPolarHBondContact O-CB 3.43Å; L624-I628 VanDerWaalsContact O-CG1 3.29Å; L624-I628 WeakPolarHBondContact O-CG1 3.28Å; L624-I628 PolarHBondContact O-N 3.42Å; I628-A632 PolarHBondContact O-N 3.33Å
629T92.3Very high91.7Very high14 Ų1437 Ų379%0.08621%0.211CC..Hα-helixtrans-70.1-44.3-176.7-520000112S625 K631 A632 N633 T636 F640S625-T629 WeakPolarHBondContact O-CB 3.41Å; S625-T629 PolarHBondContact O-N 2.92Å; S625-T629 PolarHBondContact O-OG1 3.17Å; T629-K631 VanDerWaalsContact C-N 3.32Å; T629-K631 PolarHBondContact O-N 2.91Å; T629-A632 WeakPolarHBondContact O-CB 3.35Å; T629-A632 PolarHBondContact O-N 2.63Å; T629-A632 VanDerWaalsContact O-N 3.13Å; T629-N633 PolarHBondContact O-N 3.46Å; T629-T636 HydrophobicContact CG2-CG2 4.12Å; T629-F640 HydrophobicContact CG2-CE2 4.11Å
630C91.4Very high91.5Very high6 Ų637.4 Ų37.44%0.04121%0.212CC..Hα-helixtrans-73.7-22.9-179.2-60.80000113V626 A632 N633 P634 T636 I673V626-C630 WeakPolarHBondContact O-CB 3.35Å; V626-C630 PolarHBondContact O-N 2.93Å; V626-C630 PolarHBondContact O-SG 3.49Å; C630-A632 VanDerWaalsContact C-N 3.33Å; C630-N633 CarbonylContact O-C 3.41Å; C630-P634 VanDerWaalsContact O-CA 3.32Å; C630-P634 WeakPolarHBondContact O-CA 3.47Å; C630-P634 WeakPolarHBondContact O-CD 3.34Å; C630-P634 WeakPolarHBondContact O-CG 3.47Å; C630-P634 VanDerWaalsContact O-N 3.11Å; C630-T636 PolarHBondContact SG-OG1 2.86Å; C630-I673 HydrophobicContact CB-CD1 3.87Å; C630-I673 HydrophobicContact CB-CG2 3.93Å
631K88.6Confident91.5Very high152 Ų15237.9 Ų37.966%0.66121%0.214SC*.Hα-helixtrans-65.7-38.8168.5-177.1-170.7175.5-152.40111E585 R627 T629E585-K631 IonicContact OE1-NZ 2.68Å; R627-K631 WeakPolarHBondContact O-CB 3.31Å; R627-K631 PolarHBondContact O-N 3.06Å; T629-K631 VanDerWaalsContact C-N 3.32Å; T629-K631 PolarHBondContact O-N 2.91Å
632A83.7Confident91.2Very high63 Ų6345 Ų4552%0.52125%0.248SC..Hα-helixtrans-74-40.8176.300000112.2I628 T629 C630I628-A632 PolarHBondContact O-N 3.33Å; T629-A632 WeakPolarHBondContact O-CB 3.35Å; T629-A632 PolarHBondContact O-N 2.63Å; T629-A632 VanDerWaalsContact O-N 3.13Å; C630-A632 VanDerWaalsContact C-N 3.33Å
633N88.3Confident91Very high72 Ų7246.6 Ų46.639%0.38526%0.261SS..  trans-147.4102.1176.21797.5000111.5T629 C630 T635 T636T629-N633 PolarHBondContact O-N 3.46Å; C630-N633 CarbonylContact O-C 3.41Å; N633-T635 VanDerWaalsContact CG-OG1 3.26Å; N633-T635 PolarHBondContact ND2-OG1 2.76Å; N633-T635 VanDerWaalsContact ND2-OG1 3.17Å; N633-T635 PolarHBondContact O-N 3.32Å; N633-T635 PolarHBondContact OD1-N 3.22Å; N633-T635 PolarHBondContact OD1-OG1 3.35Å; N633-T636 HydrophobicContact CB-CG2 4.05Å; N633-T636 PolarHBondContact O-N 2.85Å; N633-T636 VanDerWaalsContact O-N 3.16Å; N633-T636 PolarHBondContact O-OG1 2.75Å
634P87.3Confident91Very high75 Ų7546.6 Ų46.649%0.48726%0.261SS..G310 helixtrans-59.1-23.2-177.5-27.435.1000115.3C630 T636 V637 I673C630-P634 VanDerWaalsContact O-CA 3.32Å; C630-P634 WeakPolarHBondContact O-CA 3.47Å; C630-P634 WeakPolarHBondContact O-CD 3.34Å; C630-P634 WeakPolarHBondContact O-CG 3.47Å; C630-P634 VanDerWaalsContact O-N 3.11Å; P634-T636 PolarHBondContact O-N 2.86Å; P634-V637 WeakPolarHBondContact O-CG1 3.37Å; P634-V637 PolarHBondContact O-N 2.95Å; P634-I673 HydrophobicContact CB-CG2 4.48Å
635T87Confident90.9Very high103 Ų10347.9 Ų47.963%0.63227%0.266SS*.G310 helixtrans-70.3-16.4-178.761.50000113.3N633 V637N633-T635 VanDerWaalsContact CG-OG1 3.26Å; N633-T635 PolarHBondContact ND2-OG1 2.76Å; N633-T635 VanDerWaalsContact ND2-OG1 3.17Å; N633-T635 PolarHBondContact O-N 3.32Å; N633-T635 PolarHBondContact OD1-N 3.22Å; N633-T635 PolarHBondContact OD1-OG1 3.35Å; T635-V637 PolarHBondContact O-N 2.94Å
636T89.6Confident90.8Very high29 Ų2951.8 Ų51.818%0.17829%0.291CS..G310 helixtrans-70.7-9.7177.860.20000113.7T629 C630 N633 P634 S638 S639 F640T629-T636 HydrophobicContact CG2-CG2 4.12Å; C630-T636 PolarHBondContact SG-OG1 2.86Å; N633-T636 HydrophobicContact CB-CG2 4.05Å; N633-T636 PolarHBondContact O-N 2.85Å; N633-T636 VanDerWaalsContact O-N 3.16Å; N633-T636 PolarHBondContact O-OG1 2.75Å; P634-T636 PolarHBondContact O-N 2.86Å; T636-S638 PolarHBondContact O-N 3.09Å; T636-S639 WeakPolarHBondContact O-CB 3.38Å; T636-S639 PolarHBondContact O-N 3.25Å; T636-F640 WeakPolarHBondContact O-CD2 3.38Å; T636-F640 PolarHBondContact O-N 3.44Å
637V92Very high90.8Very high4 Ų452.2 Ų52.22%0.02429%0.294CS..Hα-helixtrans-54.4-38.2177.968.10000111.8P634 T635 S639 F640 E641 L670 I673P634-V637 WeakPolarHBondContact O-CG1 3.37Å; P634-V637 PolarHBondContact O-N 2.95Å; T635-V637 PolarHBondContact O-N 2.94Å; V637-S639 VanDerWaalsContact C-N 3.31Å; V637-S639 PolarHBondContact O-N 3.39Å; V637-F640 WeakPolarHBondContact O-CB 3.44Å; V637-F640 PolarHBondContact O-N 2.98Å; V637-F640 VanDerWaalsContact O-N 3.13Å; V637-E641 WeakPolarHBondContact O-CG 3.32Å; V637-E641 PolarHBondContact O-N 3.4Å; V637-L670 HydrophobicContact CG2-CB 4.26Å; V637-L670 HydrophobicContact CG2-CD2 3.8Å; V637-L670 WeakPolarHBondContact CG2-O 3.37Å; V637-I673 HydrophobicContact CB-CG2 3.97Å; V637-I673 HydrophobicContact CG1-CG2 4.41Å; V637-I673 HydrophobicContact CG2-CB 4.18Å; V637-I673 HydrophobicContact CG2-CG2 4.14Å
638S90.5Very high90.9Very high53 Ų5346.9 Ų46.937%0.37127%0.274SS..Hα-helixtrans-63.3-35.2178.6-600000112.7T636 F640 E641 E642T636-S638 PolarHBondContact O-N 3.09Å; S638-F640 VanDerWaalsContact C-N 3.34Å; S638-F640 PolarHBondContact O-N 3.32Å; S638-E641 PolarHBondContact O-N 3.01Å; S638-E642 WeakPolarHBondContact O-CG 3.44Å; S638-E642 PolarHBondContact O-N 2.91Å
639S90.9Very high90.8Very high73 Ų7349.6 Ų49.651%0.5129%0.291SS..Hα-helixtrans-68.2-33.6176-54.10000112.4T636 V637 A643T636-S639 WeakPolarHBondContact O-CB 3.38Å; T636-S639 PolarHBondContact O-N 3.25Å; V637-S639 VanDerWaalsContact C-N 3.31Å; V637-S639 PolarHBondContact O-N 3.39Å; S639-A643 PolarHBondContact O-N 3.3Å
640F93.6Very high90.7Very high8 Ų852 Ų524%0.03530%0.301CS..Hα-helixtrans-69.7-38.7172.1-77.5-79.9000111.8I591 I595 S625 V626 T629 T636 V637 S638 A643 L644 L670I591-F640 HydrophobicContact CG2-CE1 4.25Å; I591-F640 HydrophobicContact CG2-CZ 3.75Å; I595-F640 HydrophobicContact CB-CE1 4.5Å; I595-F640 HydrophobicContact CD1-CD1 3.87Å; I595-F640 HydrophobicContact CD1-CE1 3.74Å; I595-F640 HydrophobicContact CG1-CD1 3.93Å; I595-F640 HydrophobicContact CG1-CE1 3.88Å; S625-F640 WeakPolarHBondContact O-CZ 3.44Å; V626-F640 HydrophobicContact CG2-CB 4.26Å; V626-F640 HydrophobicContact CG2-CD1 3.62Å; V626-F640 HydrophobicContact CG2-CD2 4.23Å; V626-F640 HydrophobicContact CG2-CE1 3.9Å; V626-F640 HydrophobicContact CG2-CE2 4.49Å; V626-F640 HydrophobicContact CG2-CG 3.79Å; V626-F640 HydrophobicContact CG2-CZ 4.32Å; T629-F640 HydrophobicContact CG2-CE2 4.11Å; T636-F640 WeakPolarHBondContact O-CD2 3.38Å; T636-F640 PolarHBondContact O-N 3.44Å; V637-F640 WeakPolarHBondContact O-CB 3.44Å; V637-F640 PolarHBondContact O-N 2.98Å; V637-F640 VanDerWaalsContact O-N 3.13Å; S638-F640 VanDerWaalsContact C-N 3.34Å; S638-F640 PolarHBondContact O-N 3.32Å; F640-A643 PolarHBondContact O-N 3.05Å; F640-L644 WeakPolarHBondContact O-CB 3.38Å; F640-L644 WeakPolarHBondContact O-CG 3.17Å; F640-L644 PolarHBondContact O-N 3.36Å; F640-L670 HydrophobicContact CB-CD2 3.85Å
641E93.2Very high90.7Very high16 Ų1651.8 Ų51.88%0.07530%0.3CS..Hα-helixtrans-62.4-46.7175.8-70171.7162.400111.2V637 S638 A643 L644 F645 L670 H674 Y682V637-E641 WeakPolarHBondContact O-CG 3.32Å; V637-E641 PolarHBondContact O-N 3.4Å; S638-E641 PolarHBondContact O-N 3.01Å; E641-A643 PolarHBondContact O-N 3.2Å; E641-L644 PolarHBondContact O-N 3.24Å; E641-F645 HydrophobicContact CB-CD1 4.12Å; E641-F645 HydrophobicContact CB-CE1 4.18Å; E641-F645 HydrophobicContact CG-CD1 4.39Å; E641-F645 HydrophobicContact CG-CE1 3.98Å; E641-F645 HydrophobicContact CG-CZ 4.41Å; E641-F645 WeakPolarHBondContact O-CB 3.47Å; E641-F645 WeakPolarHBondContact O-CD1 3.45Å; E641-F645 WeakPolarHBondContact O-CG 3.19Å; E641-F645 PolarHBondContact O-N 3.17Å; E641-L670 HydrophobicContact CG-CD1 4.17Å; E641-H674 VanDerWaalsContact CD-NE2 3.34Å; E641-H674 IonicContact OE1-CD2 2.93Å; E641-H674 IonicContact OE1-CE1 3.27Å; E641-H674 IonicContact OE1-NE2 3.59Å; E641-H674 PolarHBondContact OE1-NE2 3.4Å; E641-H674 IonicContact OE2-CE1 3.35Å; E641-H674 IonicContact OE2-NE2 2.72Å; E641-H674 PolarHBondContact OE2-NE2 2.81Å; E641-Y682 WeakPolarHBondContact OE1-CE2 3.33Å; E641-Y682 PolarHBondContact OE1-OH 3.43Å; E641-Y682 VanDerWaalsContact OE1-OH 3.05Å
642E91.6Very high90.7Very high151 Ų15146.7 Ų46.771%0.70628%0.279SS*.Hα-helixtrans-56.2-38.8175-75.1173.1-175.100112.5S638 P646S638-E642 WeakPolarHBondContact O-CG 3.44Å; S638-E642 PolarHBondContact O-N 2.91Å; E642-P646 WeakPolarHBondContact O-CD 3.44Å
643A91.8Very high90.9Very high32 Ų3251 Ų5126%0.26429%0.289SS..Hα-helixtrans-75.8-40.8178.900000113.3T599 S639 F640 E641T599-A643 VanDerWaalsContact CG2-O 3.31Å; T599-A643 WeakPolarHBondContact CG2-O 3.09Å; S639-A643 PolarHBondContact O-N 3.3Å; F640-A643 PolarHBondContact O-N 3.05Å; E641-A643 PolarHBondContact O-N 3.2Å
644L94.1Very high90.9Very high0 Ų052.6 Ų52.60%030%0.297CS..Hα-helixtrans-94-31.6-168.5-67.3171.1000113.8L622 F640 E641 V647 F648 V666 L670L622-L644 HydrophobicContact CD1-CD2 4.22Å; L622-L644 HydrophobicContact CD2-CD2 4.09Å; F640-L644 WeakPolarHBondContact O-CB 3.38Å; F640-L644 WeakPolarHBondContact O-CG 3.17Å; F640-L644 PolarHBondContact O-N 3.36Å; E641-L644 PolarHBondContact O-N 3.24Å; L644-V647 PolarHBondContact O-N 3.09Å; L644-V647 VanDerWaalsContact O-N 3.14Å; L644-F648 HydrophobicContact CB-CD2 4.25Å; L644-F648 HydrophobicContact CB-CE1 4.27Å; L644-F648 HydrophobicContact CB-CE2 3.79Å; L644-F648 HydrophobicContact CB-CZ 3.8Å; L644-F648 HydrophobicContact CD1-CE2 4.46Å; L644-F648 HydrophobicContact CD1-CZ 4.13Å; L644-F648 HydrophobicContact CD2-CE1 4.46Å; L644-F648 HydrophobicContact CD2-CZ 4.34Å; L644-F648 HydrophobicContact CG-CZ 4.32Å; L644-F648 WeakPolarHBondContact O-CG 3.01Å; L644-F648 PolarHBondContact O-N 2.75Å; L644-V666 HydrophobicContact CD1-CG1 4.23Å; L644-L670 HydrophobicContact CD1-CD1 4.33Å
645F92.1Very high90.8Very high33 Ų3352.1 Ų52.115%0.14529%0.291CS..Hα-helixtrans-60.2-39.4-174.3-87.632.8000114.6E641 V647 F648 T649 M667 L670 S681 Y682E641-F645 HydrophobicContact CB-CD1 4.12Å; E641-F645 HydrophobicContact CB-CE1 4.18Å; E641-F645 HydrophobicContact CG-CD1 4.39Å; E641-F645 HydrophobicContact CG-CE1 3.98Å; E641-F645 HydrophobicContact CG-CZ 4.41Å; E641-F645 WeakPolarHBondContact O-CB 3.47Å; E641-F645 WeakPolarHBondContact O-CD1 3.45Å; E641-F645 WeakPolarHBondContact O-CG 3.19Å; E641-F645 PolarHBondContact O-N 3.17Å; F645-V647 VanDerWaalsContact C-N 3.31Å; F645-V647 PolarHBondContact O-N 3.25Å; F645-F648 HydrophobicContact CD1-CD2 4.23Å; F645-F648 HydrophobicContact CE1-CD2 4.48Å; F645-F648 PolarHBondContact O-N 3.35Å; F645-T649 WeakPolarHBondContact O-CB 3.42Å; F645-T649 PolarHBondContact O-N 3.42Å; F645-T649 PolarHBondContact O-OG1 3.32Å; F645-M667 HydrophobicContact CE1-CE 4.42Å; F645-M667 HydrophobicContact CZ-CE 3.98Å; F645-L670 HydrophobicContact CE1-CD1 4.42Å; F645-S681 WeakPolarHBondContact CE2-OG 3.39Å; F645-Y682 HydrophobicContact CE1-CE2 4.2Å; F645-Y682 AromaticContact CE1-CZ 3.99Å; F645-Y682 HydrophobicContact CE2-CD2 4.14Å; F645-Y682 AromaticContact CE2-CE2 3.97Å; F645-Y682 HydrophobicContact CE2-CE2 3.97Å; F645-Y682 HydrophobicContact CZ-CD1 4.44Å; F645-Y682 AromaticContact CZ-CD2 3.87Å; F645-Y682 HydrophobicContact CZ-CD2 3.87Å; F645-Y682 AromaticContact CZ-CE1 3.94Å; F645-Y682 HydrophobicContact CZ-CE1 3.94Å; F645-Y682 AromaticContact CZ-CE2 3.31Å; F645-Y682 HydrophobicContact CZ-CE2 3.31Å; F645-Y682 HydrophobicContact CZ-CG 4.41Å; F645-Y682 AromaticContact CZ-CZ 3.37Å
646P92.4Very high90.9Very high82 Ų8248 Ų4853%0.53227%0.266SS..Hα-helixtrans-57.5-45174.8-26.436.1000112.1E642 T649 E650E642-P646 WeakPolarHBondContact O-CD 3.44Å; P646-T649 PolarHBondContact O-N 3.07Å; P646-E650 PolarHBondContact O-N 2.97Å; P646-E650 VanDerWaalsContact O-N 3.14Å
647V93.4Very high90.8Very high9 Ų950.1 Ų50.16%0.05527%0.273CS..Hα-helixtrans-70.3-40.5-179.7-175.50000111.4T599 L602 L603 L644 F645 T649 E650 I651T599-V647 HydrophobicContact CG2-CG2 3.58Å; L602-V647 HydrophobicContact CD2-CG1 3.95Å; L602-V647 HydrophobicContact CG-CG1 3.9Å; L603-V647 HydrophobicContact CB-CG1 4.21Å; L603-V647 HydrophobicContact CB-CG2 4.26Å; L603-V647 HydrophobicContact CD1-CG1 4.37Å; L644-V647 PolarHBondContact O-N 3.09Å; L644-V647 VanDerWaalsContact O-N 3.14Å; F645-V647 VanDerWaalsContact C-N 3.31Å; F645-V647 PolarHBondContact O-N 3.25Å; V647-T649 VanDerWaalsContact C-N 3.29Å; V647-T649 PolarHBondContact O-N 3.38Å; V647-E650 PolarHBondContact O-N 2.85Å; V647-I651 HydrophobicContact CG1-CD1 3.99Å; V647-I651 WeakPolarHBondContact O-CG1 3.25Å; V647-I651 PolarHBondContact O-N 3.22Å
648F93.5Very high90.6Very high3 Ų353.7 Ų53.71%0.01329%0.29CS..Hα-helixtrans-61.9-38.5174.7-66.7-11.2000112.1L602 F619 L644 F645 I651 L652 V663 V666 M667L602-F648 HydrophobicContact CD2-CE1 4.03Å; F619-F648 HydrophobicContact CE1-CE1 4.36Å; L644-F648 HydrophobicContact CB-CD2 4.25Å; L644-F648 HydrophobicContact CB-CE1 4.27Å; L644-F648 HydrophobicContact CB-CE2 3.79Å; L644-F648 HydrophobicContact CB-CZ 3.8Å; L644-F648 HydrophobicContact CD1-CE2 4.46Å; L644-F648 HydrophobicContact CD1-CZ 4.13Å; L644-F648 HydrophobicContact CD2-CE1 4.46Å; L644-F648 HydrophobicContact CD2-CZ 4.34Å; L644-F648 HydrophobicContact CG-CZ 4.32Å; L644-F648 WeakPolarHBondContact O-CG 3.01Å; L644-F648 PolarHBondContact O-N 2.75Å; F645-F648 HydrophobicContact CD1-CD2 4.23Å; F645-F648 HydrophobicContact CE1-CD2 4.48Å; F645-F648 PolarHBondContact O-N 3.35Å; F648-I651 PolarHBondContact O-N 3.15Å; F648-L652 WeakPolarHBondContact O-CB 3.39Å; F648-L652 WeakPolarHBondContact O-CD1 3.44Å; F648-L652 WeakPolarHBondContact O-CG 3.2Å; F648-L652 PolarHBondContact O-N 3.45Å; F648-V663 HydrophobicContact CB-CG1 3.83Å; F648-V663 HydrophobicContact CD1-CB 4.37Å; F648-V663 HydrophobicContact CD1-CG1 3.95Å; F648-V663 HydrophobicContact CD1-CG2 3.69Å; F648-V663 HydrophobicContact CD2-CG1 4Å; F648-V663 HydrophobicContact CE1-CG1 4.49Å; F648-V663 HydrophobicContact CE1-CG2 4.03Å; F648-V663 HydrophobicContact CG-CG1 3.67Å; F648-V663 HydrophobicContact CG-CG2 4.28Å; F648-V666 HydrophobicContact CE2-CB 4.28Å; F648-V666 HydrophobicContact CE2-CG1 4.06Å; F648-V666 HydrophobicContact CZ-CB 3.89Å; F648-V666 HydrophobicContact CZ-CG1 3.72Å; F648-V666 HydrophobicContact CZ-CG2 4.47Å; F648-M667 HydrophobicContact CD2-CG 3.85Å; F648-M667 HydrophobicContact CD2-SD 4.35Å; F648-M667 HydrophobicContact CE2-CG 3.97Å
649T89.6Confident90.7Very high64 Ų6451.2 Ų51.239%0.39327%0.272SS..Hα-helixtrans-63.6-43.6176.6-57.50000111F645 P646 V647 L652 Q653F645-T649 WeakPolarHBondContact O-CB 3.42Å; F645-T649 PolarHBondContact O-N 3.42Å; F645-T649 PolarHBondContact O-OG1 3.32Å; P646-T649 PolarHBondContact O-N 3.07Å; V647-T649 VanDerWaalsContact C-N 3.29Å; V647-T649 PolarHBondContact O-N 3.38Å; T649-L652 PolarHBondContact O-N 2.99Å; T649-Q653 HydrophobicContact CG2-CG 4.31Å; T649-Q653 WeakPolarHBondContact O-CB 3.13Å; T649-Q653 VanDerWaalsContact O-CG 3.26Å; T649-Q653 WeakPolarHBondContact O-CG 3.48Å; T649-Q653 PolarHBondContact O-N 2.9Å
650E90.4Very high90.8Very high65 Ų6547.9 Ų47.930%0.30425%0.249SC..Hα-helixtrans-63-43.9176-173.2171.7164.400112L603 P646 V647 L652 Q653 N654L603-E650 WeakPolarHBondContact CD1-OE2 3.4Å; P646-E650 PolarHBondContact O-N 2.97Å; P646-E650 VanDerWaalsContact O-N 3.14Å; V647-E650 PolarHBondContact O-N 2.85Å; E650-L652 PolarHBondContact O-N 3.24Å; E650-Q653 PolarHBondContact O-N 3.02Å; E650-N654 VanDerWaalsContact CG-ND2 3.33Å; E650-N654 WeakPolarHBondContact CG-ND2 3.49Å; E650-N654 VanDerWaalsContact O-CB 3.29Å; E650-N654 WeakPolarHBondContact O-CB 3.34Å; E650-N654 PolarHBondContact O-N 3.14Å; E650-N654 PolarHBondContact O-ND2 2.82Å
651I91.5Very high90.8Very high0 Ų047.7 Ų47.70%025%0.248CC..Hα-helixtrans-58.9-45.4175.2-74164.5000111.4L602 V647 F648 D655 V656 F659 L660 V663L602-I651 HydrophobicContact CD1-CD1 4.45Å; L602-I651 HydrophobicContact CG-CD1 4.43Å; V647-I651 HydrophobicContact CG1-CD1 3.99Å; V647-I651 WeakPolarHBondContact O-CG1 3.25Å; V647-I651 PolarHBondContact O-N 3.22Å; F648-I651 PolarHBondContact O-N 3.15Å; I651-D655 PolarHBondContact O-N 3.19Å; I651-D655 VanDerWaalsContact O-N 3.17Å; I651-V656 HydrophobicContact CG2-CB 4.21Å; I651-V656 PolarHBondContact O-N 2.91Å; I651-V656 VanDerWaalsContact O-N 3.12Å; I651-F659 HydrophobicContact CD1-CB 4.35Å; I651-F659 HydrophobicContact CD1-CD2 3.87Å; I651-F659 HydrophobicContact CG1-CD2 4.3Å; I651-F659 HydrophobicContact CG2-CB 3.86Å; I651-L660 HydrophobicContact CG2-CD2 4.2Å; I651-V663 HydrophobicContact CB-CG2 4.49Å; I651-V663 HydrophobicContact CD1-CG2 4.03Å; I651-V663 HydrophobicContact CG2-CG2 3.9Å
652L88.7Confident90.8Very high45 Ų4547.8 Ų47.824%0.23625%0.248CC..Hα-helixtrans-67.7-42.5179.8-72.7164.5000112F648 T649 E650 D655 L660 F664 L685F648-L652 WeakPolarHBondContact O-CB 3.39Å; F648-L652 WeakPolarHBondContact O-CD1 3.44Å; F648-L652 WeakPolarHBondContact O-CG 3.2Å; F648-L652 PolarHBondContact O-N 3.45Å; T649-L652 PolarHBondContact O-N 2.99Å; E650-L652 PolarHBondContact O-N 3.24Å; L652-D655 PolarHBondContact O-N 3.22Å; L652-L660 HydrophobicContact CD2-CD2 3.56Å; L652-L660 HydrophobicContact CG-CD2 4.34Å; L652-F664 HydrophobicContact CD2-CE1 3.78Å; L652-F664 HydrophobicContact CD2-CZ 3.88Å; L652-L685 HydrophobicContact CD1-CD1 4.32Å
653Q87.6Confident91Very high154 Ų15440.6 Ų40.672%0.7221%0.214SC*.Hα-helixtrans-69.9-38-179.8-75177-7.500112.7T649 E650 D655T649-Q653 HydrophobicContact CG2-CG 4.31Å; T649-Q653 WeakPolarHBondContact O-CB 3.13Å; T649-Q653 VanDerWaalsContact O-CG 3.26Å; T649-Q653 WeakPolarHBondContact O-CG 3.48Å; T649-Q653 PolarHBondContact O-N 2.9Å; E650-Q653 PolarHBondContact O-N 3.02Å; Q653-D655 VanDerWaalsContact C-N 3.25Å; Q653-D655 PolarHBondContact O-N 3.46Å
654N87.8Confident91.1Very high105 Ų10539 Ų3956%0.56120%0.202SC*.THydrogen-bonded Turntrans-82.7-1.6177.9-69.4-34.8000113.4E650 V656E650-N654 VanDerWaalsContact CG-ND2 3.33Å; E650-N654 WeakPolarHBondContact CG-ND2 3.49Å; E650-N654 VanDerWaalsContact O-CB 3.29Å; E650-N654 WeakPolarHBondContact O-CB 3.34Å; E650-N654 PolarHBondContact O-N 3.14Å; E650-N654 PolarHBondContact O-ND2 2.82Å; N654-V656 VanDerWaalsContact C-N 3.34Å; N654-V656 HydrophobicContact CB-CG2 3.99Å; N654-V656 PolarHBondContact O-N 3.4Å
655D85.6Confident91.2Very high66 Ų6639.2 Ų39.235%0.35320%0.203SC..THydrogen-bonded Turntrans54.145.5-179.9-167.637.3000113.1I651 L652 Q653 Q657 R697I651-D655 PolarHBondContact O-N 3.19Å; I651-D655 VanDerWaalsContact O-N 3.17Å; L652-D655 PolarHBondContact O-N 3.22Å; Q653-D655 VanDerWaalsContact C-N 3.25Å; Q653-D655 PolarHBondContact O-N 3.46Å; D655-Q657 VanDerWaalsContact O-CG 3.29Å; D655-Q657 WeakPolarHBondContact O-CG 3.41Å; D655-Q657 PolarHBondContact O-N 3.05Å; D655-R697 VanDerWaalsContact CG-NH2 3.33Å; D655-R697 IonicContact OD1-CZ 3.83Å; D655-R697 IonicContact OD1-NH1 2.73Å; D655-R697 PolarHBondContact OD1-NH1 2.72Å; D655-R697 IonicContact OD1-NH2 3.57Å; D655-R697 PolarHBondContact OD1-NH2 2.94Å; D655-R697 VanDerWaalsContact OD1-NH2 3.12Å; D655-R697 IonicContact OD2-CZ 2.93Å; D655-R697 IonicContact OD2-NH1 2.76Å; D655-R697 IonicContact OD2-NH2 3.98Å; D655-R697 PolarHBondContact OD2-NH2 3.44Å
656V89.5Confident91.3Very high17 Ų1737.7 Ų37.710%0.10320%0.196CC..  trans-73.788.9179.7-172.80000109.7P609 I651 N654 E658 F659 L660P609-V656 HydrophobicContact CG-CG1 3.87Å; I651-V656 HydrophobicContact CG2-CB 4.21Å; I651-V656 PolarHBondContact O-N 2.91Å; I651-V656 VanDerWaalsContact O-N 3.12Å; N654-V656 VanDerWaalsContact C-N 3.34Å; N654-V656 HydrophobicContact CB-CG2 3.99Å; N654-V656 PolarHBondContact O-N 3.4Å; V656-E658 VanDerWaalsContact C-N 3.26Å; V656-E658 PolarHBondContact O-N 3.36Å; V656-F659 HydrophobicContact CG1-CB 4.37Å; V656-F659 HydrophobicContact CG1-CD2 4.39Å; V656-F659 HydrophobicContact CG1-CG 4.3Å; V656-F659 PolarHBondContact O-N 2.89Å; V656-L660 PolarHBondContact O-N 2.95Å
657Q86.9Confident91.5Very high72 Ų7234 Ų3434%0.33617%0.172SC..THydrogen-bonded Turntrans-60.7-32-164.5-51.9-168.1-2.800113.9D655 F659 P661 T901D655-Q657 VanDerWaalsContact O-CG 3.29Å; D655-Q657 WeakPolarHBondContact O-CG 3.41Å; D655-Q657 PolarHBondContact O-N 3.05Å; Q657-F659 PolarHBondContact O-N 2.77Å; Q657-P661 WeakPolarHBondContact O-CD 3.44Å; Q657-T901 PolarHBondContact O-OG1 2.72Å
658E88.3Confident91.5Very high80 Ų8033.6 Ų33.637%0.37417%0.169SC..THydrogen-bonded Turntrans-62.8-29.9178-61.874.3-170.400111.9P609 V656 T901P609-E658 HydrophobicContact CB-CB 3.97Å; P609-E658 HydrophobicContact CB-CG 4.01Å; P609-E658 HydrophobicContact CG-CB 4Å; P609-E658 VanDerWaalsContact CG-CD 3.49Å; P609-E658 HydrophobicContact CG-CG 3.75Å; P609-E658 VanDerWaalsContact CG-OE2 3.32Å; P609-E658 WeakPolarHBondContact CG-OE2 3.47Å; V656-E658 VanDerWaalsContact C-N 3.26Å; V656-E658 PolarHBondContact O-N 3.36Å; E658-T901 HydrophobicContact CB-CG2 4.21Å; E658-T901 HydrophobicContact CG-CG2 3.78Å
659F93.1Very high91.5Very high1 Ų134 Ų340%0.00417%0.172CC..THydrogen-bonded Turntrans-104.1-19.8-171-72.36.8000113.6L602 V605 S606 P609 N615 F619 I651 V656 Q657 Y662 V663L602-F659 HydrophobicContact CD1-CD2 4.1Å; L602-F659 HydrophobicContact CD1-CE2 3.91Å; V605-F659 HydrophobicContact CB-CZ 4.27Å; V605-F659 HydrophobicContact CG2-CE2 3.83Å; V605-F659 HydrophobicContact CG2-CZ 3.7Å; S606-F659 VanDerWaalsContact CA-CE2 3.41Å; P609-F659 HydrophobicContact CB-CD1 4.32Å; P609-F659 HydrophobicContact CB-CE1 3.61Å; P609-F659 HydrophobicContact CB-CZ 3.8Å; N615-F659 HydrophobicContact CB-CE1 3.75Å; N615-F659 HydrophobicContact CB-CZ 4.21Å; N615-F659 VanDerWaalsContact CG-CE1 3.4Å; N615-F659 WeakPolarHBondContact ND2-CE1 3.45Å; N615-F659 WeakPolarHBondContact OD1-CZ 3.27Å; F619-F659 HydrophobicContact CE2-CB 4.37Å; F619-F659 HydrophobicContact CE2-CD1 4.1Å; F619-F659 HydrophobicContact CE2-CD2 4.28Å; F619-F659 HydrophobicContact CE2-CG 4Å; F619-F659 HydrophobicContact CZ-CB 4.26Å; F619-F659 HydrophobicContact CZ-CD2 4.35Å; F619-F659 HydrophobicContact CZ-CG 4.23Å; I651-F659 HydrophobicContact CD1-CB 4.35Å; I651-F659 HydrophobicContact CD1-CD2 3.87Å; I651-F659 HydrophobicContact CG1-CD2 4.3Å; I651-F659 HydrophobicContact CG2-CB 3.86Å; V656-F659 HydrophobicContact CG1-CB 4.37Å; V656-F659 HydrophobicContact CG1-CD2 4.39Å; V656-F659 HydrophobicContact CG1-CG 4.3Å; V656-F659 PolarHBondContact O-N 2.89Å; Q657-F659 PolarHBondContact O-N 2.77Å; F659-Y662 PolarHBondContact O-N 3.2Å; F659-V663 WeakPolarHBondContact O-CG2 3.48Å; F659-V663 PolarHBondContact O-N 3.31Å
660L92.2Very high91.7Very high2 Ų231 Ų311%0.0115%0.153CC..Hα-helixtrans-51.9-48.8179.8-63.5176.4000113I651 L652 V656 Y662 V663 F664I651-L660 HydrophobicContact CG2-CD2 4.2Å; L652-L660 HydrophobicContact CD2-CD2 3.56Å; L652-L660 HydrophobicContact CG-CD2 4.34Å; V656-L660 PolarHBondContact O-N 2.95Å; L660-Y662 VanDerWaalsContact C-N 3.26Å; L660-Y662 PolarHBondContact O-N 3.3Å; L660-V663 PolarHBondContact O-N 2.96Å; L660-F664 HydrophobicContact CB-CE2 3.95Å; L660-F664 HydrophobicContact CB-CZ 4.47Å; L660-F664 WeakPolarHBondContact O-CD2 3.42Å; L660-F664 WeakPolarHBondContact O-CG 3.44Å; L660-F664 PolarHBondContact O-N 2.73Å; L660-F664 VanDerWaalsContact O-N 3.08Å
661P92.8Very high91.8Very high4 Ų427.9 Ų27.93%0.02614%0.138CC..Hα-helixtrans-59.7-36.6178.9-23.334000113.1Q657 Q665 N700 P703 F903Q657-P661 WeakPolarHBondContact O-CD 3.44Å; P661-Q665 WeakPolarHBondContact O-CG 3.38Å; P661-Q665 PolarHBondContact O-N 3.45Å; P661-Q665 PolarHBondContact O-NE2 3.39Å; P661-N700 WeakPolarHBondContact CD-OD1 3.46Å; P661-N700 WeakPolarHBondContact CG-OD1 3.4Å; P661-P703 HydrophobicContact CB-CG 4.09Å; P661-P703 WeakPolarHBondContact O-CB 3.08Å; P661-F903 HydrophobicContact CB-CD2 4.39Å
662Y94.4Very high91.8Very high18 Ų1829.4 Ų29.47%0.07115%0.145CC..Hα-helixtrans-72.6-44.2179.1-68.8-63.9000112.1H616 F619 F659 L660 F664 Q665 V666 S904 L906H616-Y662 WeakPolarHBondContact CB-OH 3.48Å; H616-Y662 AromaticContact ND1-CE1 3.54Å; H616-Y662 AromaticContact ND1-CZ 3.69Å; H616-Y662 PolarHBondContact ND1-OH 3.47Å; F619-Y662 HydrophobicContact CB-CD1 4.05Å; F619-Y662 HydrophobicContact CB-CG 4.29Å; F619-Y662 HydrophobicContact CD1-CG 4.44Å; F619-Y662 VanDerWaalsContact CD2-CB 3.45Å; F619-Y662 HydrophobicContact CD2-CD1 4.09Å; F619-Y662 AromaticContact CD2-CD2 3.73Å; F619-Y662 HydrophobicContact CD2-CD2 3.73Å; F619-Y662 HydrophobicContact CD2-CE2 4.47Å; F619-Y662 AromaticContact CD2-CG 3.5Å; F619-Y662 HydrophobicContact CD2-CG 3.5Å; F619-Y662 VanDerWaalsContact CD2-CG 3.5Å; F619-Y662 VanDerWaalsContact CE2-CB 3.48Å; F619-Y662 AromaticContact CE2-CD2 3.84Å; F619-Y662 HydrophobicContact CE2-CD2 3.84Å; F619-Y662 AromaticContact CE2-CG 3.83Å; F619-Y662 HydrophobicContact CE2-CG 3.83Å; F619-Y662 HydrophobicContact CG-CD1 4.13Å; F619-Y662 AromaticContact CG-CG 3.84Å; F619-Y662 HydrophobicContact CG-CG 3.84Å; F619-Y662 HydrophobicContact CZ-CG 4.41Å; F659-Y662 PolarHBondContact O-N 3.2Å; L660-Y662 VanDerWaalsContact C-N 3.26Å; L660-Y662 PolarHBondContact O-N 3.3Å; Y662-F664 VanDerWaalsContact C-N 3.3Å; Y662-F664 PolarHBondContact O-N 3.37Å; Y662-Q665 WeakPolarHBondContact O-CB 3.42Å; Y662-Q665 PolarHBondContact O-N 2.95Å; Y662-Q665 VanDerWaalsContact O-N 3.09Å; Y662-V666 WeakPolarHBondContact O-CG2 3.35Å; Y662-V666 PolarHBondContact O-N 3.2Å; Y662-S904 WeakPolarHBondContact OH-CB 3.47Å; Y662-L906 HydrophobicContact CD1-CD1 3.91Å; Y662-L906 HydrophobicContact CD1-CD2 3.62Å; Y662-L906 HydrophobicContact CD1-CG 3.71Å; Y662-L906 HydrophobicContact CE1-CD2 3.62Å; Y662-L906 HydrophobicContact CE1-CG 4.02Å
663V95.4Very high91.9Very high0 Ų029.3 Ų29.30%015%0.145CC..Hα-helixtrans-55.7-47.2176.4170.10000110.3F619 F648 I651 F659 L660 Q665 V666 M667F619-V663 HydrophobicContact CE1-CG2 4.33Å; F619-V663 HydrophobicContact CZ-CG2 4.26Å; F648-V663 HydrophobicContact CB-CG1 3.83Å; F648-V663 HydrophobicContact CD1-CB 4.37Å; F648-V663 HydrophobicContact CD1-CG1 3.95Å; F648-V663 HydrophobicContact CD1-CG2 3.69Å; F648-V663 HydrophobicContact CD2-CG1 4Å; F648-V663 HydrophobicContact CE1-CG1 4.49Å; F648-V663 HydrophobicContact CE1-CG2 4.03Å; F648-V663 HydrophobicContact CG-CG1 3.67Å; F648-V663 HydrophobicContact CG-CG2 4.28Å; I651-V663 HydrophobicContact CB-CG2 4.49Å; I651-V663 HydrophobicContact CD1-CG2 4.03Å; I651-V663 HydrophobicContact CG2-CG2 3.9Å; F659-V663 WeakPolarHBondContact O-CG2 3.48Å; F659-V663 PolarHBondContact O-N 3.31Å; L660-V663 PolarHBondContact O-N 2.96Å; V663-Q665 VanDerWaalsContact C-N 3.31Å; V663-Q665 PolarHBondContact O-N 3.46Å; V663-V666 PolarHBondContact O-N 2.83Å; V663-M667 HydrophobicContact CG1-CG 4.22Å; V663-M667 HydrophobicContact CG1-SD 3.94Å; V663-M667 WeakPolarHBondContact O-CB 3.47Å; V663-M667 VanDerWaalsContact O-CG 3.27Å; V663-M667 WeakPolarHBondContact O-CG 3.31Å; V663-M667 PolarHBondContact O-N 3.36Å
664F94.9Very high91.9Very high0 Ų023.1 Ų23.10%012%0.116CC..Hα-helixtrans-62.3-35.9178.2-61.2-42.1000113L652 L660 Y662 S668 L689 N700 P703 L704 L707L652-F664 HydrophobicContact CD2-CE1 3.78Å; L652-F664 HydrophobicContact CD2-CZ 3.88Å; L660-F664 HydrophobicContact CB-CE2 3.95Å; L660-F664 HydrophobicContact CB-CZ 4.47Å; L660-F664 WeakPolarHBondContact O-CD2 3.42Å; L660-F664 WeakPolarHBondContact O-CG 3.44Å; L660-F664 PolarHBondContact O-N 2.73Å; L660-F664 VanDerWaalsContact O-N 3.08Å; Y662-F664 VanDerWaalsContact C-N 3.3Å; Y662-F664 PolarHBondContact O-N 3.37Å; F664-S668 WeakPolarHBondContact O-CB 3.37Å; F664-S668 PolarHBondContact O-N 3.14Å; F664-S668 PolarHBondContact O-OG 3.1Å; F664-L689 HydrophobicContact CD1-CD2 4.46Å; F664-L689 HydrophobicContact CE1-CD2 3.92Å; F664-N700 HydrophobicContact CE2-CB 4.46Å; F664-P703 HydrophobicContact CB-CB 3.91Å; F664-P703 HydrophobicContact CB-CG 4.39Å; F664-L704 HydrophobicContact CD1-CD2 3.82Å; F664-L704 HydrophobicContact CD2-CD2 3.66Å; F664-L704 HydrophobicContact CD2-CG 3.7Å; F664-L704 HydrophobicContact CE1-CD2 3.77Å; F664-L704 HydrophobicContact CE2-CD1 4.19Å; F664-L704 HydrophobicContact CE2-CD2 3.61Å; F664-L704 HydrophobicContact CE2-CG 3.79Å; F664-L704 HydrophobicContact CG-CD2 3.79Å; F664-L704 HydrophobicContact CG-CG 4.2Å; F664-L704 HydrophobicContact CZ-CD2 3.68Å; F664-L704 HydrophobicContact CZ-CG 4.35Å; F664-L707 HydrophobicContact CB-CD2 4.45Å; F664-L707 HydrophobicContact CD1-CD2 3.9Å
665Q94.8Very high91.3Very high4 Ų422.8 Ų22.82%0.01912%0.122CC..Hα-helixtrans-66.7-43.9174.7-70.1177.581.900112.5P661 Y662 V663 S668 L669 P703 R706 S904 L906 A909P661-Q665 WeakPolarHBondContact O-CG 3.38Å; P661-Q665 PolarHBondContact O-N 3.45Å; P661-Q665 PolarHBondContact O-NE2 3.39Å; Y662-Q665 WeakPolarHBondContact O-CB 3.42Å; Y662-Q665 PolarHBondContact O-N 2.95Å; Y662-Q665 VanDerWaalsContact O-N 3.09Å; V663-Q665 VanDerWaalsContact C-N 3.31Å; V663-Q665 PolarHBondContact O-N 3.46Å; Q665-S668 WeakPolarHBondContact O-CB 3.32Å; Q665-S668 PolarHBondContact O-N 2.77Å; Q665-L669 PolarHBondContact O-N 2.68Å; Q665-P703 HydrophobicContact CG-CB 3.54Å; Q665-R706 PolarHBondContact O-NH1 2.96Å; Q665-S904 PolarHBondContact NE2-O 3.4Å; Q665-L906 HydrophobicContact CB-CD1 3.92Å; Q665-A909 HydrophobicContact CB-CB 4.16Å
666V95.5Very high90.3Very high0 Ų026.6 Ų26.60%014%0.142CC..Hα-helixtrans-67-42.5178.2-177.50000110.8F619 L644 F648 Y662 V663 S668 L669 L670 L906F619-V666 HydrophobicContact CD1-CG2 3.8Å; F619-V666 HydrophobicContact CE1-CG2 4.33Å; L644-V666 HydrophobicContact CD1-CG1 4.23Å; F648-V666 HydrophobicContact CE2-CB 4.28Å; F648-V666 HydrophobicContact CE2-CG1 4.06Å; F648-V666 HydrophobicContact CZ-CB 3.89Å; F648-V666 HydrophobicContact CZ-CG1 3.72Å; F648-V666 HydrophobicContact CZ-CG2 4.47Å; Y662-V666 WeakPolarHBondContact O-CG2 3.35Å; Y662-V666 PolarHBondContact O-N 3.2Å; V663-V666 PolarHBondContact O-N 2.83Å; V666-S668 VanDerWaalsContact C-N 3.3Å; V666-S668 PolarHBondContact O-N 3.19Å; V666-L669 WeakPolarHBondContact O-CB 3.33Å; V666-L669 PolarHBondContact O-N 3.06Å; V666-L670 HydrophobicContact CG1-CD1 4.07Å; V666-L670 HydrophobicContact CG1-CG 4.39Å; V666-L670 WeakPolarHBondContact O-CG 3.28Å; V666-L670 PolarHBondContact O-N 3.4Å; V666-L906 HydrophobicContact CG2-CD1 4.24Å
667M94.9Very high89.7Confident5 Ų529.6 Ų29.63%0.02516%0.164CC..Hα-helixtrans-61.2-39.1175-71.3-170.67100112.1F645 F648 V663 L670 L671 Y682 L685 L707F645-M667 HydrophobicContact CE1-CE 4.42Å; F645-M667 HydrophobicContact CZ-CE 3.98Å; F648-M667 HydrophobicContact CD2-CG 3.85Å; F648-M667 HydrophobicContact CD2-SD 4.35Å; F648-M667 HydrophobicContact CE2-CG 3.97Å; V663-M667 HydrophobicContact CG1-CG 4.22Å; V663-M667 HydrophobicContact CG1-SD 3.94Å; V663-M667 WeakPolarHBondContact O-CB 3.47Å; V663-M667 VanDerWaalsContact O-CG 3.27Å; V663-M667 WeakPolarHBondContact O-CG 3.31Å; V663-M667 PolarHBondContact O-N 3.36Å; M667-L670 PolarHBondContact O-N 3.31Å; M667-L671 WeakPolarHBondContact O-CB 3.49Å; M667-L671 PolarHBondContact O-N 3.39Å; M667-Y682 HydrophobicContact CB-CE1 4.25Å; M667-Y682 HydrophobicContact CE-CD1 3.86Å; M667-Y682 HydrophobicContact CE-CE1 3.67Å; M667-L685 HydrophobicContact CE-CD2 3.34Å; M667-L685 HydrophobicContact SD-CD2 3.94Å; M667-L707 HydrophobicContact CB-CD1 4.02Å; M667-L707 HydrophobicContact CB-CD2 4.4Å
668S94.1Very high89.7Confident0 Ų027 Ų270%015%0.152CC..Hα-helixtrans-60.4-49.2174.4-56.60000110.6F664 Q665 V666 L670 L671 E672 L707F664-S668 WeakPolarHBondContact O-CB 3.37Å; F664-S668 PolarHBondContact O-N 3.14Å; F664-S668 PolarHBondContact O-OG 3.1Å; Q665-S668 WeakPolarHBondContact O-CB 3.32Å; Q665-S668 PolarHBondContact O-N 2.77Å; V666-S668 VanDerWaalsContact C-N 3.3Å; V666-S668 PolarHBondContact O-N 3.19Å; S668-L670 PolarHBondContact O-N 2.92Å; S668-L671 PolarHBondContact O-N 3.18Å; S668-E672 WeakPolarHBondContact O-CB 3.34Å; S668-E672 WeakPolarHBondContact O-CG 3.4Å; S668-E672 PolarHBondContact O-N 3Å; S668-L707 WeakPolarHBondContact OG-CA 3.48Å; S668-L707 WeakPolarHBondContact OG-CB 3.39Å; S668-L707 PolarHBondContact OG-N 3.36Å
669L93.9Very high89.7Confident13 Ų1324.4 Ų24.47%0.06814%0.142CC..Hα-helixtrans-58.4-45.5178.5173.566.1000112.4C623 V626 R627 Q665 V666 I673C623-L669 HydrophobicContact CB-CD2 3.91Å; V626-L669 HydrophobicContact CB-CD2 4.16Å; V626-L669 HydrophobicContact CG1-CD2 3.95Å; V626-L669 HydrophobicContact CG1-CG 4.1Å; R627-L669 HydrophobicContact CG-CD1 3.98Å; R627-L669 HydrophobicContact CG-CD2 4.2Å; Q665-L669 PolarHBondContact O-N 2.68Å; V666-L669 WeakPolarHBondContact O-CB 3.33Å; V666-L669 PolarHBondContact O-N 3.06Å; L669-I673 HydrophobicContact CD1-CD1 4.37Å; L669-I673 HydrophobicContact CG-CD1 4.4Å; L669-I673 WeakPolarHBondContact O-CD1 3.03Å; L669-I673 VanDerWaalsContact O-CG1 3.32Å; L669-I673 WeakPolarHBondContact O-CG1 3.32Å; L669-I673 PolarHBondContact O-N 3.29Å
670L93.6Very high89.5Confident0 Ų028.4 Ų28.40%018%0.175CC..Hα-helixtrans-63.7-46.7178.7-70.7168.8000111.1V626 V637 F640 E641 L644 F645 V666 M667 S668 E672 I673 H674 Y682V626-L670 HydrophobicContact CG1-CD2 3.76Å; V626-L670 HydrophobicContact CG2-CD2 3.88Å; V637-L670 HydrophobicContact CG2-CB 4.26Å; V637-L670 HydrophobicContact CG2-CD2 3.8Å; V637-L670 WeakPolarHBondContact CG2-O 3.37Å; F640-L670 HydrophobicContact CB-CD2 3.85Å; E641-L670 HydrophobicContact CG-CD1 4.17Å; L644-L670 HydrophobicContact CD1-CD1 4.33Å; F645-L670 HydrophobicContact CE1-CD1 4.42Å; V666-L670 HydrophobicContact CG1-CD1 4.07Å; V666-L670 HydrophobicContact CG1-CG 4.39Å; V666-L670 WeakPolarHBondContact O-CG 3.28Å; V666-L670 PolarHBondContact O-N 3.4Å; M667-L670 PolarHBondContact O-N 3.31Å; S668-L670 PolarHBondContact O-N 2.92Å; L670-E672 PolarHBondContact O-N 3.15Å; L670-I673 PolarHBondContact O-N 2.96Å; L670-H674 PolarHBondContact O-CD2 3.02Å; L670-Y682 WeakPolarHBondContact CB-OH 3.28Å
671L92.7Very high89.3Confident0 Ų031.1 Ų31.10%019%0.194CC..Hα-helixtrans-63.9-39.6178.9-173.357.5000112.5M667 S668 I673 H674 I678 Y682 L707 A710 F711 K714M667-L671 WeakPolarHBondContact O-CB 3.49Å; M667-L671 PolarHBondContact O-N 3.39Å; S668-L671 PolarHBondContact O-N 3.18Å; L671-I673 PolarHBondContact O-N 3.43Å; L671-H674 PolarHBondContact O-N 3.35Å; L671-H674 VanDerWaalsContact O-N 3.16Å; L671-I678 HydrophobicContact CD1-CG2 4.31Å; L671-Y682 HydrophobicContact CB-CD1 4.4Å; L671-Y682 HydrophobicContact CB-CE1 3.87Å; L671-Y682 HydrophobicContact CD1-CD1 4.33Å; L671-Y682 HydrophobicContact CD1-CD2 4.49Å; L671-Y682 HydrophobicContact CD1-CE1 4.46Å; L671-Y682 HydrophobicContact CD1-CG 4.33Å; L671-Y682 HydrophobicContact CD2-CD1 4.07Å; L671-Y682 HydrophobicContact CD2-CE1 4.35Å; L671-Y682 HydrophobicContact CG-CE1 4.46Å; L671-L707 HydrophobicContact CD2-CD1 4.48Å; L671-A710 HydrophobicContact CB-CB 4.36Å; L671-A710 HydrophobicContact CD2-CB 4.01Å; L671-A710 HydrophobicContact CG-CB 4.25Å; L671-F711 HydrophobicContact CD2-CB 4.45Å; L671-F711 HydrophobicContact CD2-CD1 4.23Å; L671-F711 HydrophobicContact CD2-CD2 3.8Å; L671-F711 HydrophobicContact CD2-CE1 4.47Å; L671-F711 HydrophobicContact CD2-CE2 4.05Å; L671-F711 HydrophobicContact CD2-CG 3.89Å; L671-F711 HydrophobicContact CD2-CZ 4.38Å; L671-K714 HydrophobicContact CG-CG 4.37Å
672E91Very high89.2Confident32 Ų3230.9 Ų30.915%0.1519%0.193CC..Hα-helixtrans-60.6-26177.5-76165.1-167.200113.1S668 L670 R706 A710 K714S668-E672 WeakPolarHBondContact O-CB 3.34Å; S668-E672 WeakPolarHBondContact O-CG 3.4Å; S668-E672 PolarHBondContact O-N 3Å; L670-E672 PolarHBondContact O-N 3.15Å; E672-R706 VanDerWaalsContact CD-NH2 3.33Å; E672-R706 IonicContact OE1-CZ 3.25Å; E672-R706 IonicContact OE1-NE 2.82Å; E672-R706 PolarHBondContact OE1-NE 3.23Å; E672-R706 IonicContact OE1-NH2 2.78Å; E672-R706 PolarHBondContact OE1-NH2 2.9Å; E672-R706 VanDerWaalsContact OE1-NH2 3.11Å; E672-R706 IonicContact OE2-CZ 3.91Å; E672-R706 IonicContact OE2-NE 2.73Å; E672-R706 IonicContact OE2-NH2 3.5Å; E672-R706 PolarHBondContact OE2-NH2 3.25Å; E672-A710 HydrophobicContact CG-CB 3.88Å; E672-K714 WeakPolarHBondContact O-CE 3.46Å; E672-K714 PolarHBondContact O-NZ 3.26Å
673I90.3Very high88.9Confident42 Ų4232 Ų3222%0.21520%0.199CC..Hα-helixtrans-77.6-27.7178.9-67.9162.4000112.1V626 C630 P634 V637 L669 L670 L671V626-I673 HydrophobicContact CG1-CD1 3.48Å; V626-I673 VanDerWaalsContact CG1-CD1 3.48Å; C630-I673 HydrophobicContact CB-CD1 3.87Å; C630-I673 HydrophobicContact CB-CG2 3.93Å; P634-I673 HydrophobicContact CB-CG2 4.48Å; V637-I673 HydrophobicContact CB-CG2 3.97Å; V637-I673 HydrophobicContact CG1-CG2 4.41Å; V637-I673 HydrophobicContact CG2-CB 4.18Å; V637-I673 HydrophobicContact CG2-CG2 4.14Å; L669-I673 HydrophobicContact CD1-CD1 4.37Å; L669-I673 HydrophobicContact CG-CD1 4.4Å; L669-I673 WeakPolarHBondContact O-CD1 3.03Å; L669-I673 VanDerWaalsContact O-CG1 3.32Å; L669-I673 WeakPolarHBondContact O-CG1 3.32Å; L669-I673 PolarHBondContact O-N 3.29Å; L670-I673 PolarHBondContact O-N 2.96Å; L671-I673 PolarHBondContact O-N 3.43Å
674H87.6Confident88.6Confident25 Ų2535.1 Ų35.112%0.11623%0.225CC..SBendtrans-62.4144.9177.7-78.8-81.9000111.7E641 L670 L671 K714E641-H674 VanDerWaalsContact CD-NE2 3.34Å; E641-H674 IonicContact OE1-CD2 2.93Å; E641-H674 IonicContact OE1-CE1 3.27Å; E641-H674 IonicContact OE1-NE2 3.59Å; E641-H674 PolarHBondContact OE1-NE2 3.4Å; E641-H674 IonicContact OE2-CE1 3.35Å; E641-H674 IonicContact OE2-NE2 2.72Å; E641-H674 PolarHBondContact OE2-NE2 2.81Å; L670-H674 PolarHBondContact O-CD2 3.02Å; L671-H674 PolarHBondContact O-N 3.35Å; L671-H674 VanDerWaalsContact O-N 3.16Å; H674-K714 WeakPolarHBondContact O-CD 3.33Å; H674-K714 WeakPolarHBondContact O-CE 3.34Å; H674-K714 PolarHBondContact O-NZ 3.5Å
675S74.8Confident88.3Confident98 Ų9836.7 Ų36.769%0.68523%0.234SC*.SBendtrans-80.2-49.2-170.249.90000113.7
676N65.1Low88.2Confident145 Ų14536.6 Ų36.678%0.77523%0.233SC*.SBendtrans-154.52.7-176.9-73.3-50000116.8
677S77.9Confident87.9Confident81 Ų8139 Ų3957%0.56625%0.248SC*.  trans-132.9132.618060.70000110.9P679S677-P679 WeakPolarHBondContact O-CD 3.44Å
678I86.2Confident87.6Confident18 Ų1843.5 Ų43.59%0.09227%0.269CS..  trans-71.5123.7170.2-56.2165.3000107.8L671 M683 F711 K714 I719L671-I678 HydrophobicContact CD1-CG2 4.31Å; I678-M683 HydrophobicContact CB-CG 4.06Å; I678-M683 HydrophobicContact CB-SD 4.11Å; I678-M683 HydrophobicContact CD1-SD 3.71Å; I678-M683 HydrophobicContact CG2-CG 3.69Å; I678-M683 HydrophobicContact CG2-SD 3.84Å; I678-F711 HydrophobicContact CD1-CD1 4.01Å; I678-F711 HydrophobicContact CG2-CD1 4.1Å; I678-F711 HydrophobicContact CG2-CE1 3.89Å; I678-K714 HydrophobicContact CG1-CB 4.26Å; I678-I719 HydrophobicContact CD1-CD1 3.95Å; I678-I719 HydrophobicContact CD1-CG1 4.02Å
679P89.3Confident87.5Confident25 Ų2543.6 Ų43.616%0.16227%0.27CS..  trans-61.6150.2175.4-18.930000111.9S677 S681 Y682 M683S677-P679 WeakPolarHBondContact O-CD 3.44Å; P679-S681 PolarHBondContact O-N 3.26Å; P679-S681 VanDerWaalsContact O-N 3.17Å; P679-Y682 HydrophobicContact CB-CD2 3.93Å; P679-Y682 HydrophobicContact CB-CE2 4.48Å; P679-Y682 HydrophobicContact CG-CD2 3.78Å; P679-Y682 HydrophobicContact CG-CE2 4.03Å; P679-Y682 PolarHBondContact O-N 2.94Å; P679-M683 PolarHBondContact O-N 3.16Å
680A87.7Confident87.4Confident85 Ų8543.9 Ų43.970%0.70227%0.271SS*.Hα-helixtrans-58.3-33.6-175.800000113.3M683 A684A680-M683 PolarHBondContact O-N 2.91Å; A680-A684 PolarHBondContact O-N 3Å
681S87.4Confident87.2Confident58 Ų5848.3 Ų48.341%0.40629%0.292SS..Hα-helixtrans-62.1-39.9176.351.30000112.8F645 P679 L685F645-S681 WeakPolarHBondContact CE2-OG 3.39Å; P679-S681 PolarHBondContact O-N 3.26Å; P679-S681 VanDerWaalsContact O-N 3.17Å; S681-L685 PolarHBondContact O-N 2.98Å
682Y90.7Very high86.8Confident0 Ų052.5 Ų52.50%032%0.319CS..Hα-helixtrans-69.9-41.9174.1-75.8-95.2000111.7E641 F645 M667 L670 L671 P679 A684 L685 F686 F711E641-Y682 WeakPolarHBondContact OE1-CE2 3.33Å; E641-Y682 PolarHBondContact OE1-OH 3.43Å; E641-Y682 VanDerWaalsContact OE1-OH 3.05Å; F645-Y682 HydrophobicContact CE1-CE2 4.2Å; F645-Y682 AromaticContact CE1-CZ 3.99Å; F645-Y682 HydrophobicContact CE2-CD2 4.14Å; F645-Y682 AromaticContact CE2-CE2 3.97Å; F645-Y682 HydrophobicContact CE2-CE2 3.97Å; F645-Y682 HydrophobicContact CZ-CD1 4.44Å; F645-Y682 AromaticContact CZ-CD2 3.87Å; F645-Y682 HydrophobicContact CZ-CD2 3.87Å; F645-Y682 AromaticContact CZ-CE1 3.94Å; F645-Y682 HydrophobicContact CZ-CE1 3.94Å; F645-Y682 AromaticContact CZ-CE2 3.31Å; F645-Y682 HydrophobicContact CZ-CE2 3.31Å; F645-Y682 HydrophobicContact CZ-CG 4.41Å; F645-Y682 AromaticContact CZ-CZ 3.37Å; M667-Y682 HydrophobicContact CB-CE1 4.25Å; M667-Y682 HydrophobicContact CE-CD1 3.86Å; M667-Y682 HydrophobicContact CE-CE1 3.67Å; L670-Y682 WeakPolarHBondContact CB-OH 3.28Å; L671-Y682 HydrophobicContact CB-CD1 4.4Å; L671-Y682 HydrophobicContact CB-CE1 3.87Å; L671-Y682 HydrophobicContact CD1-CD1 4.33Å; L671-Y682 HydrophobicContact CD1-CD2 4.49Å; L671-Y682 HydrophobicContact CD1-CE1 4.46Å; L671-Y682 HydrophobicContact CD1-CG 4.33Å; L671-Y682 HydrophobicContact CD2-CD1 4.07Å; L671-Y682 HydrophobicContact CD2-CE1 4.35Å; L671-Y682 HydrophobicContact CG-CE1 4.46Å; P679-Y682 HydrophobicContact CB-CD2 3.93Å; P679-Y682 HydrophobicContact CB-CE2 4.48Å; P679-Y682 HydrophobicContact CG-CD2 3.78Å; P679-Y682 HydrophobicContact CG-CE2 4.03Å; P679-Y682 PolarHBondContact O-N 2.94Å; Y682-A684 PolarHBondContact O-N 3.41Å; Y682-L685 WeakPolarHBondContact O-CB 3.46Å; Y682-L685 PolarHBondContact O-N 2.84Å; Y682-F686 PolarHBondContact O-N 3.48Å; Y682-F711 HydrophobicContact CD1-CE2 4.3Å; Y682-F711 AromaticContact CD1-CZ 3.9Å; Y682-F711 HydrophobicContact CD1-CZ 3.9Å; Y682-F711 HydrophobicContact CG-CZ 4.28Å; Y682-F711 WeakPolarHBondContact O-CE1 3.39Å; Y682-F711 WeakPolarHBondContact O-CZ 2.87Å
683M89.9Confident86.5Confident40 Ų4054.4 Ų54.420%0.19733%0.333CS..Hα-helixtrans-61.8-33.3177.3-75.2-57.6-64.600112.4I678 P679 A680 L685 F686 P687 I719 A723I678-M683 HydrophobicContact CB-CG 4.06Å; I678-M683 HydrophobicContact CB-SD 4.11Å; I678-M683 HydrophobicContact CD1-SD 3.71Å; I678-M683 HydrophobicContact CG2-CG 3.69Å; I678-M683 HydrophobicContact CG2-SD 3.84Å; P679-M683 PolarHBondContact O-N 3.16Å; A680-M683 PolarHBondContact O-N 2.91Å; M683-L685 VanDerWaalsContact C-N 3.3Å; M683-L685 PolarHBondContact O-N 3.22Å; M683-F686 PolarHBondContact O-N 3.15Å; M683-P687 WeakPolarHBondContact O-CD 3.37Å; M683-I719 HydrophobicContact CE-CG1 4.35Å; M683-I719 HydrophobicContact SD-CG1 4.32Å; M683-A723 HydrophobicContact CE-CB 4.35Å
684A88.7Confident86.3Confident67 Ų6753.7 Ų53.755%0.55433%0.33SS*.Hα-helixtrans-66.1-31.7172.600000112.9A680 Y682 H688A680-A684 PolarHBondContact O-N 3Å; Y682-A684 PolarHBondContact O-N 3.41Å; A684-H688 PolarHBondContact O-CE1 3.47Å; A684-H688 PolarHBondContact O-ND1 3.31Å
685L88.9Confident86.3Confident33 Ų3352.9 Ų52.917%0.17333%0.325CS..Hα-helixtrans-77.8-30.8177.6-172.466000112.6L652 M667 S681 Y682 M683 H688 L689L652-L685 HydrophobicContact CD1-CD1 4.32Å; M667-L685 HydrophobicContact CE-CD2 3.34Å; M667-L685 HydrophobicContact SD-CD2 3.94Å; S681-L685 PolarHBondContact O-N 2.98Å; Y682-L685 WeakPolarHBondContact O-CB 3.46Å; Y682-L685 PolarHBondContact O-N 2.84Å; M683-L685 VanDerWaalsContact C-N 3.3Å; M683-L685 PolarHBondContact O-N 3.22Å; L685-H688 HydrophobicContact CD1-CB 4.35Å; L685-H688 WeakPolarHBondContact O-CB 3.39Å; L685-H688 PolarHBondContact O-N 3.4Å; L685-L689 HydrophobicContact CD2-CD1 4.36Å; L685-L689 HydrophobicContact CD2-CD2 4.12Å; L685-L689 HydrophobicContact CD2-CG 4.41Å; L685-L689 HydrophobicContact CG-CD1 4.32Å; L685-L689 HydrophobicContact CG-CD2 4.08Å; L685-L689 HydrophobicContact CG-CG 4.04Å; L685-L689 PolarHBondContact O-N 2.94Å
686F91Very high86.8Confident2 Ų254.3 Ų54.31%0.00932%0.321CS..Hα-helixtrans-48.1-46.8-171.7-175.4-106.6000115Y682 M683 H688 L689 L690 L708 F711 I719 K726Y682-F686 PolarHBondContact O-N 3.48Å; M683-F686 PolarHBondContact O-N 3.15Å; F686-H688 VanDerWaalsContact C-N 3.26Å; F686-H688 PolarHBondContact O-N 3.43Å; F686-L689 PolarHBondContact O-N 3.43Å; F686-L690 HydrophobicContact CE1-CD1 4.06Å; F686-L690 HydrophobicContact CZ-CD1 4.34Å; F686-L708 HydrophobicContact CD2-CD2 4.34Å; F686-L708 HydrophobicContact CE2-CD2 3.88Å; F686-F711 HydrophobicContact CB-CE1 4Å; F686-F711 HydrophobicContact CB-CZ 4.38Å; F686-F711 HydrophobicContact CD2-CB 4.39Å; F686-F711 AromaticContact CD2-CD1 3.7Å; F686-F711 HydrophobicContact CD2-CD1 3.7Å; F686-F711 HydrophobicContact CD2-CD2 4.31Å; F686-F711 AromaticContact CD2-CE1 3.95Å; F686-F711 HydrophobicContact CD2-CE1 3.95Å; F686-F711 AromaticContact CD2-CG 3.9Å; F686-F711 HydrophobicContact CD2-CG 3.9Å; F686-F711 HydrophobicContact CD2-CZ 4.38Å; F686-F711 HydrophobicContact CE2-CB 4.25Å; F686-F711 HydrophobicContact CE2-CD1 4.33Å; F686-F711 HydrophobicContact CE2-CG 4.25Å; F686-F711 HydrophobicContact CG-CD1 4.42Å; F686-F711 HydrophobicContact CG-CE1 4.38Å; F686-I719 HydrophobicContact CE1-CG2 4.04Å; F686-I719 HydrophobicContact CE2-CD1 4.25Å; F686-I719 HydrophobicContact CZ-CD1 4.24Å; F686-I719 HydrophobicContact CZ-CG2 4.12Å; F686-K726 HydrophobicContact CD1-CB 4.47Å; F686-K726 HydrophobicContact CE1-CB 3.99Å
687P90.2Very high87.6Confident49 Ų4949.9 Ų49.932%0.31829%0.294SS..Hα-helixtrans-62-31.1178-23.435.2000114.2M683 L690M683-P687 WeakPolarHBondContact O-CD 3.37Å; P687-L690 PolarHBondContact O-N 3.19Å
688H88.6Confident87.9Confident100 Ų10049.4 Ų49.446%0.46329%0.288SS..Hα-helixtrans-72.4-34.8-179.4-57.188.1000111.2A684 L685 F686 L690 Q691 L694A684-H688 PolarHBondContact O-CE1 3.47Å; A684-H688 PolarHBondContact O-ND1 3.31Å; L685-H688 HydrophobicContact CD1-CB 4.35Å; L685-H688 WeakPolarHBondContact O-CB 3.39Å; L685-H688 PolarHBondContact O-N 3.4Å; F686-H688 VanDerWaalsContact C-N 3.26Å; F686-H688 PolarHBondContact O-N 3.43Å; H688-L690 PolarHBondContact O-N 3.14Å; H688-Q691 WeakPolarHBondContact O-CB 3.45Å; H688-Q691 WeakPolarHBondContact O-CG 3.48Å; H688-Q691 PolarHBondContact O-N 3Å; H688-Q691 VanDerWaalsContact O-N 3.15Å; H688-L694 WeakPolarHBondContact O-CD1 2.87Å
689L91.3Very high87.8Confident2 Ų248.7 Ų48.71%0.0129%0.285CS..Hα-helixtrans-64.6-20.6177.4-58.6178000113.1F664 L685 F686 W695 L704 L707 L708 F711F664-L689 HydrophobicContact CD1-CD2 4.46Å; F664-L689 HydrophobicContact CE1-CD2 3.92Å; L685-L689 HydrophobicContact CD2-CD1 4.36Å; L685-L689 HydrophobicContact CD2-CD2 4.12Å; L685-L689 HydrophobicContact CD2-CG 4.41Å; L685-L689 HydrophobicContact CG-CD1 4.32Å; L685-L689 HydrophobicContact CG-CD2 4.08Å; L685-L689 HydrophobicContact CG-CG 4.04Å; L685-L689 PolarHBondContact O-N 2.94Å; F686-L689 PolarHBondContact O-N 3.43Å; L689-W695 PolarHBondContact O-NE1 3.36Å; L689-L704 HydrophobicContact CD2-CD2 3.97Å; L689-L707 HydrophobicContact CD1-CD2 3.69Å; L689-L707 HydrophobicContact CD1-CG 4.15Å; L689-L707 HydrophobicContact CD2-CD2 4.2Å; L689-L708 HydrophobicContact CB-CD2 4.41Å; L689-F711 HydrophobicContact CD1-CD2 4.35Å; L689-F711 HydrophobicContact CD1-CE2 3.61Å; L689-F711 HydrophobicContact CD1-CZ 4.16Å
690L92.3Very high87.8Confident20 Ų2047.6 Ų47.611%0.10528%0.277CS..THydrogen-bonded Turntrans-87.6-3179.4-55-179.4000113.1F686 P687 H688 L708 K726 L730 V733F686-L690 HydrophobicContact CE1-CD1 4.06Å; F686-L690 HydrophobicContact CZ-CD1 4.34Å; P687-L690 PolarHBondContact O-N 3.19Å; H688-L690 PolarHBondContact O-N 3.14Å; L690-L708 HydrophobicContact CD2-CD1 4.4Å; L690-L708 HydrophobicContact CD2-CD2 4.12Å; L690-K726 HydrophobicContact CD1-CB 4.04Å; L690-L730 HydrophobicContact CD2-CB 4.39Å; L690-L730 HydrophobicContact CD2-CD1 4.02Å; L690-V733 HydrophobicContact CD2-CG2 4.23Å
691Q88.8Confident88.1Confident92 Ų9243.9 Ų43.943%0.4325%0.246SC..  trans-71.2131.5-178.4-68.9-176.4-10.400111.6H688 V693 L694 W695H688-Q691 WeakPolarHBondContact O-CB 3.45Å; H688-Q691 WeakPolarHBondContact O-CG 3.48Å; H688-Q691 PolarHBondContact O-N 3Å; H688-Q691 VanDerWaalsContact O-N 3.15Å; Q691-V693 HydrophobicContact CB-CG1 4.28Å; Q691-V693 PolarHBondContact O-N 3.03Å; Q691-L694 PolarHBondContact O-N 3.22Å; Q691-W695 VanDerWaalsContact O-CD1 3.29Å
692P85.3Confident88.3Confident89 Ų8942.6 Ų42.658%0.57824%0.236SC*.G310 helixtrans-54.5-31.8-173.8-29.835.4000115.9L694 W695 E696 K736P692-L694 VanDerWaalsContact C-N 3.31Å; P692-L694 PolarHBondContact O-N 2.83Å; P692-W695 WeakPolarHBondContact O-CB 3.48Å; P692-W695 PolarHBondContact O-N 3.14Å; P692-W695 VanDerWaalsContact O-N 3.08Å; P692-E696 PolarHBondContact O-N 3.48Å; P692-K736 PolarHBondContact O-NZ 2.98Å
693V84.7Confident88.4Confident72 Ų7242.7 Ų42.744%0.43624%0.237SC..G310 helixtrans-59.5-36.8-177.3680000112.8Q691 W695 E696Q691-V693 HydrophobicContact CB-CG1 4.28Å; Q691-V693 PolarHBondContact O-N 3.03Å; V693-W695 PolarHBondContact O-N 3.32Å; V693-E696 PolarHBondContact O-N 3.12Å
694L85.2Confident88.6Confident27 Ų2740.8 Ų40.814%0.14123%0.227CC..G310 helixtrans-67.8-24.3179.1-69.7177.6000112.5H688 Q691 P692 N700 L704H688-L694 WeakPolarHBondContact O-CD1 2.87Å; Q691-L694 PolarHBondContact O-N 3.22Å; P692-L694 VanDerWaalsContact C-N 3.31Å; P692-L694 PolarHBondContact O-N 2.83Å; L694-N700 WeakPolarHBondContact O-CB 3.45Å; L694-N700 PolarHBondContact O-ND2 2.83Å; L694-L704 HydrophobicContact CB-CD1 3.94Å
695W88.9Confident88.9Confident7 Ų737.6 Ų37.63%0.02720%0.201CC..G310 helixtrans-96.52.6-176.7-59.288.7000113.3L689 Q691 P692 V693 I701 L704 V705 L708 V733 K736 L737L689-W695 PolarHBondContact O-NE1 3.36Å; Q691-W695 VanDerWaalsContact O-CD1 3.29Å; P692-W695 WeakPolarHBondContact O-CB 3.48Å; P692-W695 PolarHBondContact O-N 3.14Å; P692-W695 VanDerWaalsContact O-N 3.08Å; V693-W695 PolarHBondContact O-N 3.32Å; W695-I701 HydrophobicContact CE3-CG1 4.35Å; W695-I701 HydrophobicContact CZ3-CG2 4.48Å; W695-L704 HydrophobicContact CD2-CD1 4.29Å; W695-L704 HydrophobicContact CH2-CB 3.5Å; W695-L704 VanDerWaalsContact CH2-CB 3.5Å; W695-L704 HydrophobicContact CH2-CD1 4.47Å; W695-L704 HydrophobicContact CZ2-CB 3.79Å; W695-L704 HydrophobicContact CZ2-CD1 4.19Å; W695-L704 HydrophobicContact CZ2-CG 4.49Å; W695-L704 HydrophobicContact CZ3-CB 3.96Å; W695-V705 HydrophobicContact CH2-CG2 3.9Å; W695-V705 HydrophobicContact CZ3-CG2 3.63Å; W695-L708 HydrophobicContact CH2-CD1 3.73Å; W695-L708 HydrophobicContact CZ2-CD1 3.55Å; W695-L708 HydrophobicContact CZ2-CG 4.43Å; W695-V733 HydrophobicContact CD2-CG1 3.77Å; W695-V733 HydrophobicContact CD2-CG2 4.36Å; W695-V733 HydrophobicContact CE3-CG1 3.83Å; W695-V733 HydrophobicContact CH2-CG1 3.48Å; W695-V733 VanDerWaalsContact CH2-CG1 3.48Å; W695-V733 HydrophobicContact CZ2-CB 4.42Å; W695-V733 HydrophobicContact CZ2-CG1 3.43Å; W695-V733 VanDerWaalsContact CZ2-CG1 3.43Å; W695-V733 HydrophobicContact CZ2-CG2 4.09Å; W695-V733 HydrophobicContact CZ3-CG1 3.69Å; W695-K736 VanDerWaalsContact C-NZ 3.34Å; W695-K736 HydrophobicContact CB-CD 3.9Å; W695-K736 WeakPolarHBondContact O-CE 3.44Å; W695-K736 PolarHBondContact O-NZ 3Å; W695-L737 HydrophobicContact CE3-CD1 4.38Å; W695-L737 HydrophobicContact CE3-CD2 3.94Å; W695-L737 HydrophobicContact CE3-CG 4.38Å; W695-L737 HydrophobicContact CZ3-CD1 3.9Å; W695-L737 HydrophobicContact CZ3-CD2 4.13Å; W695-L737 HydrophobicContact CZ3-CG 4.39Å
696E84.8Confident89.1Confident129 Ų12937 Ų3760%0.60320%0.197SC*.SBendtrans-80.8-23.9170.9-67.1178.6178.100111.7P692 V693 K736P692-E696 PolarHBondContact O-N 3.48Å; V693-E696 PolarHBondContact O-N 3.12Å; E696-K736 VanDerWaalsContact CG-NZ 3.3Å
697R82.8Confident89.3Confident51 Ų5137 Ų3719%0.19220%0.196CC..  trans-90113.4-179.5-59.2-178.6-172.1161.73.5109.9D655 G699 N700D655-R697 VanDerWaalsContact CG-NH2 3.33Å; D655-R697 IonicContact OD1-CZ 3.83Å; D655-R697 IonicContact OD1-NH1 2.73Å; D655-R697 PolarHBondContact OD1-NH1 2.72Å; D655-R697 IonicContact OD1-NH2 3.57Å; D655-R697 PolarHBondContact OD1-NH2 2.94Å; D655-R697 VanDerWaalsContact OD1-NH2 3.12Å; D655-R697 IonicContact OD2-CZ 2.93Å; D655-R697 IonicContact OD2-NH1 2.76Å; D655-R697 IonicContact OD2-NH2 3.98Å; D655-R697 PolarHBondContact OD2-NH2 3.44Å; R697-G699 VanDerWaalsContact C-N 3.27Å; R697-G699 PolarHBondContact O-N 3.14Å; R697-N700 HydrophobicContact CB-CB 4.34Å; R697-N700 PolarHBondContact O-N 2.89Å
698T82.6Confident89.6Confident72 Ų7234.7 Ų34.744%0.44218%0.181SC..G310 helixtrans-53.9-42.4-179.552.60000112.3N700 I701 Q900T698-N700 PolarHBondContact O-N 3.01Å; T698-I701 PolarHBondContact O-N 2.86Å; T698-I701 VanDerWaalsContact O-N 3.14Å; T698-Q900 PolarHBondContact OG1-OE1 2.98Å; T698-Q900 VanDerWaalsContact OG1-OE1 3.07Å
699G84.8Confident89.8Confident3 Ų330.5 Ų30.53%0.03116%0.162CC..G310 helixtrans-58.7-27.2178.200000115.1R697R697-G699 VanDerWaalsContact C-N 3.27Å; R697-G699 PolarHBondContact O-N 3.14Å
700N90.4Very high89.9Confident2 Ų230.4 Ų30.41%0.01116%0.162CC..G310 helixtrans-85.9-20-179.6-72.9-13.3000113.4P661 F664 L694 R697 T698 P703 L704P661-N700 WeakPolarHBondContact CD-OD1 3.46Å; P661-N700 WeakPolarHBondContact CG-OD1 3.4Å; F664-N700 HydrophobicContact CE2-CB 4.46Å; L694-N700 WeakPolarHBondContact O-CB 3.45Å; L694-N700 PolarHBondContact O-ND2 2.83Å; R697-N700 HydrophobicContact CB-CB 4.34Å; R697-N700 PolarHBondContact O-N 2.89Å; T698-N700 PolarHBondContact O-N 3.01Å; N700-P703 WeakPolarHBondContact O-CD 3.23Å; N700-P703 WeakPolarHBondContact O-CG 3.4Å; N700-L704 HydrophobicContact CB-CD1 3.82Å; N700-L704 HydrophobicContact CB-CG 4.4Å; N700-L704 VanDerWaalsContact O-CB 3.24Å; N700-L704 WeakPolarHBondContact O-CB 3.48Å; N700-L704 VanDerWaalsContact O-CG 3.24Å; N700-L704 WeakPolarHBondContact O-CG 3.47Å; N700-L704 PolarHBondContact O-N 3.27Å
701I92.4Very high90Very high6 Ų629.5 Ų29.53%0.03116%0.157CC..Hα-helixtrans-62.1-56.6-168.9-67.6173.7000112W695 T698 L704 V705 L737 N743 Q746W695-I701 HydrophobicContact CE3-CG1 4.35Å; W695-I701 HydrophobicContact CZ3-CG2 4.48Å; T698-I701 PolarHBondContact O-N 2.86Å; T698-I701 VanDerWaalsContact O-N 3.14Å; I701-L704 PolarHBondContact O-N 3.07Å; I701-V705 HydrophobicContact CG2-CG2 4.46Å; I701-V705 WeakPolarHBondContact O-CG2 3.46Å; I701-V705 PolarHBondContact O-N 3.2Å; I701-L737 HydrophobicContact CD1-CD2 4.36Å; I701-L737 HydrophobicContact CG1-CD2 4.47Å; I701-L737 HydrophobicContact CG2-CD2 3.54Å; I701-N743 HydrophobicContact CD1-CB 4.44Å; I701-N743 HydrophobicContact CG2-CB 4.45Å; I701-Q746 HydrophobicContact CG2-CB 4.13Å; I701-Q746 HydrophobicContact CG2-CG 4Å
702P91.9Very high90.2Very high31 Ų3125.1 Ų25.120%0.20114%0.136CC..Hα-helixtrans-57.1-46.9-178.4-21.732.1000114.4V705 R706 F903P702-V705 PolarHBondContact O-N 3.35Å; P702-R706 PolarHBondContact O-N 2.77Å; P702-R706 VanDerWaalsContact O-N 3.11Å; P702-F903 HydrophobicContact CB-CD1 4.27Å; P702-F903 HydrophobicContact CB-CD2 4.45Å; P702-F903 HydrophobicContact CB-CE1 4.03Å; P702-F903 HydrophobicContact CB-CE2 4.24Å; P702-F903 HydrophobicContact CB-CG 4.47Å; P702-F903 HydrophobicContact CB-CZ 4.01Å; P702-F903 HydrophobicContact CG-CD1 4.03Å; P702-F903 HydrophobicContact CG-CD2 4.46Å; P702-F903 HydrophobicContact CG-CE1 4.28Å; P702-F903 HydrophobicContact CG-CG 4.12Å
703P92.9Very high90.5Very high3 Ų325.6 Ų25.62%0.01913%0.131CC..Hα-helixtrans-75.1-28.4-177.931.9-37.7000113.3P661 F664 Q665 N700 L707 F903P661-P703 HydrophobicContact CB-CG 4.09Å; P661-P703 WeakPolarHBondContact O-CB 3.08Å; F664-P703 HydrophobicContact CB-CB 3.91Å; F664-P703 HydrophobicContact CB-CG 4.39Å; Q665-P703 HydrophobicContact CG-CB 3.54Å; N700-P703 WeakPolarHBondContact O-CD 3.23Å; N700-P703 WeakPolarHBondContact O-CG 3.4Å; P703-L707 WeakPolarHBondContact O-CB 3.29Å; P703-L707 PolarHBondContact O-N 3.18Å; P703-F903 HydrophobicContact CB-CE2 4.16Å; P703-F903 HydrophobicContact CG-CD2 4.09Å; P703-F903 HydrophobicContact CG-CE2 3.92Å
704L94.9Very high90.7Very high0 Ų023.7 Ų23.70%012%0.117CC..Hα-helixtrans-67.7-42.8171.1-78.9173000112.1F664 L689 L694 W695 N700 I701 R706 L707 L708F664-L704 HydrophobicContact CD1-CD2 3.82Å; F664-L704 HydrophobicContact CD2-CD2 3.66Å; F664-L704 HydrophobicContact CD2-CG 3.7Å; F664-L704 HydrophobicContact CE1-CD2 3.77Å; F664-L704 HydrophobicContact CE2-CD1 4.19Å; F664-L704 HydrophobicContact CE2-CD2 3.61Å; F664-L704 HydrophobicContact CE2-CG 3.79Å; F664-L704 HydrophobicContact CG-CD2 3.79Å; F664-L704 HydrophobicContact CG-CG 4.2Å; F664-L704 HydrophobicContact CZ-CD2 3.68Å; F664-L704 HydrophobicContact CZ-CG 4.35Å; L689-L704 HydrophobicContact CD2-CD2 3.97Å; L694-L704 HydrophobicContact CB-CD1 3.94Å; W695-L704 HydrophobicContact CD2-CD1 4.29Å; W695-L704 HydrophobicContact CH2-CB 3.5Å; W695-L704 VanDerWaalsContact CH2-CB 3.5Å; W695-L704 HydrophobicContact CH2-CD1 4.47Å; W695-L704 HydrophobicContact CZ2-CB 3.79Å; W695-L704 HydrophobicContact CZ2-CD1 4.19Å; W695-L704 HydrophobicContact CZ2-CG 4.49Å; W695-L704 HydrophobicContact CZ3-CB 3.96Å; N700-L704 HydrophobicContact CB-CD1 3.82Å; N700-L704 HydrophobicContact CB-CG 4.4Å; N700-L704 VanDerWaalsContact O-CB 3.24Å; N700-L704 WeakPolarHBondContact O-CB 3.48Å; N700-L704 VanDerWaalsContact O-CG 3.24Å; N700-L704 WeakPolarHBondContact O-CG 3.47Å; N700-L704 PolarHBondContact O-N 3.27Å; I701-L704 PolarHBondContact O-N 3.07Å; L704-R706 VanDerWaalsContact C-N 3.31Å; L704-R706 PolarHBondContact O-N 3.1Å; L704-L707 PolarHBondContact O-N 2.93Å; L704-L708 WeakPolarHBondContact O-CG 3.41Å; L704-L708 PolarHBondContact O-N 3.25Å
705V95Very high90.9Very high0 Ų022.8 Ų22.80%011%0.114CC..Hα-helixtrans-57.9-49.2174.61680000109.7W695 I701 P702 L707 L708 Q709 L737 Q746 L750W695-V705 HydrophobicContact CH2-CG2 3.9Å; W695-V705 HydrophobicContact CZ3-CG2 3.63Å; I701-V705 HydrophobicContact CG2-CG2 4.46Å; I701-V705 WeakPolarHBondContact O-CG2 3.46Å; I701-V705 PolarHBondContact O-N 3.2Å; P702-V705 PolarHBondContact O-N 3.35Å; V705-L707 VanDerWaalsContact C-N 3.31Å; V705-L707 PolarHBondContact O-N 2.92Å; V705-L708 PolarHBondContact O-N 3.12Å; V705-Q709 HydrophobicContact CG1-CG 4.33Å; V705-Q709 VanDerWaalsContact O-CG 3.32Å; V705-Q709 WeakPolarHBondContact O-CG 3.35Å; V705-Q709 PolarHBondContact O-N 3.14Å; V705-L737 HydrophobicContact CG2-CD1 3.61Å; V705-Q746 HydrophobicContact CG2-CB 3.87Å; V705-L750 HydrophobicContact CG1-CB 4.39Å
706R93.3Very high90.9Very high21 Ų2122.6 Ų22.68%0.07911%0.114CC..Hα-helixtrans-57.9-43.9177-176.9-177.3163-149.46.3112.5Q665 E672 P702 L704 L708 Q709 A710 A909Q665-R706 PolarHBondContact O-NH1 2.96Å; E672-R706 VanDerWaalsContact CD-NH2 3.33Å; E672-R706 IonicContact OE1-CZ 3.25Å; E672-R706 IonicContact OE1-NE 2.82Å; E672-R706 PolarHBondContact OE1-NE 3.23Å; E672-R706 IonicContact OE1-NH2 2.78Å; E672-R706 PolarHBondContact OE1-NH2 2.9Å; E672-R706 VanDerWaalsContact OE1-NH2 3.11Å; E672-R706 IonicContact OE2-CZ 3.91Å; E672-R706 IonicContact OE2-NE 2.73Å; E672-R706 IonicContact OE2-NH2 3.5Å; E672-R706 PolarHBondContact OE2-NH2 3.25Å; P702-R706 PolarHBondContact O-N 2.77Å; P702-R706 VanDerWaalsContact O-N 3.11Å; L704-R706 VanDerWaalsContact C-N 3.31Å; L704-R706 PolarHBondContact O-N 3.1Å; R706-L708 VanDerWaalsContact C-N 3.34Å; R706-L708 PolarHBondContact O-N 2.91Å; R706-Q709 WeakPolarHBondContact O-CB 3.44Å; R706-Q709 PolarHBondContact O-N 2.99Å; R706-Q709 VanDerWaalsContact O-N 3.15Å; R706-A710 PolarHBondContact O-N 2.67Å; R706-A909 PolarHBondContact NH1-O 3.06Å; R706-A909 PolarHBondContact NH2-O 3.24Å
707L94.9Very high91Very high0 Ų019.5 Ų19.50%011%0.11CC..Hα-helixtrans-59.3-46.8177.8-178.255.9000110.8F664 M667 S668 L671 L689 P703 L704 V705 Q709 A710 F711F664-L707 HydrophobicContact CB-CD2 4.45Å; F664-L707 HydrophobicContact CD1-CD2 3.9Å; M667-L707 HydrophobicContact CB-CD1 4.02Å; M667-L707 HydrophobicContact CB-CD2 4.4Å; S668-L707 WeakPolarHBondContact OG-CA 3.48Å; S668-L707 WeakPolarHBondContact OG-CB 3.39Å; S668-L707 PolarHBondContact OG-N 3.36Å; L671-L707 HydrophobicContact CD2-CD1 4.48Å; L689-L707 HydrophobicContact CD1-CD2 3.69Å; L689-L707 HydrophobicContact CD1-CG 4.15Å; L689-L707 HydrophobicContact CD2-CD2 4.2Å; P703-L707 WeakPolarHBondContact O-CB 3.29Å; P703-L707 PolarHBondContact O-N 3.18Å; L704-L707 PolarHBondContact O-N 2.93Å; V705-L707 VanDerWaalsContact C-N 3.31Å; V705-L707 PolarHBondContact O-N 2.92Å; L707-Q709 VanDerWaalsContact C-N 3.31Å; L707-Q709 PolarHBondContact O-N 3.41Å; L707-A710 WeakPolarHBondContact O-CB 3.43Å; L707-A710 PolarHBondContact O-N 3.45Å; L707-A710 VanDerWaalsContact O-N 3.14Å; L707-F711 HydrophobicContact CD1-CD2 4.09Å; L707-F711 HydrophobicContact CD1-CE2 3.81Å; L707-F711 HydrophobicContact CD2-CE2 4.4Å; L707-F711 HydrophobicContact CG-CD2 4.04Å; L707-F711 HydrophobicContact CG-CE2 3.83Å; L707-F711 VanDerWaalsContact O-CD2 3.27Å; L707-F711 WeakPolarHBondContact O-CD2 3.42Å; L707-F711 PolarHBondContact O-N 3.45Å
708L95.5Very high91.3Very high1 Ų119.8 Ų19.81%0.00512%0.12CC..Hα-helixtrans-61.5-37.2175.5-69.9-178.4000112.7F686 L689 L690 W695 L704 V705 R706 A710 F711 L712 L730 V733 L750F686-L708 HydrophobicContact CD2-CD2 4.34Å; F686-L708 HydrophobicContact CE2-CD2 3.88Å; L689-L708 HydrophobicContact CB-CD2 4.41Å; L690-L708 HydrophobicContact CD2-CD1 4.4Å; L690-L708 HydrophobicContact CD2-CD2 4.12Å; W695-L708 HydrophobicContact CH2-CD1 3.73Å; W695-L708 HydrophobicContact CZ2-CD1 3.55Å; W695-L708 HydrophobicContact CZ2-CG 4.43Å; L704-L708 WeakPolarHBondContact O-CG 3.41Å; L704-L708 PolarHBondContact O-N 3.25Å; V705-L708 PolarHBondContact O-N 3.12Å; R706-L708 VanDerWaalsContact C-N 3.34Å; R706-L708 PolarHBondContact O-N 2.91Å; L708-A710 VanDerWaalsContact C-N 3.34Å; L708-F711 WeakPolarHBondContact O-CB 3.4Å; L708-F711 PolarHBondContact O-N 2.58Å; L708-L712 VanDerWaalsContact O-CG 3.28Å; L708-L712 WeakPolarHBondContact O-CG 3.31Å; L708-L712 PolarHBondContact O-N 2.89Å; L708-L730 HydrophobicContact CD1-CD1 3.86Å; L708-L730 HydrophobicContact CD2-CD1 4.27Å; L708-L730 HydrophobicContact CG-CD1 4.5Å; L708-V733 HydrophobicContact CD1-CG1 4.3Å; L708-L750 HydrophobicContact CB-CD1 3.8Å; L708-L750 HydrophobicContact CD1-CD1 4.15Å; L708-L750 HydrophobicContact CD1-CD2 4.23Å
709Q93.9Very high91.6Very high12 Ų1216.5 Ų16.56%0.05610%0.1CC..Hα-helixtrans-61.7-42.8173.5-65-176.3-7300111.5V705 R706 L707 F711 L712 E713 Y749 S753V705-Q709 HydrophobicContact CG1-CG 4.33Å; V705-Q709 VanDerWaalsContact O-CG 3.32Å; V705-Q709 WeakPolarHBondContact O-CG 3.35Å; V705-Q709 PolarHBondContact O-N 3.14Å; R706-Q709 WeakPolarHBondContact O-CB 3.44Å; R706-Q709 PolarHBondContact O-N 2.99Å; R706-Q709 VanDerWaalsContact O-N 3.15Å; L707-Q709 VanDerWaalsContact C-N 3.31Å; L707-Q709 PolarHBondContact O-N 3.41Å; Q709-F711 PolarHBondContact O-N 3.24Å; Q709-L712 PolarHBondContact O-N 2.92Å; Q709-E713 WeakPolarHBondContact O-CB 3.18Å; Q709-E713 PolarHBondContact O-N 2.87Å; Q709-Y749 PolarHBondContact NE2-O 3.47Å; Q709-S753 VanDerWaalsContact CG-OG 3.3Å; Q709-S753 WeakPolarHBondContact CG-OG 3.39Å; Q709-S753 PolarHBondContact NE2-OG 3.35Å
710A93.3Very high91.8Very high1 Ų117.2 Ų17.21%0.00811%0.106CC..Hα-helixtrans-63.1-39.5175.700000112.3L671 E672 R706 L707 L708 L712 K714L671-A710 HydrophobicContact CB-CB 4.36Å; L671-A710 HydrophobicContact CD2-CB 4.01Å; L671-A710 HydrophobicContact CG-CB 4.25Å; E672-A710 HydrophobicContact CG-CB 3.88Å; R706-A710 PolarHBondContact O-N 2.67Å; L707-A710 WeakPolarHBondContact O-CB 3.43Å; L707-A710 PolarHBondContact O-N 3.45Å; L707-A710 VanDerWaalsContact O-N 3.14Å; L708-A710 VanDerWaalsContact C-N 3.34Å; A710-L712 VanDerWaalsContact C-N 3.35Å; A710-L712 PolarHBondContact O-N 3.28Å; A710-K714 WeakPolarHBondContact O-CB 3.46Å; A710-K714 WeakPolarHBondContact O-CG 3.49Å; A710-K714 PolarHBondContact O-N 2.93Å
711F94.1Very high91.6Very high0 Ų021.3 Ų21.30%014%0.14CC..Hα-helixtrans-58-46.4171.4-89.1-85.4000111.9L671 I678 Y682 F686 L689 L707 L708 Q709 G715 I719L671-F711 HydrophobicContact CD2-CB 4.45Å; L671-F711 HydrophobicContact CD2-CD1 4.23Å; L671-F711 HydrophobicContact CD2-CD2 3.8Å; L671-F711 HydrophobicContact CD2-CE1 4.47Å; L671-F711 HydrophobicContact CD2-CE2 4.05Å; L671-F711 HydrophobicContact CD2-CG 3.89Å; L671-F711 HydrophobicContact CD2-CZ 4.38Å; I678-F711 HydrophobicContact CD1-CD1 4.01Å; I678-F711 HydrophobicContact CG2-CD1 4.1Å; I678-F711 HydrophobicContact CG2-CE1 3.89Å; Y682-F711 HydrophobicContact CD1-CE2 4.3Å; Y682-F711 AromaticContact CD1-CZ 3.9Å; Y682-F711 HydrophobicContact CD1-CZ 3.9Å; Y682-F711 HydrophobicContact CG-CZ 4.28Å; Y682-F711 WeakPolarHBondContact O-CE1 3.39Å; Y682-F711 WeakPolarHBondContact O-CZ 2.87Å; F686-F711 HydrophobicContact CB-CE1 4Å; F686-F711 HydrophobicContact CB-CZ 4.38Å; F686-F711 HydrophobicContact CD2-CB 4.39Å; F686-F711 AromaticContact CD2-CD1 3.7Å; F686-F711 HydrophobicContact CD2-CD1 3.7Å; F686-F711 HydrophobicContact CD2-CD2 4.31Å; F686-F711 AromaticContact CD2-CE1 3.95Å; F686-F711 HydrophobicContact CD2-CE1 3.95Å; F686-F711 AromaticContact CD2-CG 3.9Å; F686-F711 HydrophobicContact CD2-CG 3.9Å; F686-F711 HydrophobicContact CD2-CZ 4.38Å; F686-F711 HydrophobicContact CE2-CB 4.25Å; F686-F711 HydrophobicContact CE2-CD1 4.33Å; F686-F711 HydrophobicContact CE2-CG 4.25Å; F686-F711 HydrophobicContact CG-CD1 4.42Å; F686-F711 HydrophobicContact CG-CE1 4.38Å; L689-F711 HydrophobicContact CD1-CD2 4.35Å; L689-F711 HydrophobicContact CD1-CE2 3.61Å; L689-F711 HydrophobicContact CD1-CZ 4.16Å; L707-F711 HydrophobicContact CD1-CD2 4.09Å; L707-F711 HydrophobicContact CD1-CE2 3.81Å; L707-F711 HydrophobicContact CD2-CE2 4.4Å; L707-F711 HydrophobicContact CG-CD2 4.04Å; L707-F711 HydrophobicContact CG-CE2 3.83Å; L707-F711 VanDerWaalsContact O-CD2 3.27Å; L707-F711 WeakPolarHBondContact O-CD2 3.42Å; L707-F711 PolarHBondContact O-N 3.45Å; L708-F711 WeakPolarHBondContact O-CB 3.4Å; L708-F711 PolarHBondContact O-N 2.58Å; Q709-F711 PolarHBondContact O-N 3.24Å; F711-G715 PolarHBondContact O-N 3.05Å; F711-I719 HydrophobicContact CB-CD1 4.16Å
712L93Very high91.2Very high1 Ų124.8 Ų24.81%0.00517%0.165CC..Hα-helixtrans-67.4-45.1-178.8-68167.8000111.7L708 Q709 A710 K714 G716 L730 L750 I754 N757 M758L708-L712 VanDerWaalsContact O-CG 3.28Å; L708-L712 WeakPolarHBondContact O-CG 3.31Å; L708-L712 PolarHBondContact O-N 2.89Å; Q709-L712 PolarHBondContact O-N 2.92Å; A710-L712 VanDerWaalsContact C-N 3.35Å; A710-L712 PolarHBondContact O-N 3.28Å; L712-K714 PolarHBondContact O-N 3.49Å; L712-G716 WeakPolarHBondContact O-CA 3.43Å; L712-G716 PolarHBondContact O-N 2.99Å; L712-L730 HydrophobicContact CD1-CD2 4.34Å; L712-L730 HydrophobicContact CD2-CD2 3.91Å; L712-L750 HydrophobicContact CD1-CD1 3.88Å; L712-I754 HydrophobicContact CD1-CG1 3.68Å; L712-I754 HydrophobicContact CD2-CG1 4.49Å; L712-N757 HydrophobicContact CB-CB 4.38Å; L712-N757 WeakPolarHBondContact O-CB 3.47Å; L712-M758 HydrophobicContact CD2-CG 3.81Å; L712-M758 HydrophobicContact CD2-SD 3.79Å
713E91.1Very high90.9Very high98 Ų9823.8 Ų23.846%0.45816%0.159SC..Hα-helixtrans-60-44178-170.5-170.5145.300111.9Q709Q709-E713 WeakPolarHBondContact O-CB 3.18Å; Q709-E713 PolarHBondContact O-N 2.87Å
714K89.8Confident90.5Very high33 Ų3326 Ų2614%0.14318%0.178CC..Hα-helixtrans-85.4-21.4-175.6-61.2-55.5-178.1177.30114.8L671 E672 H674 I678 A710 L712L671-K714 HydrophobicContact CG-CG 4.37Å; E672-K714 WeakPolarHBondContact O-CE 3.46Å; E672-K714 PolarHBondContact O-NZ 3.26Å; H674-K714 WeakPolarHBondContact O-CD 3.33Å; H674-K714 WeakPolarHBondContact O-CE 3.34Å; H674-K714 PolarHBondContact O-NZ 3.5Å; I678-K714 HydrophobicContact CG1-CB 4.26Å; A710-K714 WeakPolarHBondContact O-CB 3.46Å; A710-K714 WeakPolarHBondContact O-CG 3.49Å; A710-K714 PolarHBondContact O-N 2.93Å; L712-K714 PolarHBondContact O-N 3.49Å
715G87.9Confident90.2Very high8 Ų831.1 Ų31.18%0.08221%0.205CC..Hα-helixtrans-157.331-174.100000115.9F711 A717 S718 I719F711-G715 PolarHBondContact O-N 3.05Å; G715-A717 PolarHBondContact O-N 2.88Å; G715-S718 CarbonylContact O-C 3.57Å; G715-S718 WeakPolarHBondContact O-CA 3.39Å; G715-S718 WeakPolarHBondContact O-CB 3.2Å; G715-S718 PolarHBondContact O-N 3.21Å; G715-I719 WeakPolarHBondContact O-CG1 3.35Å; G715-I719 PolarHBondContact O-N 3.03Å
716G88.8Confident90Very high3 Ų334.4 Ų34.43%0.03122%0.219CC..Hα-helixtrans-49.2-43.1173.500000113.3L712 A720L712-G716 WeakPolarHBondContact O-CA 3.43Å; L712-G716 PolarHBondContact O-N 2.99Å; G716-A720 WeakPolarHBondContact O-CB 3.35Å; G716-A720 PolarHBondContact O-N 3.4Å
717A88.4Confident89.9Confident63 Ų6333.7 Ų33.752%0.52122%0.217SC..Hα-helixtrans-66.3-39.9174.700000113.5G715 A720 A721 P759G715-A717 PolarHBondContact O-N 2.88Å; A717-A720 PolarHBondContact O-N 2.75Å; A717-A721 WeakPolarHBondContact O-CB 3.26Å; A717-A721 PolarHBondContact O-N 3.01Å; A717-P759 HydrophobicContact CB-CG 4.12Å
718S87.8Confident89.8Confident58 Ų5836.8 Ų36.841%0.40624%0.237SC..Hα-helixtrans-66.1-42.8176.8-176.40000111.4G715 A721 S722G715-S718 CarbonylContact O-C 3.57Å; G715-S718 WeakPolarHBondContact O-CA 3.39Å; G715-S718 WeakPolarHBondContact O-CB 3.2Å; G715-S718 PolarHBondContact O-N 3.21Å; S718-A721 PolarHBondContact O-N 3.21Å; S718-S722 WeakPolarHBondContact O-CB 3.46Å; S718-S722 PolarHBondContact O-N 3.34Å; S718-S722 PolarHBondContact O-OG 3.49Å
719I90.4Very high89.6Confident2 Ų238.1 Ų38.11%0.0125%0.251CS..Hα-helixtrans-62.3-45.6175.7-67166000109.9I678 M683 F686 F711 G715 A721 A723 A724I678-I719 HydrophobicContact CD1-CD1 3.95Å; I678-I719 HydrophobicContact CD1-CG1 4.02Å; M683-I719 HydrophobicContact CE-CG1 4.35Å; M683-I719 HydrophobicContact SD-CG1 4.32Å; F686-I719 HydrophobicContact CE1-CG2 4.04Å; F686-I719 HydrophobicContact CE2-CD1 4.25Å; F686-I719 HydrophobicContact CZ-CD1 4.24Å; F686-I719 HydrophobicContact CZ-CG2 4.12Å; F711-I719 HydrophobicContact CB-CD1 4.16Å; G715-I719 WeakPolarHBondContact O-CG1 3.35Å; G715-I719 PolarHBondContact O-N 3.03Å; I719-A721 VanDerWaalsContact C-N 3.25Å; I719-A721 PolarHBondContact O-N 3.43Å; I719-A723 HydrophobicContact CG2-CB 4.4Å; I719-A723 CarbonylContact O-C 3.16Å; I719-A723 VanDerWaalsContact O-CA 3.31Å; I719-A723 WeakPolarHBondContact O-CA 3.38Å; I719-A723 PolarHBondContact O-N 3.19Å; I719-A724 PolarHBondContact O-N 3.2Å
720A88.2Confident89.6Confident18 Ų1837.7 Ų37.715%0.14925%0.249CC..Hα-helixtrans-61.4-32.717700000113.1G716 A717 A724 P759G716-A720 WeakPolarHBondContact O-CB 3.35Å; G716-A720 PolarHBondContact O-N 3.4Å; A717-A720 PolarHBondContact O-N 2.75Å; A720-A724 WeakPolarHBondContact O-CB 3.31Å; A720-P759 HydrophobicContact CB-CG 3.94Å
721A86.4Confident89.6Confident88 Ų8838.6 Ų38.673%0.72725%0.254SS*.Hα-helixtrans-85.7-42.6179.800000113.6A717 S718 I719A717-A721 WeakPolarHBondContact O-CB 3.26Å; A717-A721 PolarHBondContact O-N 3.01Å; S718-A721 PolarHBondContact O-N 3.21Å; I719-A721 VanDerWaalsContact C-N 3.25Å; I719-A721 PolarHBondContact O-N 3.43Å
722S84Confident89.6Confident80 Ų8040.2 Ų40.256%0.55927%0.27SS*.Hα-helixtrans-102.9-15-169.666.30000114.8S718S718-S722 WeakPolarHBondContact O-CB 3.46Å; S718-S722 PolarHBondContact O-N 3.34Å; S718-S722 PolarHBondContact O-OG 3.49Å
723A84.9Confident89.7Confident9 Ų940.4 Ų40.47%0.07427%0.272CS..  trans-140.636.3-176.400000111.5M683 I719 D725 K726M683-A723 HydrophobicContact CE-CB 4.35Å; I719-A723 HydrophobicContact CG2-CB 4.4Å; I719-A723 CarbonylContact O-C 3.16Å; I719-A723 VanDerWaalsContact O-CA 3.31Å; I719-A723 WeakPolarHBondContact O-CA 3.38Å; I719-A723 PolarHBondContact O-N 3.19Å; A723-D725 PolarHBondContact O-N 3.2Å; A723-D725 VanDerWaalsContact O-N 3.17Å; A723-K726 HydrophobicContact CB-CB 4.34Å; A723-K726 HydrophobicContact CB-CG 4.03Å; A723-K726 WeakPolarHBondContact O-CB 3.46Å; A723-K726 PolarHBondContact O-N 3.2Å
724A85.8Confident89.9Confident51 Ų5135.9 Ų35.942%0.42125%0.25SS..G310 helixtrans-56.2-32.3-179.400000112.8I719 A720 K726 I727I719-A724 PolarHBondContact O-N 3.2Å; A720-A724 WeakPolarHBondContact O-CB 3.31Å; A724-K726 PolarHBondContact O-N 2.87Å; A724-I727 PolarHBondContact O-N 2.78Å
725D88.4Confident90.1Very high106 Ų10639.1 Ų39.157%0.56727%0.266SS*.G310 helixtrans-67.4-13.8176.270-57.2000113.3A723A723-D725 PolarHBondContact O-N 3.2Å; A723-D725 VanDerWaalsContact O-N 3.17Å
726K90.2Very high90.3Very high69 Ų6942.4 Ų42.430%0.328%0.278SS..G310 helixtrans-93.5-12.4178.5-53.7-51.4-177.6-149.10113.9F686 L690 A723 A724 G729 L730F686-K726 HydrophobicContact CD1-CB 4.47Å; F686-K726 HydrophobicContact CE1-CB 3.99Å; L690-K726 HydrophobicContact CD1-CB 4.04Å; A723-K726 HydrophobicContact CB-CB 4.34Å; A723-K726 HydrophobicContact CB-CG 4.03Å; A723-K726 WeakPolarHBondContact O-CB 3.46Å; A723-K726 PolarHBondContact O-N 3.2Å; A724-K726 PolarHBondContact O-N 2.87Å; K726-G729 WeakPolarHBondContact O-CA 3.43Å; K726-G729 PolarHBondContact O-N 2.79Å; K726-L730 PolarHBondContact O-N 3.44Å; K726-L730 VanDerWaalsContact O-N 3.15Å
727I90.9Very high90.4Very high7 Ų742.4 Ų42.44%0.03628%0.277CS..Hα-helixtrans-55.9-43177.6-61.5175.2000112.1A724 G729 L730 L731 M758 I763 Y766A724-I727 PolarHBondContact O-N 2.78Å; I727-G729 VanDerWaalsContact C-N 3.27Å; I727-G729 PolarHBondContact O-N 2.93Å; I727-L730 WeakPolarHBondContact O-CB 3.49Å; I727-L730 PolarHBondContact O-N 3.24Å; I727-L731 HydrophobicContact CG2-CD1 4.22Å; I727-L731 HydrophobicContact CG2-CG 4.49Å; I727-L731 WeakPolarHBondContact O-CG 3.45Å; I727-L731 PolarHBondContact O-N 3.08Å; I727-M758 HydrophobicContact CD1-CE 3.92Å; I727-M758 HydrophobicContact CG1-CE 4.03Å; I727-M758 HydrophobicContact CG2-CE 4.34Å; I727-I763 HydrophobicContact CG2-CD1 3.99Å; I727-Y766 HydrophobicContact CG2-CD2 4.11Å; I727-Y766 HydrophobicContact CG2-CE2 3.72Å
728P92.4Very high90.6Very high64 Ų6439.5 Ų39.542%0.41625%0.253SS..Hα-helixtrans-59.3-35.2174-25.936.1000113.7L731 G732P728-L731 PolarHBondContact O-N 2.59Å; P728-G732 PolarHBondContact O-N 3.41Å
729G92.3Very high90.6Very high30 Ų3039.4 Ų39.431%0.30926%0.256SS..Hα-helixtrans-65-42.6175.600000112.2K726 I727 L731 G732 V733K726-G729 WeakPolarHBondContact O-CA 3.43Å; K726-G729 PolarHBondContact O-N 2.79Å; I727-G729 VanDerWaalsContact C-N 3.27Å; I727-G729 PolarHBondContact O-N 2.93Å; G729-L731 VanDerWaalsContact C-N 3.33Å; G729-L731 PolarHBondContact O-N 2.98Å; G729-G732 PolarHBondContact O-N 3.41Å; G729-V733 PolarHBondContact O-N 3.24Å
730L92.9Very high90.4Very high3 Ų341 Ų412%0.01627%0.268CS..Hα-helixtrans-60.8-41.8174.2-172.668.4000112.1L690 L708 L712 K726 I727 G732 V733 F734 L750 I754L690-L730 HydrophobicContact CD2-CB 4.39Å; L690-L730 HydrophobicContact CD2-CD1 4.02Å; L708-L730 HydrophobicContact CD1-CD1 3.86Å; L708-L730 HydrophobicContact CD2-CD1 4.27Å; L708-L730 HydrophobicContact CG-CD1 4.5Å; L712-L730 HydrophobicContact CD1-CD2 4.34Å; L712-L730 HydrophobicContact CD2-CD2 3.91Å; K726-L730 PolarHBondContact O-N 3.44Å; K726-L730 VanDerWaalsContact O-N 3.15Å; I727-L730 WeakPolarHBondContact O-CB 3.49Å; I727-L730 PolarHBondContact O-N 3.24Å; L730-G732 VanDerWaalsContact C-N 3.34Å; L730-V733 WeakPolarHBondContact O-CB 3.4Å; L730-V733 PolarHBondContact O-N 3.16Å; L730-F734 PolarHBondContact O-N 3.42Å; L730-F734 VanDerWaalsContact O-N 3.15Å; L730-L750 HydrophobicContact CD1-CD1 4.06Å; L730-L750 HydrophobicContact CD1-CD2 4.28Å; L730-I754 HydrophobicContact CD2-CD1 3.8Å; L730-I754 HydrophobicContact CD2-CG1 3.87Å; L730-I754 HydrophobicContact CG-CD1 4.03Å
731L93.6Very high90.3Very high20 Ų2042.9 Ų42.911%0.10527%0.272CS..Hα-helixtrans-70.2-31175.5-66.4175.6000112.5I727 P728 G729 V733 F734 Q735 I754 Y766 I770I727-L731 HydrophobicContact CG2-CD1 4.22Å; I727-L731 HydrophobicContact CG2-CG 4.49Å; I727-L731 WeakPolarHBondContact O-CG 3.45Å; I727-L731 PolarHBondContact O-N 3.08Å; P728-L731 PolarHBondContact O-N 2.59Å; G729-L731 VanDerWaalsContact C-N 3.33Å; G729-L731 PolarHBondContact O-N 2.98Å; L731-V733 VanDerWaalsContact C-N 3.34Å; L731-F734 WeakPolarHBondContact O-CB 3.18Å; L731-F734 PolarHBondContact O-N 2.93Å; L731-Q735 WeakPolarHBondContact O-CB 3.42Å; L731-Q735 PolarHBondContact O-N 3.08Å; L731-I754 HydrophobicContact CD2-CD1 4.27Å; L731-Y766 HydrophobicContact CD1-CD1 3.75Å; L731-Y766 HydrophobicContact CD1-CD2 3.77Å; L731-Y766 HydrophobicContact CD1-CE1 4.37Å; L731-Y766 HydrophobicContact CD1-CE2 4.38Å; L731-Y766 HydrophobicContact CD1-CG 3.41Å; L731-Y766 VanDerWaalsContact CD1-CG 3.41Å; L731-I770 HydrophobicContact CD2-CD1 3.94Å; L731-I770 HydrophobicContact CD2-CG1 4.29Å
732G94.2Very high90.1Very high33 Ų3341.5 Ų41.534%0.3426%0.261SS..Hα-helixtrans-63.1-39.3171.400000112.4P728 G729 L730 Q735 K736P728-G732 PolarHBondContact O-N 3.41Å; G729-G732 PolarHBondContact O-N 3.41Å; L730-G732 VanDerWaalsContact C-N 3.34Å; G732-Q735 PolarHBondContact O-N 3.06Å; G732-K736 PolarHBondContact O-N 3.01Å
733V94.9Very high90.3Very high6 Ų639 Ų394%0.03624%0.241CC..Hα-helixtrans-61.3-49.8171.3171.10000110.7L690 W695 L708 G729 L730 L731 Q735 K736 L737 L750L690-V733 HydrophobicContact CD2-CG2 4.23Å; W695-V733 HydrophobicContact CD2-CG1 3.77Å; W695-V733 HydrophobicContact CD2-CG2 4.36Å; W695-V733 HydrophobicContact CE3-CG1 3.83Å; W695-V733 HydrophobicContact CH2-CG1 3.48Å; W695-V733 VanDerWaalsContact CH2-CG1 3.48Å; W695-V733 HydrophobicContact CZ2-CB 4.42Å; W695-V733 HydrophobicContact CZ2-CG1 3.43Å; W695-V733 VanDerWaalsContact CZ2-CG1 3.43Å; W695-V733 HydrophobicContact CZ2-CG2 4.09Å; W695-V733 HydrophobicContact CZ3-CG1 3.69Å; L708-V733 HydrophobicContact CD1-CG1 4.3Å; G729-V733 PolarHBondContact O-N 3.24Å; L730-V733 WeakPolarHBondContact O-CB 3.4Å; L730-V733 PolarHBondContact O-N 3.16Å; L731-V733 VanDerWaalsContact C-N 3.34Å; V733-Q735 VanDerWaalsContact C-N 3.3Å; V733-Q735 PolarHBondContact O-N 3.32Å; V733-K736 PolarHBondContact O-N 2.77Å; V733-K736 VanDerWaalsContact O-N 3.15Å; V733-L737 HydrophobicContact CG1-CD1 3.99Å; V733-L737 HydrophobicContact CG1-CG 4.4Å; V733-L737 WeakPolarHBondContact O-CG 3.35Å; V733-L737 PolarHBondContact O-N 3.46Å; V733-L750 HydrophobicContact CB-CD2 4.38Å; V733-L750 HydrophobicContact CG1-CD2 3.87Å
734F95.2Very high90.4Very high2 Ų238.6 Ų38.61%0.00924%0.238CC..Hα-helixtrans-53.5-47.1174.2152.7-103.6000112L730 L731 K736 L737 I738 L750 L751 I770 L773 L774L730-F734 PolarHBondContact O-N 3.42Å; L730-F734 VanDerWaalsContact O-N 3.15Å; L731-F734 WeakPolarHBondContact O-CB 3.18Å; L731-F734 PolarHBondContact O-N 2.93Å; F734-K736 VanDerWaalsContact C-N 3.31Å; F734-K736 PolarHBondContact O-N 2.81Å; F734-L737 PolarHBondContact O-N 3.32Å; F734-I738 HydrophobicContact CD2-CB 4.42Å; F734-I738 HydrophobicContact CE2-CB 3.97Å; F734-I738 HydrophobicContact CE2-CD1 4.36Å; F734-I738 HydrophobicContact CE2-CG1 4.1Å; F734-I738 HydrophobicContact CE2-CG2 4.24Å; F734-I738 HydrophobicContact CZ-CB 4.4Å; F734-I738 HydrophobicContact CZ-CG1 4.45Å; F734-I738 HydrophobicContact CZ-CG2 4.2Å; F734-I738 WeakPolarHBondContact O-CB 3.4Å; F734-I738 WeakPolarHBondContact O-CG2 3.44Å; F734-I738 PolarHBondContact O-N 3.28Å; F734-L750 HydrophobicContact CB-CD2 4.34Å; F734-L751 HydrophobicContact CD2-CB 4.24Å; F734-L751 HydrophobicContact CD2-CD1 4.49Å; F734-L751 HydrophobicContact CD2-CD2 4.4Å; F734-L751 HydrophobicContact CE2-CB 4.4Å; F734-L751 HydrophobicContact CE2-CD2 3.8Å; F734-L751 HydrophobicContact CE2-CG 4.47Å; F734-L751 HydrophobicContact CZ-CD2 4.14Å; F734-I770 HydrophobicContact CE1-CG1 4.32Å; F734-I770 HydrophobicContact CE1-CG2 4.23Å; F734-I770 HydrophobicContact CZ-CG2 4.13Å; F734-L773 HydrophobicContact CE1-CD1 4.04Å; F734-L774 HydrophobicContact CE2-CD2 4.21Å; F734-L774 HydrophobicContact CZ-CD2 4.07Å; F734-L774 HydrophobicContact CZ-CG 4.35Å
735Q93.8Very high90.6Very high102 Ų10237.2 Ų37.248%0.47722%0.223SC..Hα-helixtrans-61.1-39179.5-176.8179.41.400112.1L731 G732 V733 I738 A739 L773L731-Q735 WeakPolarHBondContact O-CB 3.42Å; L731-Q735 PolarHBondContact O-N 3.08Å; G732-Q735 PolarHBondContact O-N 3.06Å; V733-Q735 VanDerWaalsContact C-N 3.3Å; V733-Q735 PolarHBondContact O-N 3.32Å; Q735-I738 WeakPolarHBondContact O-CG2 3.48Å; Q735-A739 WeakPolarHBondContact O-CB 3.45Å; Q735-A739 PolarHBondContact O-N 3.12Å; Q735-L773 HydrophobicContact CB-CD1 4.29Å; Q735-L773 HydrophobicContact CG-CD1 4.03Å; Q735-L773 HydrophobicContact CG-CD2 4.4Å
736K91.8Very high90.8Very high76 Ų7633.2 Ų33.233%0.3320%0.2SC..Hα-helixtrans-65.3-45.6175.4-178.7170.3177.1168.90111.6P692 W695 E696 G732 V733 F734 A739P692-K736 PolarHBondContact O-NZ 2.98Å; W695-K736 VanDerWaalsContact C-NZ 3.34Å; W695-K736 HydrophobicContact CB-CD 3.9Å; W695-K736 WeakPolarHBondContact O-CE 3.44Å; W695-K736 PolarHBondContact O-NZ 3Å; E696-K736 VanDerWaalsContact CG-NZ 3.3Å; G732-K736 PolarHBondContact O-N 3.01Å; V733-K736 PolarHBondContact O-N 2.77Å; V733-K736 VanDerWaalsContact O-N 3.15Å; F734-K736 VanDerWaalsContact C-N 3.31Å; F734-K736 PolarHBondContact O-N 2.81Å; K736-A739 PolarHBondContact O-N 2.86Å
737L92.1Very high91Very high3 Ų329.9 Ų29.92%0.01619%0.186CC..Hα-helixtrans-66.1-45.3-178.4-65.7175.1000112.1W695 I701 V705 V733 F734 A739 S740 N743 D744 Q746W695-L737 HydrophobicContact CE3-CD1 4.38Å; W695-L737 HydrophobicContact CE3-CD2 3.94Å; W695-L737 HydrophobicContact CE3-CG 4.38Å; W695-L737 HydrophobicContact CZ3-CD1 3.9Å; W695-L737 HydrophobicContact CZ3-CD2 4.13Å; W695-L737 HydrophobicContact CZ3-CG 4.39Å; I701-L737 HydrophobicContact CD1-CD2 4.36Å; I701-L737 HydrophobicContact CG1-CD2 4.47Å; I701-L737 HydrophobicContact CG2-CD2 3.54Å; V705-L737 HydrophobicContact CG2-CD1 3.61Å; V733-L737 HydrophobicContact CG1-CD1 3.99Å; V733-L737 HydrophobicContact CG1-CG 4.4Å; V733-L737 WeakPolarHBondContact O-CG 3.35Å; V733-L737 PolarHBondContact O-N 3.46Å; F734-L737 PolarHBondContact O-N 3.32Å; L737-A739 PolarHBondContact O-N 2.62Å; L737-S740 PolarHBondContact O-N 2.74Å; L737-S740 VanDerWaalsContact O-N 3.13Å; L737-N743 HydrophobicContact CD2-CB 4.14Å; L737-N743 CarbonylContact O-C 3.49Å; L737-D744 PolarHBondContact O-N 2.93Å; L737-Q746 HydrophobicContact CD1-CB 4.27Å
738I92.2Very high91.2Very high2 Ų229.6 Ų29.61%0.0119%0.185CC..Hα-helixtrans-68.3-25.1-177.5-155.764.7000112.9F734 Q735 S740 D744 F748 L774 R777 F786F734-I738 HydrophobicContact CD2-CB 4.42Å; F734-I738 HydrophobicContact CE2-CB 3.97Å; F734-I738 HydrophobicContact CE2-CD1 4.36Å; F734-I738 HydrophobicContact CE2-CG1 4.1Å; F734-I738 HydrophobicContact CE2-CG2 4.24Å; F734-I738 HydrophobicContact CZ-CB 4.4Å; F734-I738 HydrophobicContact CZ-CG1 4.45Å; F734-I738 HydrophobicContact CZ-CG2 4.2Å; F734-I738 WeakPolarHBondContact O-CB 3.4Å; F734-I738 WeakPolarHBondContact O-CG2 3.44Å; F734-I738 PolarHBondContact O-N 3.28Å; Q735-I738 WeakPolarHBondContact O-CG2 3.48Å; I738-S740 VanDerWaalsContact C-N 3.26Å; I738-S740 PolarHBondContact O-N 2.99Å; I738-D744 HydrophobicContact CD1-CB 4.27Å; I738-F748 HydrophobicContact CD1-CD2 3.8Å; I738-F748 HydrophobicContact CD1-CE2 3.46Å; I738-F748 VanDerWaalsContact CD1-CE2 3.46Å; I738-F748 HydrophobicContact CD1-CZ 3.87Å; I738-L774 HydrophobicContact CD1-CD2 3.89Å; I738-L774 HydrophobicContact CG1-CD2 3.84Å; I738-R777 HydrophobicContact CG1-CG 4.38Å; I738-R777 PolarHBondContact O-NE 3.35Å; I738-F786 HydrophobicContact CD1-CD2 3.98Å; I738-F786 HydrophobicContact CD1-CE2 3.53Å; I738-F786 HydrophobicContact CG1-CE2 3.82Å
739A88.4Confident91.3Very high56 Ų5630.2 Ų30.246%0.46318%0.179SC..THydrogen-bonded Turntrans-72.5-16175.500000113.4Q735 K736 L737 R777Q735-A739 WeakPolarHBondContact O-CB 3.45Å; Q735-A739 PolarHBondContact O-N 3.12Å; K736-A739 PolarHBondContact O-N 2.86Å; L737-A739 PolarHBondContact O-N 2.62Å; A739-R777 PolarHBondContact O-NH1 3.11Å; A739-R777 PolarHBondContact O-NH2 3.25Å
740S86.6Confident91.4Very high37 Ų3728.8 Ų28.826%0.25917%0.165SC..  trans-99124.2-178.9175.50000111.1L737 I738 A742 N743 D744L737-S740 PolarHBondContact O-N 2.74Å; L737-S740 VanDerWaalsContact O-N 3.13Å; I738-S740 VanDerWaalsContact C-N 3.26Å; I738-S740 PolarHBondContact O-N 2.99Å; S740-A742 PolarHBondContact O-N 2.92Å; S740-A742 PolarHBondContact OG-N 3.49Å; S740-N743 PolarHBondContact O-N 3.37Å; S740-N743 PolarHBondContact OG-N 2.91Å; S740-N743 PolarHBondContact OG-ND2 3.39Å; S740-N743 VanDerWaalsContact OG-ND2 3.14Å; S740-D744 WeakPolarHBondContact O-CB 3.36Å; S740-D744 PolarHBondContact O-N 3.15Å
741K84.6Confident91.5Very high56 Ų5628.7 Ų28.724%0.24316%0.164CC..THydrogen-bonded Turntrans-59-33.4174.2-68172.5-179.2156.80112.1D79 T783 F890D79-K741 IonicContact OD2-NZ 2.68Å; D79-K741 PolarHBondContact OD2-NZ 3.02Å; K741-T783 HydrophobicContact CB-CG2 4.09Å; K741-T783 HydrophobicContact CG-CG2 4.16Å; K741-F890 HydrophobicContact CD-CE2 4.2Å
742A83.3Confident91.5Very high60 Ų6028.8 Ų28.850%0.49617%0.165SC..THydrogen-bonded Turntrans-72.7-33.5178.500000112.9S740 H745S740-A742 PolarHBondContact O-N 2.92Å; S740-A742 PolarHBondContact OG-N 3.49Å; A742-H745 PolarHBondContact O-CE1 3.36Å; A742-H745 PolarHBondContact O-ND1 2.97Å
743N87.1Confident91.5Very high27 Ų2727.7 Ų27.714%0.14415%0.151CC..THydrogen-bonded Turntrans-115.72.9-167.2-60.7-64.1000115I701 L737 S740 H745 Q746 G747I701-N743 HydrophobicContact CD1-CB 4.44Å; I701-N743 HydrophobicContact CG2-CB 4.45Å; L737-N743 HydrophobicContact CD2-CB 4.14Å; L737-N743 CarbonylContact O-C 3.49Å; S740-N743 PolarHBondContact O-N 3.37Å; S740-N743 PolarHBondContact OG-N 2.91Å; S740-N743 PolarHBondContact OG-ND2 3.39Å; S740-N743 VanDerWaalsContact OG-ND2 3.14Å; N743-H745 VanDerWaalsContact C-N 3.34Å; N743-H745 PolarHBondContact O-N 3.14Å; N743-Q746 VanDerWaalsContact O-CB 3.28Å; N743-Q746 WeakPolarHBondContact O-CB 3.41Å; N743-Q746 PolarHBondContact O-N 3.34Å; N743-G747 PolarHBondContact O-N 3.07Å
744D87.8Confident91.5Very high1 Ų127.4 Ų27.41%0.00515%0.15CC..Hα-helixtrans-51.8-44.4-175.251.519.4000114.9L737 I738 S740 Q746 G747 F748 T783 F786L737-D744 PolarHBondContact O-N 2.93Å; I738-D744 HydrophobicContact CD1-CB 4.27Å; S740-D744 WeakPolarHBondContact O-CB 3.36Å; S740-D744 PolarHBondContact O-N 3.15Å; D744-Q746 VanDerWaalsContact C-N 3.28Å; D744-Q746 PolarHBondContact O-N 3.39Å; D744-G747 WeakPolarHBondContact O-CA 3.39Å; D744-G747 PolarHBondContact O-N 2.8Å; D744-F748 WeakPolarHBondContact O-CD2 3.33Å; D744-F748 PolarHBondContact O-N 3.37Å; D744-F748 VanDerWaalsContact O-N 3.15Å; D744-T783 PolarHBondContact OD2-OG1 3.46Å; D744-F786 HydrophobicContact CB-CD2 4.03Å
745H89.4Confident91.4Very high22 Ų2227.6 Ų27.610%0.10215%0.151CC..Hα-helixtrans-56.9-35.7174.865-66000113.9A742 N743 G747 F748 Y749 K785A742-H745 PolarHBondContact O-CE1 3.36Å; A742-H745 PolarHBondContact O-ND1 2.97Å; N743-H745 VanDerWaalsContact C-N 3.34Å; N743-H745 PolarHBondContact O-N 3.14Å; H745-G747 VanDerWaalsContact C-N 3.28Å; H745-G747 PolarHBondContact O-N 2.92Å; H745-F748 PolarHBondContact O-N 3.39Å; H745-Y749 PolarHBondContact O-N 3.22Å; H745-K785 HydrophobicContact CB-CD 3.67Å; H745-K785 VanDerWaalsContact CB-CE 3.43Å; H745-K785 HydrophobicContact CB-CG 3.9Å; H745-K785 WeakPolarHBondContact CD2-CE 3.32Å; H745-K785 PolarHBondContact CD2-NZ 2.97Å; H745-K785 PolarHBondContact CE1-NZ 2.81Å; H745-K785 VanDerWaalsContact ND1-CE 3.29Å; H745-K785 WeakPolarHBondContact ND1-CE 3.42Å; H745-K785 PolarHBondContact ND1-NZ 3.48Å; H745-K785 PolarHBondContact NE2-NZ 2.95Å
746Q92.7Very high91.3Very high21 Ų2124.8 Ų24.810%0.09814%0.138CC..Hα-helixtrans-66.9-36.2175.9-61.8-66.9-1500110.3I701 V705 L737 N743 D744 F748 Y749 L750I701-Q746 HydrophobicContact CG2-CB 4.13Å; I701-Q746 HydrophobicContact CG2-CG 4Å; V705-Q746 HydrophobicContact CG2-CB 3.87Å; L737-Q746 HydrophobicContact CD1-CB 4.27Å; N743-Q746 VanDerWaalsContact O-CB 3.28Å; N743-Q746 WeakPolarHBondContact O-CB 3.41Å; N743-Q746 PolarHBondContact O-N 3.34Å; D744-Q746 VanDerWaalsContact C-N 3.28Å; D744-Q746 PolarHBondContact O-N 3.39Å; Q746-F748 VanDerWaalsContact C-N 3.33Å; Q746-F748 PolarHBondContact O-N 3.42Å; Q746-Y749 PolarHBondContact O-N 3.22Å; Q746-L750 PolarHBondContact O-N 3.48Å; Q746-L750 VanDerWaalsContact O-N 3.11Å
747G94.6Very high91.3Very high0 Ų023.3 Ų23.30%013%0.134CC..Hα-helixtrans-59.8-42.1171.200000112.3N743 D744 H745 L750 L751N743-G747 PolarHBondContact O-N 3.07Å; D744-G747 WeakPolarHBondContact O-CA 3.39Å; D744-G747 PolarHBondContact O-N 2.8Å; H745-G747 VanDerWaalsContact C-N 3.28Å; H745-G747 PolarHBondContact O-N 2.92Å; G747-L750 PolarHBondContact O-N 2.76Å; G747-L751 WeakPolarHBondContact O-CB 3.21Å; G747-L751 PolarHBondContact O-N 3Å
748F95.4Very high91.3Very high1 Ų123.5 Ų23.50%0.00414%0.135CC..Hα-helixtrans-68.6-38.1176-77.3-72.5000113.5I738 D744 H745 Q746 L750 L751 N752 L774 F786 S789 F790 F793I738-F748 HydrophobicContact CD1-CD2 3.8Å; I738-F748 HydrophobicContact CD1-CE2 3.46Å; I738-F748 VanDerWaalsContact CD1-CE2 3.46Å; I738-F748 HydrophobicContact CD1-CZ 3.87Å; D744-F748 WeakPolarHBondContact O-CD2 3.33Å; D744-F748 PolarHBondContact O-N 3.37Å; D744-F748 VanDerWaalsContact O-N 3.15Å; H745-F748 PolarHBondContact O-N 3.39Å; Q746-F748 VanDerWaalsContact C-N 3.33Å; Q746-F748 PolarHBondContact O-N 3.42Å; F748-L750 VanDerWaalsContact C-N 3.32Å; F748-L750 PolarHBondContact O-N 2.97Å; F748-L751 PolarHBondContact O-N 2.98Å; F748-N752 WeakPolarHBondContact O-CB 3.29Å; F748-N752 PolarHBondContact O-N 3.14Å; F748-N752 PolarHBondContact O-ND2 3.37Å; F748-N752 PolarHBondContact O-OD1 2.96Å; F748-L774 HydrophobicContact CE1-CD1 4.3Å; F748-L774 HydrophobicContact CE1-CD2 3.62Å; F748-L774 HydrophobicContact CZ-CD2 3.62Å; F748-F786 AromaticContact CE2-CD2 3.69Å; F748-F786 HydrophobicContact CE2-CD2 3.69Å; F748-F786 AromaticContact CE2-CE2 3.81Å; F748-F786 HydrophobicContact CE2-CE2 3.81Å; F748-F786 HydrophobicContact CE2-CG 4.08Å; F748-F786 HydrophobicContact CE2-CZ 4.29Å; F748-F786 HydrophobicContact CZ-CD2 4.2Å; F748-F786 HydrophobicContact CZ-CE1 4.32Å; F748-F786 AromaticContact CZ-CE2 3.9Å; F748-F786 HydrophobicContact CZ-CE2 3.9Å; F748-F786 AromaticContact CZ-CZ 3.95Å; F748-F786 HydrophobicContact CZ-CZ 3.95Å; F748-S789 VanDerWaalsContact CG-CB 3.48Å; F748-F790 HydrophobicContact CE1-CB 4.09Å; F748-F790 HydrophobicContact CE1-CD2 4.29Å; F748-F790 HydrophobicContact CE2-CB 4.49Å; F748-F790 HydrophobicContact CZ-CB 3.67Å; F748-F790 HydrophobicContact CZ-CD2 4.22Å; F748-F790 HydrophobicContact CZ-CG 4.47Å; F748-F793 HydrophobicContact CD1-CB 3.73Å; F748-F793 HydrophobicContact CD1-CG 4.18Å; F748-F793 HydrophobicContact CE1-CB 3.97Å; F748-F793 HydrophobicContact CE1-CD1 4.33Å; F748-F793 HydrophobicContact CE1-CG 4.31Å
749Y93.8Very high91.3Very high77 Ų7725.1 Ų25.130%0.30215%0.145SC..Hα-helixtrans-59.1-45.2173.8-66.7-23.9000111.9Q709 H745 Q746 S753Q709-Y749 PolarHBondContact NE2-O 3.47Å; H745-Y749 PolarHBondContact O-N 3.22Å; Q746-Y749 PolarHBondContact O-N 3.22Å; Y749-S753 PolarHBondContact O-N 3.46Å; Y749-S753 PolarHBondContact O-OG 3.13Å
750L95Very high91.3Very high0 Ų025.1 Ų25.10%014%0.14CC..Hα-helixtrans-61.3-46.2174.5-177.158.6000111.3V705 L708 L712 L730 V733 F734 Q746 G747 F748 S753 I754V705-L750 HydrophobicContact CG1-CB 4.39Å; L708-L750 HydrophobicContact CB-CD1 3.8Å; L708-L750 HydrophobicContact CD1-CD1 4.15Å; L708-L750 HydrophobicContact CD1-CD2 4.23Å; L712-L750 HydrophobicContact CD1-CD1 3.88Å; L730-L750 HydrophobicContact CD1-CD1 4.06Å; L730-L750 HydrophobicContact CD1-CD2 4.28Å; V733-L750 HydrophobicContact CB-CD2 4.38Å; V733-L750 HydrophobicContact CG1-CD2 3.87Å; F734-L750 HydrophobicContact CB-CD2 4.34Å; Q746-L750 PolarHBondContact O-N 3.48Å; Q746-L750 VanDerWaalsContact O-N 3.11Å; G747-L750 PolarHBondContact O-N 2.76Å; F748-L750 VanDerWaalsContact C-N 3.32Å; F748-L750 PolarHBondContact O-N 2.97Å; L750-S753 PolarHBondContact O-N 3.31Å; L750-I754 HydrophobicContact CG-CD1 4.19Å; L750-I754 WeakPolarHBondContact O-CG1 3.38Å; L750-I754 PolarHBondContact O-N 2.87Å
751L95.1Very high91.5Very high0 Ų030.3 Ų30.30%016%0.161CC..Hα-helixtrans-65.5-40.3-177.9-170.363.9000112.9F734 G747 F748 S753 I754 I755 I770 L774 F793F734-L751 HydrophobicContact CD2-CB 4.24Å; F734-L751 HydrophobicContact CD2-CD1 4.49Å; F734-L751 HydrophobicContact CD2-CD2 4.4Å; F734-L751 HydrophobicContact CE2-CB 4.4Å; F734-L751 HydrophobicContact CE2-CD2 3.8Å; F734-L751 HydrophobicContact CE2-CG 4.47Å; F734-L751 HydrophobicContact CZ-CD2 4.14Å; G747-L751 WeakPolarHBondContact O-CB 3.21Å; G747-L751 PolarHBondContact O-N 3Å; F748-L751 PolarHBondContact O-N 2.98Å; L751-S753 VanDerWaalsContact C-N 3.31Å; L751-S753 PolarHBondContact O-N 3.31Å; L751-I754 PolarHBondContact O-N 3.47Å; L751-I755 PolarHBondContact O-N 3.2Å; L751-I770 HydrophobicContact CD1-CD1 4.1Å; L751-I770 HydrophobicContact CD1-CG2 3.84Å; L751-I770 HydrophobicContact CD2-CG2 3.75Å; L751-I770 HydrophobicContact CG-CG2 4.42Å; L751-L774 HydrophobicContact CD2-CD1 4.13Å; L751-F793 HydrophobicContact CB-CE2 4.41Å; L751-F793 HydrophobicContact CD1-CE2 4.33Å; L751-F793 HydrophobicContact CD1-CZ 4.4Å; L751-F793 HydrophobicContact CD2-CD1 4Å; L751-F793 HydrophobicContact CD2-CD2 3.76Å; L751-F793 HydrophobicContact CD2-CE1 3.64Å; L751-F793 HydrophobicContact CD2-CE2 3.41Å; L751-F793 VanDerWaalsContact CD2-CE2 3.41Å; L751-F793 HydrophobicContact CD2-CG 4.06Å; L751-F793 HydrophobicContact CD2-CZ 3.34Å; L751-F793 HydrophobicContact CG-CD2 3.9Å; L751-F793 HydrophobicContact CG-CE2 3.39Å; L751-F793 HydrophobicContact CG-CZ 3.74Å
752N94.5Very high91.7Very high23 Ų2328.7 Ų28.712%0.12316%0.156CC..Hα-helixtrans-57.5-46.3173.3-72.7-13.6000110.5F748 I754 I755 E756 F793 L796F748-N752 WeakPolarHBondContact O-CB 3.29Å; F748-N752 PolarHBondContact O-N 3.14Å; F748-N752 PolarHBondContact O-ND2 3.37Å; F748-N752 PolarHBondContact O-OD1 2.96Å; N752-I754 PolarHBondContact O-N 3.39Å; N752-I755 PolarHBondContact O-N 2.89Å; N752-E756 VanDerWaalsContact O-CB 3.31Å; N752-E756 WeakPolarHBondContact O-CB 3.36Å; N752-E756 PolarHBondContact O-N 3.34Å; N752-F793 WeakPolarHBondContact OD1-CD2 3.42Å; N752-L796 HydrophobicContact CB-CD2 3.7Å
753S93.6Very high92Very high9 Ų925.9 Ų25.96%0.06313%0.133CC..Hα-helixtrans-66.5-33.4177.8-66.70000113.4Q709 Y749 L750 L751 N757Q709-S753 VanDerWaalsContact CG-OG 3.3Å; Q709-S753 WeakPolarHBondContact CG-OG 3.39Å; Q709-S753 PolarHBondContact NE2-OG 3.35Å; Y749-S753 PolarHBondContact O-N 3.46Å; Y749-S753 PolarHBondContact O-OG 3.13Å; L750-S753 PolarHBondContact O-N 3.31Å; L751-S753 VanDerWaalsContact C-N 3.31Å; L751-S753 PolarHBondContact O-N 3.31Å; S753-N757 WeakPolarHBondContact O-CB 3.12Å; S753-N757 PolarHBondContact O-N 3.46Å; S753-N757 VanDerWaalsContact O-N 3.08Å; S753-N757 PolarHBondContact O-ND2 3.49Å
754I94.1Very high92.2Very high0 Ų028.4 Ų28.40%015%0.149CC..Hα-helixtrans-63-50.9173.5-70168.4000110.1L712 L730 L731 L750 L751 N752 E756 M758 I763L712-I754 HydrophobicContact CD1-CG1 3.68Å; L712-I754 HydrophobicContact CD2-CG1 4.49Å; L730-I754 HydrophobicContact CD2-CD1 3.8Å; L730-I754 HydrophobicContact CD2-CG1 3.87Å; L730-I754 HydrophobicContact CG-CD1 4.03Å; L731-I754 HydrophobicContact CD2-CD1 4.27Å; L750-I754 HydrophobicContact CG-CD1 4.19Å; L750-I754 WeakPolarHBondContact O-CG1 3.38Å; L750-I754 PolarHBondContact O-N 2.87Å; L751-I754 PolarHBondContact O-N 3.47Å; N752-I754 PolarHBondContact O-N 3.39Å; I754-E756 VanDerWaalsContact C-N 3.29Å; I754-E756 PolarHBondContact O-N 3.39Å; I754-M758 HydrophobicContact CG2-CG 4.3Å; I754-M758 VanDerWaalsContact O-CB 3.22Å; I754-M758 WeakPolarHBondContact O-CB 3.27Å; I754-M758 WeakPolarHBondContact O-CG 3.49Å; I754-M758 PolarHBondContact O-N 3.15Å; I754-M758 VanDerWaalsContact O-N 3.1Å; I754-I763 HydrophobicContact CG2-CD1 3.7Å; I754-I763 HydrophobicContact CG2-CG1 3.84Å
755I92.9Very high92.3Very high7 Ų735.3 Ų35.34%0.03618%0.181CC..Hα-helixtrans-65.3-35.2-178.6-67.8-45000112.1L751 N752 I763 F793 K800 Y801L751-I755 PolarHBondContact O-N 3.2Å; N752-I755 PolarHBondContact O-N 2.89Å; I755-I763 HydrophobicContact CD1-CG2 4.23Å; I755-F793 HydrophobicContact CG1-CE2 3.67Å; I755-F793 HydrophobicContact CG1-CZ 4.27Å; I755-K800 HydrophobicContact CG2-CB 4.33Å; I755-K800 HydrophobicContact CG2-CG 4.34Å; I755-Y801 HydrophobicContact CD1-CE2 4.04Å; I755-Y801 HydrophobicContact CG2-CD2 4.38Å; I755-Y801 HydrophobicContact CG2-CE2 3.63Å
756E92.1Very high92.4Very high42 Ų4236.9 Ų36.920%0.19619%0.187CC..Hα-helixtrans-74.7-41.3-178177.2160.5-144.800113.7N752 I754 K800 H914 P916N752-E756 VanDerWaalsContact O-CB 3.31Å; N752-E756 WeakPolarHBondContact O-CB 3.36Å; N752-E756 PolarHBondContact O-N 3.34Å; I754-E756 VanDerWaalsContact C-N 3.29Å; I754-E756 PolarHBondContact O-N 3.39Å; E756-K800 IonicContact OE1-NZ 3.7Å; E756-K800 PolarHBondContact OE1-NZ 2.77Å; E756-H914 IonicContact OE1-CD2 3.66Å; E756-H914 IonicContact OE1-CE1 2.68Å; E756-H914 IonicContact OE1-NE2 2.72Å; E756-H914 PolarHBondContact OE1-NE2 2.9Å; E756-H914 IonicContact OE2-CD2 3.12Å; E756-H914 PolarHBondContact OE2-CD2 3.22Å; E756-H914 IonicContact OE2-NE2 3.63Å; E756-H914 PolarHBondContact OE2-NE2 3.03Å; E756-H914 VanDerWaalsContact OE2-NE2 3.11Å; E756-P916 VanDerWaalsContact OE1-CA 3.31Å; E756-P916 WeakPolarHBondContact OE1-CA 3.19Å; E756-P916 WeakPolarHBondContact OE1-CB 3.39Å
757N92.1Very high92.4Very high46 Ų4637.4 Ų37.425%0.24619%0.188CC..Hα-helixtrans-111.8-14.7-165-56.8-70.8000114.7L712 S753L712-N757 HydrophobicContact CB-CB 4.38Å; L712-N757 WeakPolarHBondContact O-CB 3.47Å; S753-N757 WeakPolarHBondContact O-CB 3.12Å; S753-N757 PolarHBondContact O-N 3.46Å; S753-N757 VanDerWaalsContact O-N 3.08Å; S753-N757 PolarHBondContact O-ND2 3.49Å
758M92.3Very high92.3Very high7 Ų742 Ų423%0.03421%0.208CC..SBendtrans-89144.7179.6-66.1-105.6-72.500111.9L712 I727 I754 I763L712-M758 HydrophobicContact CD2-CG 3.81Å; L712-M758 HydrophobicContact CD2-SD 3.79Å; I727-M758 HydrophobicContact CD1-CE 3.92Å; I727-M758 HydrophobicContact CG1-CE 4.03Å; I727-M758 HydrophobicContact CG2-CE 4.34Å; I754-M758 HydrophobicContact CG2-CG 4.3Å; I754-M758 VanDerWaalsContact O-CB 3.22Å; I754-M758 WeakPolarHBondContact O-CB 3.27Å; I754-M758 WeakPolarHBondContact O-CG 3.49Å; I754-M758 PolarHBondContact O-N 3.15Å; I754-M758 VanDerWaalsContact O-N 3.1Å; M758-I763 HydrophobicContact CB-CG1 4.06Å; M758-I763 HydrophobicContact CE-CD1 3.32Å; M758-I763 HydrophobicContact CE-CG1 3.88Å
759P92Very high92.3Very high36 Ų3646.7 Ų46.723%0.23423%0.23CC..  trans-55.2130.1172.2-25.134.3000111.2A717 A720 E761 S762A717-P759 HydrophobicContact CB-CG 4.12Å; A720-P759 HydrophobicContact CB-CG 3.94Å; P759-E761 PolarHBondContact O-N 2.86Å; P759-E761 VanDerWaalsContact O-N 3.09Å; P759-S762 WeakPolarHBondContact O-CB 3.35Å; P759-S762 PolarHBondContact O-N 3.42Å; P759-S762 PolarHBondContact O-OG 3.42Å
760P89Confident92.3Very high56 Ų5643.3 Ų43.336%0.36422%0.217SC..Hα-helixtrans-50.7-39.2-175.5-30.436.5000114.1S762 I763 T764 R767 Y801P760-S762 VanDerWaalsContact C-N 3.29Å; P760-S762 PolarHBondContact O-N 3.26Å; P760-I763 PolarHBondContact O-N 3.49Å; P760-T764 PolarHBondContact O-N 3.19Å; P760-T764 PolarHBondContact O-OG1 3.46Å; P760-R767 PolarHBondContact O-NH2 3.28Å; P760-Y801 HydrophobicContact CB-CE1 3.92Å; P760-Y801 HydrophobicContact CG-CE1 4.04Å
761E90.1Very high92.4Very high146 Ų14643.4 Ų43.468%0.68222%0.218SC*.Hα-helixtrans-63.8-34-176.6-55.876.9-165.100112.1P759 I763P759-E761 PolarHBondContact O-N 2.86Å; P759-E761 VanDerWaalsContact O-N 3.09Å; E761-I763 VanDerWaalsContact C-N 3.28Å; E761-I763 PolarHBondContact O-N 2.86Å
762S90Very high92.4Very high22 Ų2245.4 Ų45.415%0.15423%0.228CC..Hα-helixtrans-70-24.9-178.470.10000113.3P759 P760P759-S762 WeakPolarHBondContact O-CB 3.35Å; P759-S762 PolarHBondContact O-N 3.42Å; P759-S762 PolarHBondContact O-OG 3.42Å; P760-S762 VanDerWaalsContact C-N 3.29Å; P760-S762 PolarHBondContact O-N 3.26Å
763I89.6Confident92.3Very high1 Ų145.2 Ų45.21%0.00523%0.227CC..Hα-helixtrans-103.9-18.2-177.2-62.8-57.5000112.8I727 I754 I755 M758 P760 E761 Q765 Y766 R767 I770I727-I763 HydrophobicContact CG2-CD1 3.99Å; I754-I763 HydrophobicContact CG2-CD1 3.7Å; I754-I763 HydrophobicContact CG2-CG1 3.84Å; I755-I763 HydrophobicContact CD1-CG2 4.23Å; M758-I763 HydrophobicContact CB-CG1 4.06Å; M758-I763 HydrophobicContact CE-CD1 3.32Å; M758-I763 HydrophobicContact CE-CG1 3.88Å; P760-I763 PolarHBondContact O-N 3.49Å; E761-I763 VanDerWaalsContact C-N 3.28Å; E761-I763 PolarHBondContact O-N 2.86Å; I763-Q765 VanDerWaalsContact C-N 3.32Å; I763-Q765 PolarHBondContact O-N 3.49Å; I763-Q765 VanDerWaalsContact O-N 3.12Å; I763-Y766 PolarHBondContact O-N 2.93Å; I763-R767 HydrophobicContact CG2-CG 3.98Å; I763-R767 WeakPolarHBondContact O-CG 3.37Å; I763-R767 PolarHBondContact O-N 3.23Å; I763-I770 HydrophobicContact CG2-CD1 4.44Å
764T89.2Confident92.4Very high79 Ų7944.8 Ų44.849%0.48522%0.224SC..G310 helixtrans-46.8-47.9-172.9-650000114.1P760 Y766 R767P760-T764 PolarHBondContact O-N 3.19Å; P760-T764 PolarHBondContact O-OG1 3.46Å; T764-Y766 PolarHBondContact O-N 2.96Å; T764-R767 PolarHBondContact O-N 3Å; T764-R767 PolarHBondContact OG1-NH2 2.62Å
765Q90.6Very high92.4Very high146 Ų14645.3 Ų45.368%0.68223%0.226SC*.G310 helixtrans-65.8-21.1-178.265.4-176.7-2100114.3I763I763-Q765 VanDerWaalsContact C-N 3.32Å; I763-Q765 PolarHBondContact O-N 3.49Å; I763-Q765 VanDerWaalsContact O-N 3.12Å
766Y92.8Very high92.3Very high56 Ų5649.9 Ų49.922%0.2225%0.247CC..G310 helixtrans-98.5-15.8-176.2-54.4-67.3000113.5I727 L731 I763 T764 K768 Q769 I770I727-Y766 HydrophobicContact CG2-CD2 4.11Å; I727-Y766 HydrophobicContact CG2-CE2 3.72Å; L731-Y766 HydrophobicContact CD1-CD1 3.75Å; L731-Y766 HydrophobicContact CD1-CD2 3.77Å; L731-Y766 HydrophobicContact CD1-CE1 4.37Å; L731-Y766 HydrophobicContact CD1-CE2 4.38Å; L731-Y766 HydrophobicContact CD1-CG 3.41Å; L731-Y766 VanDerWaalsContact CD1-CG 3.41Å; I763-Y766 PolarHBondContact O-N 2.93Å; T764-Y766 PolarHBondContact O-N 2.96Å; Y766-K768 VanDerWaalsContact C-N 3.31Å; Y766-K768 PolarHBondContact O-N 3.2Å; Y766-Q769 PolarHBondContact O-N 3.08Å; Y766-Q769 VanDerWaalsContact O-N 3.08Å; Y766-I770 WeakPolarHBondContact O-CG1 3.35Å; Y766-I770 PolarHBondContact O-N 3.16Å
767R90.9Very high92.1Very high31 Ų3149.7 Ų49.712%0.11725%0.245CC..Hα-helixtrans-54.7-44-173.9-65-177.8-170.3-178.68.9113.1P760 I763 T764 Q769 I770 F771 I809P760-R767 PolarHBondContact O-NH2 3.28Å; I763-R767 HydrophobicContact CG2-CG 3.98Å; I763-R767 WeakPolarHBondContact O-CG 3.37Å; I763-R767 PolarHBondContact O-N 3.23Å; T764-R767 PolarHBondContact O-N 3Å; T764-R767 PolarHBondContact OG1-NH2 2.62Å; R767-Q769 PolarHBondContact O-N 3.27Å; R767-I770 PolarHBondContact O-N 3.15Å; R767-F771 WeakPolarHBondContact O-CD2 3.16Å; R767-F771 PolarHBondContact O-N 3.37Å; R767-I809 HydrophobicContact CB-CD1 4.27Å
768K93.6Very high91.9Very high96 Ų9648.6 Ų48.642%0.41724%0.238SC..Hα-helixtrans-61.7-44.5179.5-177.6167174.91640111.4Y766 F771 I772 I809 S812 I813Y766-K768 VanDerWaalsContact C-N 3.31Å; Y766-K768 PolarHBondContact O-N 3.2Å; K768-F771 PolarHBondContact O-N 3.45Å; K768-I772 HydrophobicContact CG-CD1 4Å; K768-I772 VanDerWaalsContact O-CG1 3.3Å; K768-I772 WeakPolarHBondContact O-CG1 3.43Å; K768-I772 PolarHBondContact O-N 3.18Å; K768-I809 HydrophobicContact CB-CD1 4.13Å; K768-S812 PolarHBondContact NZ-O 2.87Å; K768-I813 HydrophobicContact CG-CG1 3.96Å
769Q94.5Very high91.7Very high100 Ų10055.5 Ų55.547%0.46727%0.271SS..Hα-helixtrans-66.3-38.4179.2-173.46122.100112.3Y766 R767 F771 I772 L773Y766-Q769 PolarHBondContact O-N 3.08Å; Y766-Q769 VanDerWaalsContact O-N 3.08Å; R767-Q769 PolarHBondContact O-N 3.27Å; Q769-F771 PolarHBondContact O-N 2.97Å; Q769-I772 PolarHBondContact O-N 2.99Å; Q769-L773 WeakPolarHBondContact O-CG 3.46Å; Q769-L773 PolarHBondContact O-N 2.81Å
770I95.3Very high91.2Very high7 Ų757.8 Ų57.84%0.03629%0.287CS..Hα-helixtrans-57.3-51.5176-69.5164.4000110.3L731 F734 L751 I763 Y766 R767 I772 L773 L774 F793L731-I770 HydrophobicContact CD2-CD1 3.94Å; L731-I770 HydrophobicContact CD2-CG1 4.29Å; F734-I770 HydrophobicContact CE1-CG1 4.32Å; F734-I770 HydrophobicContact CE1-CG2 4.23Å; F734-I770 HydrophobicContact CZ-CG2 4.13Å; L751-I770 HydrophobicContact CD1-CD1 4.1Å; L751-I770 HydrophobicContact CD1-CG2 3.84Å; L751-I770 HydrophobicContact CD2-CG2 3.75Å; L751-I770 HydrophobicContact CG-CG2 4.42Å; I763-I770 HydrophobicContact CG2-CD1 4.44Å; Y766-I770 WeakPolarHBondContact O-CG1 3.35Å; Y766-I770 PolarHBondContact O-N 3.16Å; R767-I770 PolarHBondContact O-N 3.15Å; I770-I772 PolarHBondContact O-N 3.49Å; I770-L773 PolarHBondContact O-N 3.19Å; I770-L774 HydrophobicContact CG2-CD1 4.24Å; I770-L774 WeakPolarHBondContact O-CG 3.44Å; I770-L774 PolarHBondContact O-N 3.32Å; I770-L774 VanDerWaalsContact O-N 3.08Å; I770-F793 HydrophobicContact CG2-CZ 4.41Å
771F95.9Very high90.8Very high2 Ų256.4 Ų56.41%0.00928%0.279CS..Hα-helixtrans-66.3-36179.5-80.2-65.5000113R767 K768 Q769 L773 L774 F775 F793 V794 Y797 L806 I809 F810 I813R767-F771 WeakPolarHBondContact O-CD2 3.16Å; R767-F771 PolarHBondContact O-N 3.37Å; K768-F771 PolarHBondContact O-N 3.45Å; Q769-F771 PolarHBondContact O-N 2.97Å; F771-L773 VanDerWaalsContact C-N 3.33Å; F771-L773 PolarHBondContact O-N 3.29Å; F771-L774 HydrophobicContact CD1-CD1 4.13Å; F771-L774 HydrophobicContact CE1-CD1 4.41Å; F771-L774 PolarHBondContact O-N 3.01Å; F771-F775 HydrophobicContact CB-CD2 4.35Å; F771-F775 HydrophobicContact CB-CE2 3.98Å; F771-F775 HydrophobicContact CD1-CZ 4.43Å; F771-F775 WeakPolarHBondContact O-CD2 3.49Å; F771-F775 VanDerWaalsContact O-CG 3.31Å; F771-F775 WeakPolarHBondContact O-CG 3.44Å; F771-F775 PolarHBondContact O-N 3.22Å; F771-F793 HydrophobicContact CD1-CE1 4.31Å; F771-F793 HydrophobicContact CE1-CD1 4.22Å; F771-F793 AromaticContact CE1-CE1 3.51Å; F771-F793 HydrophobicContact CE1-CE1 3.51Å; F771-F793 HydrophobicContact CE1-CZ 4.4Å; F771-F793 AromaticContact CZ-CE1 3.7Å; F771-F793 HydrophobicContact CZ-CE1 3.7Å; F771-F793 HydrophobicContact CZ-CZ 4.17Å; F771-V794 HydrophobicContact CE1-CG2 4.35Å; F771-Y797 HydrophobicContact CE2-CD2 4.01Å; F771-Y797 AromaticContact CE2-CE2 3.84Å; F771-Y797 HydrophobicContact CE2-CE2 3.84Å; F771-Y797 HydrophobicContact CE2-CG 4.46Å; F771-Y797 HydrophobicContact CZ-CD1 4.5Å; F771-Y797 AromaticContact CZ-CD2 3.95Å; F771-Y797 HydrophobicContact CZ-CD2 3.95Å; F771-Y797 HydrophobicContact CZ-CE2 4.25Å; F771-Y797 HydrophobicContact CZ-CG 4.08Å; F771-L806 HydrophobicContact CZ-CD1 4.44Å; F771-I809 HydrophobicContact CD2-CG1 3.77Å; F771-I809 HydrophobicContact CD2-CG2 4.23Å; F771-I809 HydrophobicContact CE2-CG1 4.11Å; F771-I809 HydrophobicContact CE2-CG2 3.92Å; F771-F810 HydrophobicContact CD1-CD1 4.39Å; F771-F810 AromaticContact CD1-CE1 3.54Å; F771-F810 HydrophobicContact CD1-CE1 3.54Å; F771-F810 HydrophobicContact CD1-CZ 4.32Å; F771-F810 HydrophobicContact CD2-CE1 4.44Å; F771-F810 AromaticContact CE1-CE1 3.44Å; F771-F810 HydrophobicContact CE1-CE1 3.44Å; F771-F810 VanDerWaalsContact CE1-CE1 3.44Å; F771-F810 HydrophobicContact CE1-CZ 4.01Å; F771-F810 HydrophobicContact CE2-CE1 4.33Å; F771-F810 HydrophobicContact CG-CE1 4.07Å; F771-F810 AromaticContact CZ-CE1 3.85Å; F771-F810 HydrophobicContact CZ-CE1 3.85Å; F771-I813 HydrophobicContact CB-CD1 3.51Å
772I94.6Very high90.4Very high41 Ų4154.5 Ų54.521%0.2127%0.269CS..Hα-helixtrans-57.3-46.8173.1-71.5167.2000110.8K768 Q769 I770 L774 F775 Q776 I813K768-I772 HydrophobicContact CG-CD1 4Å; K768-I772 VanDerWaalsContact O-CG1 3.3Å; K768-I772 WeakPolarHBondContact O-CG1 3.43Å; K768-I772 PolarHBondContact O-N 3.18Å; Q769-I772 PolarHBondContact O-N 2.99Å; I770-I772 PolarHBondContact O-N 3.49Å; I772-L774 PolarHBondContact O-N 3.47Å; I772-F775 PolarHBondContact O-N 3.45Å; I772-Q776 HydrophobicContact CG2-CG 4.45Å; I772-Q776 WeakPolarHBondContact O-CB 3.48Å; I772-Q776 VanDerWaalsContact O-CG 3.29Å; I772-Q776 WeakPolarHBondContact O-CG 3.35Å; I772-Q776 PolarHBondContact O-N 3.36Å; I772-I813 HydrophobicContact CG1-CD1 4.28Å; I772-I813 HydrophobicContact CG1-CG1 4.22Å; I772-I813 HydrophobicContact CG1-CG2 4.03Å
773L94Very high90.2Very high20 Ų2054 Ų5411%0.10527%0.265CS..Hα-helixtrans-62.7-42.4178.1-69.8171.1000112F734 Q735 Q769 I770 F771 Q776 R777F734-L773 HydrophobicContact CE1-CD1 4.04Å; Q735-L773 HydrophobicContact CB-CD1 4.29Å; Q735-L773 HydrophobicContact CG-CD1 4.03Å; Q735-L773 HydrophobicContact CG-CD2 4.4Å; Q769-L773 WeakPolarHBondContact O-CG 3.46Å; Q769-L773 PolarHBondContact O-N 2.81Å; I770-L773 PolarHBondContact O-N 3.19Å; F771-L773 VanDerWaalsContact C-N 3.33Å; F771-L773 PolarHBondContact O-N 3.29Å; L773-Q776 PolarHBondContact O-N 3.06Å; L773-R777 WeakPolarHBondContact O-CG 3.45Å; L773-R777 PolarHBondContact O-N 3.09Å; L773-R777 VanDerWaalsContact O-N 3.07Å
774L95.3Very high90Very high0 Ų054.8 Ų54.80%027%0.27CS..Hα-helixtrans-62.3-44.2176.9-66.4176000111.9F734 I738 F748 L751 I770 F771 I772 R777 L778 F786 F790 F793F734-L774 HydrophobicContact CE2-CD2 4.21Å; F734-L774 HydrophobicContact CZ-CD2 4.07Å; F734-L774 HydrophobicContact CZ-CG 4.35Å; I738-L774 HydrophobicContact CD1-CD2 3.89Å; I738-L774 HydrophobicContact CG1-CD2 3.84Å; F748-L774 HydrophobicContact CE1-CD1 4.3Å; F748-L774 HydrophobicContact CE1-CD2 3.62Å; F748-L774 HydrophobicContact CZ-CD2 3.62Å; L751-L774 HydrophobicContact CD2-CD1 4.13Å; I770-L774 HydrophobicContact CG2-CD1 4.24Å; I770-L774 WeakPolarHBondContact O-CG 3.44Å; I770-L774 PolarHBondContact O-N 3.32Å; I770-L774 VanDerWaalsContact O-N 3.08Å; F771-L774 HydrophobicContact CD1-CD1 4.13Å; F771-L774 HydrophobicContact CE1-CD1 4.41Å; F771-L774 PolarHBondContact O-N 3.01Å; I772-L774 PolarHBondContact O-N 3.47Å; L774-R777 PolarHBondContact O-N 2.97Å; L774-L778 WeakPolarHBondContact O-CB 3.47Å; L774-L778 PolarHBondContact O-N 3.11Å; L774-F786 HydrophobicContact CD2-CE2 4.47Å; L774-F786 HydrophobicContact CD2-CZ 4.25Å; L774-F786 WeakPolarHBondContact O-CZ 3.46Å; L774-F790 HydrophobicContact CB-CD2 4.26Å; L774-F790 HydrophobicContact CB-CE2 4.06Å; L774-F790 HydrophobicContact CD1-CD2 4.27Å; L774-F790 HydrophobicContact CD1-CE2 4.24Å; L774-F793 HydrophobicContact CD1-CD1 3.66Å; L774-F793 HydrophobicContact CD1-CE1 3.47Å; L774-F793 VanDerWaalsContact CD1-CE1 3.47Å
775F94.1Very high90Very high10 Ų1055.4 Ų55.44%0.04427%0.265CS..Hα-helixtrans-68.1-36.7178-65.4-45000112.8F771 I772 R777 L778 Q779 F790 F810 I813 M817 V821F771-F775 HydrophobicContact CB-CD2 4.35Å; F771-F775 HydrophobicContact CB-CE2 3.98Å; F771-F775 HydrophobicContact CD1-CZ 4.43Å; F771-F775 WeakPolarHBondContact O-CD2 3.49Å; F771-F775 VanDerWaalsContact O-CG 3.31Å; F771-F775 WeakPolarHBondContact O-CG 3.44Å; F771-F775 PolarHBondContact O-N 3.22Å; I772-F775 PolarHBondContact O-N 3.45Å; F775-R777 VanDerWaalsContact C-N 3.34Å; F775-R777 PolarHBondContact O-N 3.11Å; F775-L778 HydrophobicContact CD1-CD2 4.42Å; F775-L778 PolarHBondContact O-N 3.42Å; F775-Q779 WeakPolarHBondContact O-CG 3.42Å; F775-Q779 PolarHBondContact O-N 2.85Å; F775-F790 HydrophobicContact CD1-CZ 4.33Å; F775-F790 HydrophobicContact CE1-CE2 4.27Å; F775-F790 AromaticContact CE1-CZ 3.76Å; F775-F790 HydrophobicContact CE1-CZ 3.76Å; F775-F810 HydrophobicContact CE2-CD1 4.3Å; F775-F810 HydrophobicContact CE2-CE1 4.43Å; F775-F810 AromaticContact CZ-CD1 3.93Å; F775-F810 HydrophobicContact CZ-CD1 3.93Å; F775-F810 HydrophobicContact CZ-CD2 4.42Å; F775-F810 AromaticContact CZ-CE1 3.79Å; F775-F810 HydrophobicContact CZ-CE1 3.79Å; F775-F810 HydrophobicContact CZ-CE2 4.3Å; F775-F810 HydrophobicContact CZ-CG 4.27Å; F775-F810 AromaticContact CZ-CZ 3.97Å; F775-F810 HydrophobicContact CZ-CZ 3.97Å; F775-I813 HydrophobicContact CD2-CD1 4.2Å; F775-I813 HydrophobicContact CE2-CD1 3.83Å; F775-M817 HydrophobicContact CB-CE 4.15Å; F775-M817 HydrophobicContact CD1-CE 3.63Å; F775-M817 HydrophobicContact CD2-CE 3.55Å; F775-M817 HydrophobicContact CE1-CE 3.79Å; F775-M817 HydrophobicContact CE2-CE 3.71Å; F775-M817 HydrophobicContact CE2-CG 4.28Å; F775-M817 HydrophobicContact CG-CE 3.51Å; F775-M817 HydrophobicContact CZ-CE 3.83Å; F775-M817 HydrophobicContact CZ-CG 4.36Å; F775-V821 HydrophobicContact CE1-CG2 3.59Å; F775-V821 HydrophobicContact CZ-CG2 3.9Å
776Q90.9Very high90Very high103 Ų10348.4 Ų48.448%0.48123%0.233SC..Hα-helixtrans-59.9-44.2172.9-76.7173.5-11.400111.5I772 L773 Q779 S780I772-Q776 HydrophobicContact CG2-CG 4.45Å; I772-Q776 WeakPolarHBondContact O-CB 3.48Å; I772-Q776 VanDerWaalsContact O-CG 3.29Å; I772-Q776 WeakPolarHBondContact O-CG 3.35Å; I772-Q776 PolarHBondContact O-N 3.36Å; L773-Q776 PolarHBondContact O-N 3.06Å; Q776-Q779 PolarHBondContact O-N 3.23Å; Q776-S780 WeakPolarHBondContact O-CB 3.5Å; Q776-S780 PolarHBondContact O-N 3.11Å; Q776-S780 PolarHBondContact O-OG 3.26Å
777R87.8Confident90Very high39 Ų3945.9 Ų45.915%0.14722%0.223CC..Hα-helixtrans-66.3-39.1176.6-68.6-62.5-68.6160.6-1.5112.6I738 A739 L773 L774 F775 Q779 S780 S781 F786I738-R777 HydrophobicContact CG1-CG 4.38Å; I738-R777 PolarHBondContact O-NE 3.35Å; A739-R777 PolarHBondContact O-NH1 3.11Å; A739-R777 PolarHBondContact O-NH2 3.25Å; L773-R777 WeakPolarHBondContact O-CG 3.45Å; L773-R777 PolarHBondContact O-N 3.09Å; L773-R777 VanDerWaalsContact O-N 3.07Å; L774-R777 PolarHBondContact O-N 2.97Å; F775-R777 VanDerWaalsContact C-N 3.34Å; F775-R777 PolarHBondContact O-N 3.11Å; R777-Q779 PolarHBondContact O-N 2.95Å; R777-S780 PolarHBondContact O-N 3.47Å; R777-S781 PolarHBondContact NH1-OG 3.35Å; R777-S781 PolarHBondContact NH2-OG 2.9Å; R777-S781 CarbonylContact O-C 3.5Å; R777-S781 PolarHBondContact O-N 3.17Å; R777-S781 VanDerWaalsContact O-N 3.07Å; R777-F786 HydrophobicContact CB-CE2 3.61Å; R777-F786 HydrophobicContact CB-CZ 3.72Å; R777-F786 HydrophobicContact CG-CE2 4.4Å
778L88.6Confident90.1Very high22 Ų2246.4 Ų46.412%0.11523%0.226CC..Hα-helixtrans-61.7-31.5175.6-169.866.2000112.7L774 F775 K782 F786 I787 I825L774-L778 WeakPolarHBondContact O-CB 3.47Å; L774-L778 PolarHBondContact O-N 3.11Å; F775-L778 HydrophobicContact CD1-CD2 4.42Å; F775-L778 PolarHBondContact O-N 3.42Å; L778-K782 HydrophobicContact CD1-CB 4.19Å; L778-K782 HydrophobicContact CD1-CD 4.24Å; L778-F786 HydrophobicContact CB-CE1 4.1Å; L778-F786 HydrophobicContact CD1-CD1 4.24Å; L778-F786 HydrophobicContact CD1-CE1 3.97Å; L778-I787 HydrophobicContact CD1-CG1 4.43Å; L778-I825 HydrophobicContact CD1-CD1 4.2Å; L778-I825 HydrophobicContact CD2-CD1 3.73Å; L778-I825 HydrophobicContact CD2-CG1 3.9Å; L778-I825 HydrophobicContact CG-CD1 4.2Å
779Q86.9Confident90.2Very high153 Ų15342.7 Ų42.772%0.71521%0.213SC*.Hα-helixtrans-83.4-38.5177.3-72.7177.3-2.600113.5F775 Q776 R777F775-Q779 WeakPolarHBondContact O-CG 3.42Å; F775-Q779 PolarHBondContact O-N 2.85Å; Q776-Q779 PolarHBondContact O-N 3.23Å; R777-Q779 PolarHBondContact O-N 2.95Å
780S82.4Confident90.2Very high83 Ų8338 Ų3858%0.5819%0.19SC*.Hα-helixtrans-88.1-42.2-171.261.30000114.2Q776 R777Q776-S780 WeakPolarHBondContact O-CB 3.5Å; Q776-S780 PolarHBondContact O-N 3.11Å; Q776-S780 PolarHBondContact O-OG 3.26Å; R777-S780 PolarHBondContact O-N 3.47Å
781S80.8Confident90.3Very high27 Ų2737.6 Ų37.619%0.18919%0.189CC..  trans-163.274.1-174.968.80000111.7R777R777-S781 PolarHBondContact NH1-OG 3.35Å; R777-S781 PolarHBondContact NH2-OG 2.9Å; R777-S781 CarbonylContact O-C 3.5Å; R777-S781 PolarHBondContact O-N 3.17Å; R777-S781 VanDerWaalsContact O-N 3.07Å
782K80.5Confident90.3Very high106 Ų10638 Ų3846%0.46119%0.191SC..  trans-79138.9177.465.4-173.3-178174.30111.2L778 I787L778-K782 HydrophobicContact CD1-CB 4.19Å; L778-K782 HydrophobicContact CD1-CD 4.24Å; K782-I787 HydrophobicContact CB-CG1 4.47Å; K782-I787 HydrophobicContact CD-CD1 4.13Å; K782-I787 HydrophobicContact CG-CD1 4.4Å
783T85.4Confident90.4Very high12 Ų1236.1 Ų36.17%0.07418%0.181CC..  trans-109158.7169.663.60000108.9K741 D744 K785 F786 I787 E888K741-T783 HydrophobicContact CB-CG2 4.09Å; K741-T783 HydrophobicContact CG-CG2 4.16Å; D744-T783 PolarHBondContact OD2-OG1 3.46Å; T783-K785 PolarHBondContact O-N 3.36Å; T783-F786 WeakPolarHBondContact O-CB 3.42Å; T783-F786 PolarHBondContact O-N 3.21Å; T783-F786 WeakPolarHBondContact OG1-CB 3.11Å; T783-F786 PolarHBondContact OG1-N 2.69Å; T783-I787 WeakPolarHBondContact O-CG1 3.2Å; T783-I787 PolarHBondContact O-N 3.09Å; T783-E888 VanDerWaalsContact CA-OE1 3.29Å; T783-E888 WeakPolarHBondContact CA-OE1 3.21Å; T783-E888 VanDerWaalsContact CB-OE1 3.23Å; T783-E888 WeakPolarHBondContact CB-OE1 3.3Å
784T86.3Confident90.6Very high18 Ų1835.1 Ų35.111%0.1118%0.176CC..Hα-helixtrans-56.8-39.6172.2-68.90000110.3I787 K788 P885 E888T784-I787 PolarHBondContact O-N 2.95Å; T784-K788 HydrophobicContact CG2-CD 4.46Å; T784-K788 WeakPolarHBondContact O-CG 3.31Å; T784-K788 PolarHBondContact O-N 2.97Å; T784-P885 VanDerWaalsContact OG1-CD 3.24Å; T784-P885 WeakPolarHBondContact OG1-CD 3.34Å; T784-E888 WeakPolarHBondContact CB-OE2 3.43Å; T784-E888 PolarHBondContact N-OE1 2.9Å; T784-E888 PolarHBondContact N-OE2 3.45Å; T784-E888 PolarHBondContact OG1-OE2 2.91Å
785K88.6Confident90.7Very high91 Ų9135.1 Ų35.140%0.39618%0.176SC..Hα-helixtrans-62.4-44.6176.6-163.3-176.5-155.4173.80113H745 T783 I787 K788 S789H745-K785 HydrophobicContact CB-CD 3.67Å; H745-K785 VanDerWaalsContact CB-CE 3.43Å; H745-K785 HydrophobicContact CB-CG 3.9Å; H745-K785 WeakPolarHBondContact CD2-CE 3.32Å; H745-K785 PolarHBondContact CD2-NZ 2.97Å; H745-K785 PolarHBondContact CE1-NZ 2.81Å; H745-K785 VanDerWaalsContact ND1-CE 3.29Å; H745-K785 WeakPolarHBondContact ND1-CE 3.42Å; H745-K785 PolarHBondContact ND1-NZ 3.48Å; H745-K785 PolarHBondContact NE2-NZ 2.95Å; T783-K785 PolarHBondContact O-N 3.36Å; K785-I787 VanDerWaalsContact C-N 3.34Å; K785-K788 PolarHBondContact O-N 3.06Å; K785-S789 WeakPolarHBondContact O-CB 3.3Å; K785-S789 PolarHBondContact O-N 3.03Å; K785-S789 PolarHBondContact O-OG 3.37Å
786F92Very high90.8Very high0 Ų034.8 Ų34.80%018%0.175CC..Hα-helixtrans-58.2-47.9174.1-178.4-82000110.6I738 D744 F748 L774 R777 L778 T783 S789 F790I738-F786 HydrophobicContact CD1-CD2 3.98Å; I738-F786 HydrophobicContact CD1-CE2 3.53Å; I738-F786 HydrophobicContact CG1-CE2 3.82Å; D744-F786 HydrophobicContact CB-CD2 4.03Å; F748-F786 AromaticContact CE2-CD2 3.69Å; F748-F786 HydrophobicContact CE2-CD2 3.69Å; F748-F786 AromaticContact CE2-CE2 3.81Å; F748-F786 HydrophobicContact CE2-CE2 3.81Å; F748-F786 HydrophobicContact CE2-CG 4.08Å; F748-F786 HydrophobicContact CE2-CZ 4.29Å; F748-F786 HydrophobicContact CZ-CD2 4.2Å; F748-F786 HydrophobicContact CZ-CE1 4.32Å; F748-F786 AromaticContact CZ-CE2 3.9Å; F748-F786 HydrophobicContact CZ-CE2 3.9Å; F748-F786 AromaticContact CZ-CZ 3.95Å; F748-F786 HydrophobicContact CZ-CZ 3.95Å; L774-F786 HydrophobicContact CD2-CE2 4.47Å; L774-F786 HydrophobicContact CD2-CZ 4.25Å; L774-F786 WeakPolarHBondContact O-CZ 3.46Å; R777-F786 HydrophobicContact CB-CE2 3.61Å; R777-F786 HydrophobicContact CB-CZ 3.72Å; R777-F786 HydrophobicContact CG-CE2 4.4Å; L778-F786 HydrophobicContact CB-CE1 4.1Å; L778-F786 HydrophobicContact CD1-CD1 4.24Å; L778-F786 HydrophobicContact CD1-CE1 3.97Å; T783-F786 WeakPolarHBondContact O-CB 3.42Å; T783-F786 PolarHBondContact O-N 3.21Å; T783-F786 WeakPolarHBondContact OG1-CB 3.11Å; T783-F786 PolarHBondContact OG1-N 2.69Å; F786-S789 PolarHBondContact O-N 3.31Å; F786-F790 HydrophobicContact CD1-CB 4.31Å; F786-F790 HydrophobicContact CE1-CB 4.12Å; F786-F790 HydrophobicContact CE1-CD2 4.44Å; F786-F790 HydrophobicContact CE1-CG 4.38Å; F786-F790 WeakPolarHBondContact O-CB 3.24Å; F786-F790 PolarHBondContact O-N 3.34Å
787I92.2Very high91Very high3 Ų330.1 Ų30.12%0.01515%0.153CC..Hα-helixtrans-60.7-50.6-178.8-66.6168000110.4L778 K782 T783 T784 K785 S789 F790 L791 E829L778-I787 HydrophobicContact CD1-CG1 4.43Å; K782-I787 HydrophobicContact CB-CG1 4.47Å; K782-I787 HydrophobicContact CD-CD1 4.13Å; K782-I787 HydrophobicContact CG-CD1 4.4Å; T783-I787 WeakPolarHBondContact O-CG1 3.2Å; T783-I787 PolarHBondContact O-N 3.09Å; T784-I787 PolarHBondContact O-N 2.95Å; K785-I787 VanDerWaalsContact C-N 3.34Å; I787-S789 VanDerWaalsContact C-N 3.3Å; I787-S789 PolarHBondContact O-N 3.37Å; I787-F790 PolarHBondContact O-N 3.08Å; I787-L791 HydrophobicContact CG2-CD1 3.92Å; I787-L791 HydrophobicContact CG2-CG 4.42Å; I787-L791 VanDerWaalsContact O-CG 3.25Å; I787-L791 WeakPolarHBondContact O-CG 3.47Å; I787-L791 PolarHBondContact O-N 3.26Å; I787-E829 HydrophobicContact CG2-CB 3.62Å; I787-E829 HydrophobicContact CG2-CG 3.9Å
788K92.9Very high91.4Very high42 Ų4228.3 Ų28.318%0.18315%0.146CC..Hα-helixtrans-54.7-47.8177.5-68.5-174.4-168.7-142.10111.2T784 K785 L791 V792 K832T784-K788 HydrophobicContact CG2-CD 4.46Å; T784-K788 WeakPolarHBondContact O-CG 3.31Å; T784-K788 PolarHBondContact O-N 2.97Å; K785-K788 PolarHBondContact O-N 3.06Å; K788-L791 PolarHBondContact O-N 3.29Å; K788-V792 WeakPolarHBondContact O-CG2 3.36Å; K788-V792 PolarHBondContact O-N 3.31Å; K788-K832 WeakPolarHBondContact CD-O 3.39Å; K788-K832 WeakPolarHBondContact CE-O 3.48Å; K788-K832 HydrophobicContact CG-CB 4.21Å; K788-K832 WeakPolarHBondContact CG-O 3.48Å; K788-K832 PolarHBondContact NZ-O 3.22Å
789S94.4Very high91.7Very high18 Ų1828.2 Ų28.213%0.12615%0.146CC..Hα-helixtrans-71.4-34.7-178.2-63.60000113.2F748 K785 F786 I787 V792 F793F748-S789 VanDerWaalsContact CG-CB 3.48Å; K785-S789 WeakPolarHBondContact O-CB 3.3Å; K785-S789 PolarHBondContact O-N 3.03Å; K785-S789 PolarHBondContact O-OG 3.37Å; F786-S789 PolarHBondContact O-N 3.31Å; I787-S789 VanDerWaalsContact C-N 3.3Å; I787-S789 PolarHBondContact O-N 3.37Å; S789-V792 PolarHBondContact O-N 3.01Å; S789-F793 WeakPolarHBondContact O-CB 3.24Å; S789-F793 PolarHBondContact O-N 3.46Å
790F96.3Very high91.9Very high0 Ų024.7 Ų24.70%013%0.129CC..Hα-helixtrans-62.4-45.2173.5176.8-101.3000111.6F748 L774 F775 F786 I787 V792 F793 V794 V821 I825F748-F790 HydrophobicContact CE1-CB 4.09Å; F748-F790 HydrophobicContact CE1-CD2 4.29Å; F748-F790 HydrophobicContact CE2-CB 4.49Å; F748-F790 HydrophobicContact CZ-CB 3.67Å; F748-F790 HydrophobicContact CZ-CD2 4.22Å; F748-F790 HydrophobicContact CZ-CG 4.47Å; L774-F790 HydrophobicContact CB-CD2 4.26Å; L774-F790 HydrophobicContact CB-CE2 4.06Å; L774-F790 HydrophobicContact CD1-CD2 4.27Å; L774-F790 HydrophobicContact CD1-CE2 4.24Å; F775-F790 HydrophobicContact CD1-CZ 4.33Å; F775-F790 HydrophobicContact CE1-CE2 4.27Å; F775-F790 AromaticContact CE1-CZ 3.76Å; F775-F790 HydrophobicContact CE1-CZ 3.76Å; F786-F790 HydrophobicContact CD1-CB 4.31Å; F786-F790 HydrophobicContact CE1-CB 4.12Å; F786-F790 HydrophobicContact CE1-CD2 4.44Å; F786-F790 HydrophobicContact CE1-CG 4.38Å; F786-F790 WeakPolarHBondContact O-CB 3.24Å; F786-F790 PolarHBondContact O-N 3.34Å; I787-F790 PolarHBondContact O-N 3.08Å; F790-V792 PolarHBondContact O-N 3.19Å; F790-F793 PolarHBondContact O-N 3.22Å; F790-V794 HydrophobicContact CD1-CG2 4.25Å; F790-V794 HydrophobicContact CD2-CG2 4.2Å; F790-V794 HydrophobicContact CE1-CG2 3.78Å; F790-V794 HydrophobicContact CE2-CG2 3.72Å; F790-V794 HydrophobicContact CG-CG2 4.43Å; F790-V794 HydrophobicContact CZ-CG2 3.48Å; F790-V794 VanDerWaalsContact CZ-CG2 3.48Å; F790-V794 WeakPolarHBondContact O-CG2 3.17Å; F790-V794 PolarHBondContact O-N 2.91Å; F790-V821 HydrophobicContact CE1-CG1 4.25Å; F790-V821 HydrophobicContact CZ-CG1 4.43Å; F790-I825 HydrophobicContact CD1-CG2 4.1Å; F790-I825 HydrophobicContact CE1-CG2 4.05Å
791L96.4Very high92.5Very high0 Ų023 Ų230%011%0.11CC..Hα-helixtrans-60.7-44.6177.3-68.5165.9000111.5I787 K788 N795 I825 I826 E829 V833I787-L791 HydrophobicContact CG2-CD1 3.92Å; I787-L791 HydrophobicContact CG2-CG 4.42Å; I787-L791 VanDerWaalsContact O-CG 3.25Å; I787-L791 WeakPolarHBondContact O-CG 3.47Å; I787-L791 PolarHBondContact O-N 3.26Å; K788-L791 PolarHBondContact O-N 3.29Å; L791-N795 WeakPolarHBondContact O-CB 3.45Å; L791-N795 PolarHBondContact O-N 3.34Å; L791-N795 VanDerWaalsContact O-N 3.16Å; L791-N795 PolarHBondContact O-ND2 3.35Å; L791-I825 HydrophobicContact CD2-CG2 4.26Å; L791-I826 HydrophobicContact CD2-CB 4.27Å; L791-I826 HydrophobicContact CD2-CG1 3.83Å; L791-E829 HydrophobicContact CD1-CB 3.96Å; L791-E829 WeakPolarHBondContact CD1-O 3.36Å; L791-V833 HydrophobicContact CB-CG2 3.93Å; L791-V833 HydrophobicContact CD1-CG2 3.77Å
792V96.4Very high93.1Very high9 Ų922.5 Ų22.56%0.05511%0.109CC..Hα-helixtrans-61.7-46.6175.5174.80000110.7K788 S789 F790 N795 L796 V833 E838 I841K788-V792 WeakPolarHBondContact O-CG2 3.36Å; K788-V792 PolarHBondContact O-N 3.31Å; S789-V792 PolarHBondContact O-N 3.01Å; F790-V792 PolarHBondContact O-N 3.19Å; V792-N795 PolarHBondContact O-N 2.83Å; V792-L796 VanDerWaalsContact O-CB 3.31Å; V792-L796 WeakPolarHBondContact O-CB 3.41Å; V792-L796 PolarHBondContact O-N 3.11Å; V792-V833 HydrophobicContact CG2-CG1 4.07Å; V792-E838 HydrophobicContact CG1-CG 4.43Å; V792-E838 HydrophobicContact CG2-CB 3.71Å; V792-E838 HydrophobicContact CG2-CG 3.84Å; V792-I841 HydrophobicContact CG1-CD1 4.02Å; V792-I841 HydrophobicContact CG1-CG2 4.21Å
793F97.1Very high93.8Very high2 Ų217.5 Ų17.51%0.0099%0.088CC..Hα-helixtrans-61.9-47.1-179.9171.5-109.4000113.1F748 L751 N752 I755 I770 F771 L774 S789 F790 N795 L796 Y797F748-F793 HydrophobicContact CD1-CB 3.73Å; F748-F793 HydrophobicContact CD1-CG 4.18Å; F748-F793 HydrophobicContact CE1-CB 3.97Å; F748-F793 HydrophobicContact CE1-CD1 4.33Å; F748-F793 HydrophobicContact CE1-CG 4.31Å; L751-F793 HydrophobicContact CB-CE2 4.41Å; L751-F793 HydrophobicContact CD1-CE2 4.33Å; L751-F793 HydrophobicContact CD1-CZ 4.4Å; L751-F793 HydrophobicContact CD2-CD1 4Å; L751-F793 HydrophobicContact CD2-CD2 3.76Å; L751-F793 HydrophobicContact CD2-CE1 3.64Å; L751-F793 HydrophobicContact CD2-CE2 3.41Å; L751-F793 VanDerWaalsContact CD2-CE2 3.41Å; L751-F793 HydrophobicContact CD2-CG 4.06Å; L751-F793 HydrophobicContact CD2-CZ 3.34Å; L751-F793 HydrophobicContact CG-CD2 3.9Å; L751-F793 HydrophobicContact CG-CE2 3.39Å; L751-F793 HydrophobicContact CG-CZ 3.74Å; N752-F793 WeakPolarHBondContact OD1-CD2 3.42Å; I755-F793 HydrophobicContact CG1-CE2 3.67Å; I755-F793 HydrophobicContact CG1-CZ 4.27Å; I770-F793 HydrophobicContact CG2-CZ 4.41Å; F771-F793 HydrophobicContact CD1-CE1 4.31Å; F771-F793 HydrophobicContact CE1-CD1 4.22Å; F771-F793 AromaticContact CE1-CE1 3.51Å; F771-F793 HydrophobicContact CE1-CE1 3.51Å; F771-F793 HydrophobicContact CE1-CZ 4.4Å; F771-F793 AromaticContact CZ-CE1 3.7Å; F771-F793 HydrophobicContact CZ-CE1 3.7Å; F771-F793 HydrophobicContact CZ-CZ 4.17Å; L774-F793 HydrophobicContact CD1-CD1 3.66Å; L774-F793 HydrophobicContact CD1-CE1 3.47Å; L774-F793 VanDerWaalsContact CD1-CE1 3.47Å; S789-F793 WeakPolarHBondContact O-CB 3.24Å; S789-F793 PolarHBondContact O-N 3.46Å; F790-F793 PolarHBondContact O-N 3.22Å; F793-N795 VanDerWaalsContact C-N 3.31Å; F793-N795 PolarHBondContact O-N 3.42Å; F793-L796 PolarHBondContact O-N 3.04Å; F793-Y797 WeakPolarHBondContact O-CB 3.29Å; F793-Y797 PolarHBondContact O-N 2.98Å
794V97.2Very high94.3Very high0 Ų020.9 Ų20.90%010%0.104CC..Hα-helixtrans-61-42.9179.5169.40000111.1F771 F790 Y797 C798 L806 F810 I826F771-V794 HydrophobicContact CE1-CG2 4.35Å; F790-V794 HydrophobicContact CD1-CG2 4.25Å; F790-V794 HydrophobicContact CD2-CG2 4.2Å; F790-V794 HydrophobicContact CE1-CG2 3.78Å; F790-V794 HydrophobicContact CE2-CG2 3.72Å; F790-V794 HydrophobicContact CG-CG2 4.43Å; F790-V794 HydrophobicContact CZ-CG2 3.48Å; F790-V794 VanDerWaalsContact CZ-CG2 3.48Å; F790-V794 WeakPolarHBondContact O-CG2 3.17Å; F790-V794 PolarHBondContact O-N 2.91Å; V794-Y797 WeakPolarHBondContact O-CB 3.35Å; V794-Y797 PolarHBondContact O-N 2.88Å; V794-C798 PolarHBondContact O-N 2.99Å; V794-L806 HydrophobicContact CG1-CD1 4.06Å; V794-L806 HydrophobicContact CG1-CD2 3.81Å; V794-F810 HydrophobicContact CG1-CE2 4.38Å; V794-F810 HydrophobicContact CG1-CZ 4.01Å; V794-F810 HydrophobicContact CG2-CZ 4.06Å; V794-I826 HydrophobicContact CG1-CD1 4.08Å
795N96.9Very high94.7Very high0 Ų021.2 Ų21.20%011%0.109CC..Hα-helixtrans-71-37.1177.8-75.9-67.5000112.1L791 V792 F793 Y797 C798 V799 I841 I846L791-N795 WeakPolarHBondContact O-CB 3.45Å; L791-N795 PolarHBondContact O-N 3.34Å; L791-N795 VanDerWaalsContact O-N 3.16Å; L791-N795 PolarHBondContact O-ND2 3.35Å; V792-N795 PolarHBondContact O-N 2.83Å; F793-N795 VanDerWaalsContact C-N 3.31Å; F793-N795 PolarHBondContact O-N 3.42Å; N795-Y797 VanDerWaalsContact C-N 3.34Å; N795-Y797 PolarHBondContact O-N 3.22Å; N795-C798 WeakPolarHBondContact O-CB 3.04Å; N795-C798 PolarHBondContact O-N 3.41Å; N795-V799 VanDerWaalsContact O-CG2 3.27Å; N795-V799 WeakPolarHBondContact O-CG2 3.43Å; N795-V799 PolarHBondContact O-N 2.94Å; N795-I841 HydrophobicContact CB-CG2 4.19Å; N795-I846 WeakPolarHBondContact OD1-CG1 3.31Å; N795-I846 PolarHBondContact OD1-N 3.5Å
796L96Very high95Very high3 Ų316.9 Ų16.92%0.0169%0.09CC..Hα-helixtrans-61.5-42.7172.4-17761.1000111.7N752 V792 F793 C798 V799 K800 I841 P916N752-L796 HydrophobicContact CB-CD2 3.7Å; V792-L796 VanDerWaalsContact O-CB 3.31Å; V792-L796 WeakPolarHBondContact O-CB 3.41Å; V792-L796 PolarHBondContact O-N 3.11Å; F793-L796 PolarHBondContact O-N 3.04Å; L796-C798 VanDerWaalsContact C-N 3.33Å; L796-C798 PolarHBondContact O-N 3.33Å; L796-V799 WeakPolarHBondContact O-CB 3.35Å; L796-V799 PolarHBondContact O-N 3.49Å; L796-K800 HydrophobicContact CD1-CG 4.28Å; L796-K800 WeakPolarHBondContact O-CG 3.48Å; L796-K800 PolarHBondContact O-N 3.24Å; L796-I841 HydrophobicContact CB-CG2 3.85Å; L796-I841 HydrophobicContact CD1-CG2 4.46Å; L796-P916 HydrophobicContact CD1-CB 3.86Å; L796-P916 HydrophobicContact CD1-CG 3.75Å
797Y96Very high95.2Very high5 Ų518.8 Ų18.82%0.0210%0.099CC..Hα-helixtrans-58.4-45.9173.9-174.8-79000111F771 F793 V794 N795 V799 K800 Y801 L806 I809F771-Y797 HydrophobicContact CE2-CD2 4.01Å; F771-Y797 AromaticContact CE2-CE2 3.84Å; F771-Y797 HydrophobicContact CE2-CE2 3.84Å; F771-Y797 HydrophobicContact CE2-CG 4.46Å; F771-Y797 HydrophobicContact CZ-CD1 4.5Å; F771-Y797 AromaticContact CZ-CD2 3.95Å; F771-Y797 HydrophobicContact CZ-CD2 3.95Å; F771-Y797 HydrophobicContact CZ-CE2 4.25Å; F771-Y797 HydrophobicContact CZ-CG 4.08Å; F793-Y797 WeakPolarHBondContact O-CB 3.29Å; F793-Y797 PolarHBondContact O-N 2.98Å; V794-Y797 WeakPolarHBondContact O-CB 3.35Å; V794-Y797 PolarHBondContact O-N 2.88Å; N795-Y797 VanDerWaalsContact C-N 3.34Å; N795-Y797 PolarHBondContact O-N 3.22Å; Y797-V799 VanDerWaalsContact C-N 3.33Å; Y797-V799 PolarHBondContact O-N 3.3Å; Y797-K800 PolarHBondContact O-N 3.16Å; Y797-Y801 HydrophobicContact CD1-CD2 4.05Å; Y797-Y801 AromaticContact CD2-CD2 3.57Å; Y797-Y801 HydrophobicContact CD2-CD2 3.57Å; Y797-Y801 AromaticContact CD2-CE2 3.8Å; Y797-Y801 HydrophobicContact CD2-CE2 3.8Å; Y797-Y801 AromaticContact CE1-CD2 3.89Å; Y797-Y801 HydrophobicContact CE1-CD2 3.89Å; Y797-Y801 HydrophobicContact CE1-CG 4.45Å; Y797-Y801 AromaticContact CE2-CD2 3.4Å; Y797-Y801 HydrophobicContact CE2-CD2 3.4Å; Y797-Y801 VanDerWaalsContact CE2-CD2 3.4Å; Y797-Y801 AromaticContact CE2-CE2 3.63Å; Y797-Y801 HydrophobicContact CE2-CE2 3.63Å; Y797-Y801 AromaticContact CG-CD2 3.9Å; Y797-Y801 HydrophobicContact CG-CD2 3.9Å; Y797-Y801 AromaticContact CZ-CD2 3.57Å; Y797-Y801 PolarHBondContact O-N 3.42Å; Y797-L806 HydrophobicContact CD1-CB 4.2Å; Y797-L806 HydrophobicContact CD1-CD1 3.79Å; Y797-L806 HydrophobicContact CE1-CB 4.39Å; Y797-L806 HydrophobicContact CE1-CD1 4.31Å; Y797-I809 HydrophobicContact CE1-CG2 4.12Å
798C96Very high95.3Very high0 Ų024.2 Ų24.20%012%0.124CC..Hα-helixtrans-61.3-40.2175.2-171.80000112.4V794 N795 L796 G802 A803 L806V794-C798 PolarHBondContact O-N 2.99Å; N795-C798 WeakPolarHBondContact O-CB 3.04Å; N795-C798 PolarHBondContact O-N 3.41Å; L796-C798 VanDerWaalsContact C-N 3.33Å; L796-C798 PolarHBondContact O-N 3.33Å; C798-G802 CarbonylContact O-C 3.55Å; C798-G802 WeakPolarHBondContact O-CA 3.43Å; C798-G802 PolarHBondContact O-N 2.97Å; C798-A803 VanDerWaalsContact SG-CA 3.56Å; C798-L806 HydrophobicContact CB-CD2 3.93Å
799V94.5Very high95.4Very high21 Ų2123.2 Ų23.213%0.12712%0.121CC..Hα-helixtrans-62-46.5178.2168.60000110.7N795 L796 Y797 V844 K848 I917N795-V799 VanDerWaalsContact O-CG2 3.27Å; N795-V799 WeakPolarHBondContact O-CG2 3.43Å; N795-V799 PolarHBondContact O-N 2.94Å; L796-V799 WeakPolarHBondContact O-CB 3.35Å; L796-V799 PolarHBondContact O-N 3.49Å; Y797-V799 VanDerWaalsContact C-N 3.33Å; Y797-V799 PolarHBondContact O-N 3.3Å; V799-V844 HydrophobicContact CG2-CB 4.1Å; V799-V844 HydrophobicContact CG2-CG1 3.86Å; V799-K848 PolarHBondContact O-NZ 2.87Å; V799-I917 HydrophobicContact CG1-CG1 4.12Å
800K92.7Very high95.4Very high79 Ų7922.4 Ų22.434%0.34312%0.115SC..Hα-helixtrans-79.7-42.6-174.8-64.7-69.4-172.8-178.90113.7I755 E756 L796 Y797 P916I755-K800 HydrophobicContact CG2-CB 4.33Å; I755-K800 HydrophobicContact CG2-CG 4.34Å; E756-K800 IonicContact OE1-NZ 3.7Å; E756-K800 PolarHBondContact OE1-NZ 2.77Å; L796-K800 HydrophobicContact CD1-CG 4.28Å; L796-K800 WeakPolarHBondContact O-CG 3.48Å; L796-K800 PolarHBondContact O-N 3.24Å; Y797-K800 PolarHBondContact O-N 3.16Å; K800-P916 PolarHBondContact NZ-O 3.49Å
801Y93.3Very high95.3Very high47 Ų4724 Ų2418%0.18412%0.123CC..Hα-helixtrans-105.8-10.1-176-59.9-59.5000114.9I755 P760 Y797 A805I755-Y801 HydrophobicContact CD1-CE2 4.04Å; I755-Y801 HydrophobicContact CG2-CD2 4.38Å; I755-Y801 HydrophobicContact CG2-CE2 3.63Å; P760-Y801 HydrophobicContact CB-CE1 3.92Å; P760-Y801 HydrophobicContact CG-CE1 4.04Å; Y797-Y801 HydrophobicContact CD1-CD2 4.05Å; Y797-Y801 AromaticContact CD2-CD2 3.57Å; Y797-Y801 HydrophobicContact CD2-CD2 3.57Å; Y797-Y801 AromaticContact CD2-CE2 3.8Å; Y797-Y801 HydrophobicContact CD2-CE2 3.8Å; Y797-Y801 AromaticContact CE1-CD2 3.89Å; Y797-Y801 HydrophobicContact CE1-CD2 3.89Å; Y797-Y801 HydrophobicContact CE1-CG 4.45Å; Y797-Y801 AromaticContact CE2-CD2 3.4Å; Y797-Y801 HydrophobicContact CE2-CD2 3.4Å; Y797-Y801 VanDerWaalsContact CE2-CD2 3.4Å; Y797-Y801 AromaticContact CE2-CE2 3.63Å; Y797-Y801 HydrophobicContact CE2-CE2 3.63Å; Y797-Y801 AromaticContact CG-CD2 3.9Å; Y797-Y801 HydrophobicContact CG-CD2 3.9Å; Y797-Y801 AromaticContact CZ-CD2 3.57Å; Y797-Y801 PolarHBondContact O-N 3.42Å; Y801-A805 WeakPolarHBondContact O-CB 3.42Å
802G94.6Very high95.2Very high17 Ų1726.6 Ų26.618%0.17514%0.141CC..  trans93.6159.9179.800000114.2C798 I804 A805 L806C798-G802 CarbonylContact O-C 3.55Å; C798-G802 WeakPolarHBondContact O-CA 3.43Å; C798-G802 PolarHBondContact O-N 2.97Å; G802-I804 PolarHBondContact O-N 3.48Å; G802-A805 PolarHBondContact O-N 3.08Å; G802-L806 PolarHBondContact O-N 3.43Å
803A95.1Very high95.1Very high1 Ų128.3 Ų28.31%0.00815%0.15CC..Hα-helixtrans-70.4-30.8-175.400000113.5C798 L806 Q807 I849 E852 C853C798-A803 VanDerWaalsContact SG-CA 3.56Å; A803-L806 PolarHBondContact O-N 3.38Å; A803-Q807 PolarHBondContact O-N 2.87Å; A803-I849 HydrophobicContact CB-CG1 4.39Å; A803-E852 HydrophobicContact CB-CB 4.46Å; A803-C853 HydrophobicContact CB-CB 3.86Å
804I95.1Very high94.9Very high83 Ų8333 Ų3343%0.42617%0.172SC..Hα-helixtrans-64.7-49175.5-61.6172.9000109.9G802 L806 Q807 E808G802-I804 PolarHBondContact O-N 3.48Å; I804-L806 PolarHBondContact O-N 2.96Å; I804-Q807 PolarHBondContact O-N 3.19Å; I804-Q807 VanDerWaalsContact O-N 3.1Å; I804-E808 HydrophobicContact CG2-CG 4.25Å; I804-E808 WeakPolarHBondContact O-CG 3.32Å; I804-E808 PolarHBondContact O-N 3Å
805A94.4Very high94.6Very high25 Ų2538.1 Ų38.121%0.20721%0.205CC..Hα-helixtrans-60-36178.300000112.3Y801 G802 I809Y801-A805 WeakPolarHBondContact O-CB 3.42Å; G802-A805 PolarHBondContact O-N 3.08Å; A805-I809 WeakPolarHBondContact O-CB 3.16Å; A805-I809 VanDerWaalsContact O-CG2 3.28Å; A805-I809 WeakPolarHBondContact O-CG2 3.36Å; A805-I809 PolarHBondContact O-N 3.12Å
806L95.5Very high94.3Very high0 Ų043.6 Ų43.60%023%0.229CC..Hα-helixtrans-66-43.4174.7-178.265.4000112.3F771 V794 Y797 C798 G802 A803 I804 I809 F810 F818 I849F771-L806 HydrophobicContact CZ-CD1 4.44Å; V794-L806 HydrophobicContact CG1-CD1 4.06Å; V794-L806 HydrophobicContact CG1-CD2 3.81Å; Y797-L806 HydrophobicContact CD1-CB 4.2Å; Y797-L806 HydrophobicContact CD1-CD1 3.79Å; Y797-L806 HydrophobicContact CE1-CB 4.39Å; Y797-L806 HydrophobicContact CE1-CD1 4.31Å; C798-L806 HydrophobicContact CB-CD2 3.93Å; G802-L806 PolarHBondContact O-N 3.43Å; A803-L806 PolarHBondContact O-N 3.38Å; I804-L806 PolarHBondContact O-N 2.96Å; L806-I809 HydrophobicContact CD1-CG2 4.4Å; L806-I809 VanDerWaalsContact O-CG2 3.27Å; L806-I809 WeakPolarHBondContact O-CG2 3.46Å; L806-F810 HydrophobicContact CD1-CD1 4.19Å; L806-F810 HydrophobicContact CD1-CE1 3.61Å; L806-F810 HydrophobicContact CD1-CE2 4.08Å; L806-F810 HydrophobicContact CD1-CZ 3.56Å; L806-F810 HydrophobicContact CG-CE2 4.42Å; L806-F810 HydrophobicContact CG-CZ 4.38Å; L806-F810 PolarHBondContact O-N 2.95Å; L806-F818 HydrophobicContact CD2-CE2 4.29Å; L806-F818 HydrophobicContact CG-CE2 4.32Å; L806-I849 HydrophobicContact CD2-CD1 3.94Å; L806-I849 HydrophobicContact CD2-CG1 4.38Å
807Q95.3Very high94.2Very high40 Ų4043.8 Ų43.819%0.18723%0.23CC..Hα-helixtrans-64.9-47177177.1-86.9-44.700111.2A803 I804 I809 F810 D811 F818 A855A803-Q807 PolarHBondContact O-N 2.87Å; I804-Q807 PolarHBondContact O-N 3.19Å; I804-Q807 VanDerWaalsContact O-N 3.1Å; Q807-I809 PolarHBondContact O-N 3.5Å; Q807-F810 PolarHBondContact O-N 3.21Å; Q807-D811 PolarHBondContact NE2-OD2 3.39Å; Q807-D811 WeakPolarHBondContact O-CB 3.44Å; Q807-D811 PolarHBondContact O-N 3.48Å; Q807-F818 HydrophobicContact CB-CD1 4.14Å; Q807-F818 HydrophobicContact CB-CD2 3.95Å; Q807-F818 HydrophobicContact CB-CE1 4.23Å; Q807-F818 HydrophobicContact CB-CE2 4.07Å; Q807-F818 HydrophobicContact CB-CG 3.98Å; Q807-F818 HydrophobicContact CB-CZ 4.19Å; Q807-F818 HydrophobicContact CG-CB 4.16Å; Q807-F818 HydrophobicContact CG-CD1 3.75Å; Q807-F818 HydrophobicContact CG-CD2 4.32Å; Q807-F818 HydrophobicContact CG-CE1 4.17Å; Q807-F818 HydrophobicContact CG-CG 3.81Å; Q807-A855 HydrophobicContact CG-CB 4.3Å
808E94.2Very high94.1Very high117 Ų11743.6 Ų43.655%0.54723%0.229SC..Hα-helixtrans-59.8-44.8179-72.5177.9167.700112.1I804 F810 S812I804-E808 HydrophobicContact CG2-CG 4.25Å; I804-E808 WeakPolarHBondContact O-CG 3.32Å; I804-E808 PolarHBondContact O-N 3Å; E808-F810 PolarHBondContact O-N 3.32Å; E808-S812 WeakPolarHBondContact O-CB 3.27Å; E808-S812 PolarHBondContact O-N 3.02Å
809I95.4Very high94Very high21 Ų2143.9 Ų43.911%0.10823%0.232CC..Hα-helixtrans-66.7-39.9-179-168.662.2000111.8R767 K768 F771 Y797 A805 L806 Q807 S812R767-I809 HydrophobicContact CB-CD1 4.27Å; K768-I809 HydrophobicContact CB-CD1 4.13Å; F771-I809 HydrophobicContact CD2-CG1 3.77Å; F771-I809 HydrophobicContact CD2-CG2 4.23Å; F771-I809 HydrophobicContact CE2-CG1 4.11Å; F771-I809 HydrophobicContact CE2-CG2 3.92Å; Y797-I809 HydrophobicContact CE1-CG2 4.12Å; A805-I809 WeakPolarHBondContact O-CB 3.16Å; A805-I809 VanDerWaalsContact O-CG2 3.28Å; A805-I809 WeakPolarHBondContact O-CG2 3.36Å; A805-I809 PolarHBondContact O-N 3.12Å; L806-I809 HydrophobicContact CD1-CG2 4.4Å; L806-I809 VanDerWaalsContact O-CG2 3.27Å; L806-I809 WeakPolarHBondContact O-CG2 3.46Å; Q807-I809 PolarHBondContact O-N 3.5Å; I809-S812 PolarHBondContact O-N 2.87Å; I809-S812 PolarHBondContact O-OG 3.13Å
810F95.3Very high94Very high1 Ų146.6 Ų46.60%0.00424%0.244CC..Hα-helixtrans-65.6-50.2177-76.49.1000111F771 F775 V794 L806 Q807 E808 S812 I813 Q814 M817 F818 V821F771-F810 HydrophobicContact CD1-CD1 4.39Å; F771-F810 AromaticContact CD1-CE1 3.54Å; F771-F810 HydrophobicContact CD1-CE1 3.54Å; F771-F810 HydrophobicContact CD1-CZ 4.32Å; F771-F810 HydrophobicContact CD2-CE1 4.44Å; F771-F810 AromaticContact CE1-CE1 3.44Å; F771-F810 HydrophobicContact CE1-CE1 3.44Å; F771-F810 VanDerWaalsContact CE1-CE1 3.44Å; F771-F810 HydrophobicContact CE1-CZ 4.01Å; F771-F810 HydrophobicContact CE2-CE1 4.33Å; F771-F810 HydrophobicContact CG-CE1 4.07Å; F771-F810 AromaticContact CZ-CE1 3.85Å; F771-F810 HydrophobicContact CZ-CE1 3.85Å; F775-F810 HydrophobicContact CE2-CD1 4.3Å; F775-F810 HydrophobicContact CE2-CE1 4.43Å; F775-F810 AromaticContact CZ-CD1 3.93Å; F775-F810 HydrophobicContact CZ-CD1 3.93Å; F775-F810 HydrophobicContact CZ-CD2 4.42Å; F775-F810 AromaticContact CZ-CE1 3.79Å; F775-F810 HydrophobicContact CZ-CE1 3.79Å; F775-F810 HydrophobicContact CZ-CE2 4.3Å; F775-F810 HydrophobicContact CZ-CG 4.27Å; F775-F810 AromaticContact CZ-CZ 3.97Å; F775-F810 HydrophobicContact CZ-CZ 3.97Å; V794-F810 HydrophobicContact CG1-CE2 4.38Å; V794-F810 HydrophobicContact CG1-CZ 4.01Å; V794-F810 HydrophobicContact CG2-CZ 4.06Å; L806-F810 HydrophobicContact CD1-CD1 4.19Å; L806-F810 HydrophobicContact CD1-CE1 3.61Å; L806-F810 HydrophobicContact CD1-CE2 4.08Å; L806-F810 HydrophobicContact CD1-CZ 3.56Å; L806-F810 HydrophobicContact CG-CE2 4.42Å; L806-F810 HydrophobicContact CG-CZ 4.38Å; L806-F810 PolarHBondContact O-N 2.95Å; Q807-F810 PolarHBondContact O-N 3.21Å; E808-F810 PolarHBondContact O-N 3.32Å; F810-S812 PolarHBondContact O-N 2.85Å; F810-I813 WeakPolarHBondContact O-CB 3.39Å; F810-I813 PolarHBondContact O-N 3.15Å; F810-Q814 PolarHBondContact O-N 3.17Å; F810-M817 HydrophobicContact CB-CB 4.29Å; F810-M817 HydrophobicContact CB-CG 4.39Å; F810-M817 WeakPolarHBondContact O-CB 3.38Å; F810-F818 HydrophobicContact CB-CB 4.07Å; F810-F818 HydrophobicContact CD2-CB 4.49Å; F810-F818 AromaticContact CD2-CD2 3.91Å; F810-F818 HydrophobicContact CD2-CD2 3.91Å; F810-V821 HydrophobicContact CD2-CB 4.2Å; F810-V821 HydrophobicContact CD2-CG1 4.47Å; F810-V821 HydrophobicContact CD2-CG2 4.19Å; F810-V821 HydrophobicContact CE2-CB 3.97Å; F810-V821 HydrophobicContact CE2-CG1 3.76Å; F810-V821 HydrophobicContact CE2-CG2 4.15Å
811D93.4Very high94.1Very high32 Ų3242.9 Ų42.917%0.17123%0.228CC..Hα-helixtrans-70.9-20.6-177.7-72.8-18.1000112.7Q807 I813 Q814 K816 M817 F818 Y861Q807-D811 PolarHBondContact NE2-OD2 3.39Å; Q807-D811 WeakPolarHBondContact O-CB 3.44Å; Q807-D811 PolarHBondContact O-N 3.48Å; D811-I813 VanDerWaalsContact C-N 3.28Å; D811-I813 PolarHBondContact O-N 3.28Å; D811-Q814 WeakPolarHBondContact CA-O 3.43Å; D811-Q814 CarbonylContact O-C 3.33Å; D811-K816 WeakPolarHBondContact OD1-CA 3.32Å; D811-K816 PolarHBondContact OD1-N 3.41Å; D811-M817 PolarHBondContact OD1-N 3.38Å; D811-F818 WeakPolarHBondContact OD1-CB 3.47Å; D811-F818 PolarHBondContact OD1-N 2.96Å; D811-Y861 PolarHBondContact OD1-OH 3.34Å; D811-Y861 PolarHBondContact OD2-OH 3.03Å
812S94.5Very high94.2Very high55 Ų5540.7 Ų40.739%0.38522%0.22SC..THydrogen-bonded Turntrans-70.2-20.1170.582.50000114.3K768 E808 I809 F810K768-S812 PolarHBondContact NZ-O 2.87Å; E808-S812 WeakPolarHBondContact O-CB 3.27Å; E808-S812 PolarHBondContact O-N 3.02Å; I809-S812 PolarHBondContact O-N 2.87Å; I809-S812 PolarHBondContact O-OG 3.13Å; F810-S812 PolarHBondContact O-N 2.85Å
813I94.4Very high94.2Very high45 Ų4543.5 Ų43.523%0.23123%0.228CC..THydrogen-bonded Turntrans-83.5-50.6176.1-67.5164.3000109K768 F771 I772 F775 F810 D811K768-I813 HydrophobicContact CG-CG1 3.96Å; F771-I813 HydrophobicContact CB-CD1 3.51Å; I772-I813 HydrophobicContact CG1-CD1 4.28Å; I772-I813 HydrophobicContact CG1-CG1 4.22Å; I772-I813 HydrophobicContact CG1-CG2 4.03Å; F775-I813 HydrophobicContact CD2-CD1 4.2Å; F775-I813 HydrophobicContact CE2-CD1 3.83Å; F810-I813 WeakPolarHBondContact O-CB 3.39Å; F810-I813 PolarHBondContact O-N 3.15Å; D811-I813 VanDerWaalsContact C-N 3.28Å; D811-I813 PolarHBondContact O-N 3.28Å
814Q92.4Very high94.1Very high102 Ų10249.5 Ų49.548%0.47725%0.254SS..SBendtrans-148.9134175.1178.7-177.5-4300108.8F810 D811 K816 M817F810-Q814 PolarHBondContact O-N 3.17Å; D811-Q814 WeakPolarHBondContact CA-O 3.43Å; D811-Q814 CarbonylContact O-C 3.33Å; Q814-K816 PolarHBondContact O-N 3.38Å; Q814-M817 HydrophobicContact CB-CB 4.25Å; Q814-M817 HydrophobicContact CB-SD 4.38Å; Q814-M817 WeakPolarHBondContact O-CB 3.32Å; Q814-M817 PolarHBondContact O-N 3.47Å; Q814-M817 VanDerWaalsContact O-N 3.08Å
815P91.9Very high94.1Very high106 Ų10646.6 Ų46.669%0.68824%0.239SC*.THydrogen-bonded Turntrans-54.3134.7174.7-25.534.2000111.4M817P815-M817 PolarHBondContact O-N 2.85Å
816K90.9Very high94.1Very high115 Ų11545.4 Ų45.450%0.523%0.229SC..THydrogen-bonded Turntrans70.59.7-179.1-45.9-175.9-177-154.20115.9D811 Q814 F818 G819 M820 E860 Y861D811-K816 WeakPolarHBondContact OD1-CA 3.32Å; D811-K816 PolarHBondContact OD1-N 3.41Å; Q814-K816 PolarHBondContact O-N 3.38Å; K816-F818 PolarHBondContact O-N 3.33Å; K816-G819 PolarHBondContact O-N 3.15Å; K816-M820 PolarHBondContact O-N 3.11Å; K816-M820 VanDerWaalsContact O-N 3.16Å; K816-E860 WeakPolarHBondContact CD-OE1 3.31Å; K816-E860 WeakPolarHBondContact CE-OE1 3.43Å; K816-E860 IonicContact NZ-OE1 3.11Å; K816-E860 PolarHBondContact NZ-OE1 2.96Å; K816-E860 IonicContact NZ-OE2 3.34Å; K816-E860 PolarHBondContact NZ-OE2 3.09Å; K816-Y861 WeakPolarHBondContact CA-OH 3.34Å
817M92.9Very high94.2Very high8 Ų847.2 Ų47.24%0.03924%0.239CC..Hα-helixtrans-60-34.4175.1-168.373.8178.600111.2F775 F810 D811 Q814 P815 M820 V821F775-M817 HydrophobicContact CB-CE 4.15Å; F775-M817 HydrophobicContact CD1-CE 3.63Å; F775-M817 HydrophobicContact CD2-CE 3.55Å; F775-M817 HydrophobicContact CE1-CE 3.79Å; F775-M817 HydrophobicContact CE2-CE 3.71Å; F775-M817 HydrophobicContact CE2-CG 4.28Å; F775-M817 HydrophobicContact CG-CE 3.51Å; F775-M817 HydrophobicContact CZ-CE 3.83Å; F775-M817 HydrophobicContact CZ-CG 4.36Å; F810-M817 HydrophobicContact CB-CB 4.29Å; F810-M817 HydrophobicContact CB-CG 4.39Å; F810-M817 WeakPolarHBondContact O-CB 3.38Å; D811-M817 PolarHBondContact OD1-N 3.38Å; Q814-M817 HydrophobicContact CB-CB 4.25Å; Q814-M817 HydrophobicContact CB-SD 4.38Å; Q814-M817 WeakPolarHBondContact O-CB 3.32Å; Q814-M817 PolarHBondContact O-N 3.47Å; Q814-M817 VanDerWaalsContact O-N 3.08Å; P815-M817 PolarHBondContact O-N 2.85Å; M817-M820 HydrophobicContact CE-CE 3.52Å; M817-M820 PolarHBondContact O-N 3.08Å; M817-M820 HydrophobicContact SD-CE 3.26Å; M817-M820 WeakPolarHBondContact SD-CE 3.44Å; M817-M820 HydrophobicContact SD-SD 4.48Å; M817-V821 HydrophobicContact CE-CG2 4.14Å; M817-V821 HydrophobicContact CG-CG2 4.22Å; M817-V821 WeakPolarHBondContact O-CG2 3.45Å; M817-V821 PolarHBondContact O-N 2.92Å
818F95.1Very high94.1Very high1 Ų148.1 Ų48.10%0.00425%0.248CC..Hα-helixtrans-59-51.9178.8-178.8-108.4000112.8L806 Q807 F810 D811 K816 M820 V821 L822 I849 M856 Y861L806-F818 HydrophobicContact CD2-CE2 4.29Å; L806-F818 HydrophobicContact CG-CE2 4.32Å; Q807-F818 HydrophobicContact CB-CD1 4.14Å; Q807-F818 HydrophobicContact CB-CD2 3.95Å; Q807-F818 HydrophobicContact CB-CE1 4.23Å; Q807-F818 HydrophobicContact CB-CE2 4.07Å; Q807-F818 HydrophobicContact CB-CG 3.98Å; Q807-F818 HydrophobicContact CB-CZ 4.19Å; Q807-F818 HydrophobicContact CG-CB 4.16Å; Q807-F818 HydrophobicContact CG-CD1 3.75Å; Q807-F818 HydrophobicContact CG-CD2 4.32Å; Q807-F818 HydrophobicContact CG-CE1 4.17Å; Q807-F818 HydrophobicContact CG-CG 3.81Å; F810-F818 HydrophobicContact CB-CB 4.07Å; F810-F818 HydrophobicContact CD2-CB 4.49Å; F810-F818 AromaticContact CD2-CD2 3.91Å; F810-F818 HydrophobicContact CD2-CD2 3.91Å; D811-F818 WeakPolarHBondContact OD1-CB 3.47Å; D811-F818 PolarHBondContact OD1-N 2.96Å; K816-F818 PolarHBondContact O-N 3.33Å; F818-M820 VanDerWaalsContact C-N 3.32Å; F818-M820 PolarHBondContact O-N 3.37Å; F818-V821 PolarHBondContact O-N 3.33Å; F818-L822 HydrophobicContact CD1-CD1 4.05Å; F818-L822 HydrophobicContact CE1-CD1 3.56Å; F818-L822 HydrophobicContact CE2-CD1 4.26Å; F818-L822 HydrophobicContact CZ-CD1 3.69Å; F818-L822 HydrophobicContact CZ-CG 4.42Å; F818-L822 WeakPolarHBondContact O-CG 3.15Å; F818-L822 PolarHBondContact O-N 3.21Å; F818-L822 VanDerWaalsContact O-N 3.15Å; F818-I849 HydrophobicContact CZ-CG2 3.96Å; F818-M856 HydrophobicContact CE1-CG 4.31Å; F818-M856 HydrophobicContact CE1-SD 3.83Å; F818-M856 HydrophobicContact CZ-SD 4.46Å; F818-Y861 HydrophobicContact CB-CE2 4.45Å; F818-Y861 AromaticContact CD1-CD2 3.87Å; F818-Y861 HydrophobicContact CD1-CD2 3.87Å; F818-Y861 AromaticContact CD1-CE2 3.74Å; F818-Y861 HydrophobicContact CD1-CE2 3.74Å; F818-Y861 HydrophobicContact CE1-CD2 4.35Å
819G94Very high94.1Very high6 Ų644.2 Ų44.26%0.06223%0.23CC..Hα-helixtrans-61.7-39.3175.200000112.7K816 L822 E823 L864K816-G819 PolarHBondContact O-N 3.15Å; G819-L822 PolarHBondContact O-N 3.47Å; G819-E823 WeakPolarHBondContact O-CB 3.4Å; G819-E823 PolarHBondContact O-N 3.36Å; G819-L864 WeakPolarHBondContact O-CD1 3.34Å
820M93.4Very high94.1Very high77 Ų7743.2 Ų43.238%0.37923%0.225SC..Hα-helixtrans-63.3-44179.4-170.4-172.578.100112.5K816 M817 F818 E823 K824K816-M820 PolarHBondContact O-N 3.11Å; K816-M820 VanDerWaalsContact O-N 3.16Å; M817-M820 HydrophobicContact CE-CE 3.52Å; M817-M820 PolarHBondContact O-N 3.08Å; M817-M820 HydrophobicContact SD-CE 3.26Å; M817-M820 WeakPolarHBondContact SD-CE 3.44Å; M817-M820 HydrophobicContact SD-SD 4.48Å; F818-M820 VanDerWaalsContact C-N 3.32Å; F818-M820 PolarHBondContact O-N 3.37Å; M820-E823 PolarHBondContact O-N 2.77Å; M820-K824 HydrophobicContact CG-CG 4.28Å; M820-K824 WeakPolarHBondContact O-CB 3.38Å; M820-K824 WeakPolarHBondContact O-CG 3.32Å; M820-K824 PolarHBondContact O-N 2.95Å
821V94.4Very high94Very high2 Ų244.6 Ų44.61%0.01223%0.231CC..Hα-helixtrans-67.5-39178.8175.30000111F775 F790 F810 M817 F818 I825 I826F775-V821 HydrophobicContact CE1-CG2 3.59Å; F775-V821 HydrophobicContact CZ-CG2 3.9Å; F790-V821 HydrophobicContact CE1-CG1 4.25Å; F790-V821 HydrophobicContact CZ-CG1 4.43Å; F810-V821 HydrophobicContact CD2-CB 4.2Å; F810-V821 HydrophobicContact CD2-CG1 4.47Å; F810-V821 HydrophobicContact CD2-CG2 4.19Å; F810-V821 HydrophobicContact CE2-CB 3.97Å; F810-V821 HydrophobicContact CE2-CG1 3.76Å; F810-V821 HydrophobicContact CE2-CG2 4.15Å; M817-V821 HydrophobicContact CE-CG2 4.14Å; M817-V821 HydrophobicContact CG-CG2 4.22Å; M817-V821 WeakPolarHBondContact O-CG2 3.45Å; M817-V821 PolarHBondContact O-N 2.92Å; F818-V821 PolarHBondContact O-N 3.33Å; V821-I825 HydrophobicContact CG1-CB 4.42Å; V821-I825 WeakPolarHBondContact O-CA 3.48Å; V821-I825 WeakPolarHBondContact O-CB 3.4Å; V821-I825 PolarHBondContact O-N 3.36Å; V821-I826 HydrophobicContact CG1-CD1 4.11Å; V821-I826 HydrophobicContact CG1-CG1 4.38Å; V821-I826 PolarHBondContact O-N 3.38Å
822L96.1Very high94Very high1 Ų143.6 Ų43.61%0.00523%0.225CC..Iπ-helixtrans-60.6-51.4173.8-72.7174.9000111.6F818 G819 I826 I827 I849 M856 L864 L868F818-L822 HydrophobicContact CD1-CD1 4.05Å; F818-L822 HydrophobicContact CE1-CD1 3.56Å; F818-L822 HydrophobicContact CE2-CD1 4.26Å; F818-L822 HydrophobicContact CZ-CD1 3.69Å; F818-L822 HydrophobicContact CZ-CG 4.42Å; F818-L822 WeakPolarHBondContact O-CG 3.15Å; F818-L822 PolarHBondContact O-N 3.21Å; F818-L822 VanDerWaalsContact O-N 3.15Å; G819-L822 PolarHBondContact O-N 3.47Å; L822-I826 HydrophobicContact CD2-CB 4.26Å; L822-I826 HydrophobicContact CD2-CD1 3.67Å; L822-I826 HydrophobicContact CD2-CG2 4.36Å; L822-I826 PolarHBondContact O-N 2.93Å; L822-I827 WeakPolarHBondContact O-CB 3.49Å; L822-I827 WeakPolarHBondContact O-CD1 3.43Å; L822-I827 VanDerWaalsContact O-CG1 3.28Å; L822-I827 WeakPolarHBondContact O-CG1 3.33Å; L822-I827 PolarHBondContact O-N 2.88Å; L822-I849 HydrophobicContact CD1-CG2 4.47Å; L822-I849 HydrophobicContact CD2-CG2 4.37Å; L822-M856 HydrophobicContact CD1-CE 4.19Å; L822-M856 HydrophobicContact CD1-SD 3.66Å; L822-L864 HydrophobicContact CB-CD1 4.19Å; L822-L868 HydrophobicContact CD2-CD1 4.29Å; L822-L868 HydrophobicContact CD2-CD2 4.03Å
823E95.3Very high93.9Very high75 Ų7541 Ų4135%0.3521%0.207SC..Iπ-helixtrans-68.3-43.4-174.8-168.6-171134.600113G819 M820 P828 L864G819-E823 WeakPolarHBondContact O-CB 3.4Å; G819-E823 PolarHBondContact O-N 3.36Å; M820-E823 PolarHBondContact O-N 2.77Å; E823-P828 WeakPolarHBondContact O-CD 3.35Å; E823-L864 HydrophobicContact CB-CD1 4.24Å; E823-L864 HydrophobicContact CB-CD2 3.87Å; E823-L864 HydrophobicContact CG-CD2 3.87Å
824K93.2Very high93.5Very high128 Ų12841.1 Ų41.156%0.55721%0.212SC*.Iπ-helixtrans-94.8-18.1-170.7-59.9-53.9-171.9-154.60114.2M820 P828M820-K824 HydrophobicContact CG-CG 4.28Å; M820-K824 WeakPolarHBondContact O-CB 3.38Å; M820-K824 WeakPolarHBondContact O-CG 3.32Å; M820-K824 PolarHBondContact O-N 2.95Å; K824-P828 VanDerWaalsContact C-CG 3.47Å; K824-P828 VanDerWaalsContact O-CG 3.27Å; K824-P828 WeakPolarHBondContact O-CG 3.32Å
825I93.6Very high93.3Very high21 Ų2137.8 Ų37.811%0.10821%0.205CC..Iπ-helixtrans-127.3-61.7-172.2-48.9-66.8000111.2L778 F790 L791 V821 P828 E829L778-I825 HydrophobicContact CD1-CD1 4.2Å; L778-I825 HydrophobicContact CD2-CD1 3.73Å; L778-I825 HydrophobicContact CD2-CG1 3.9Å; L778-I825 HydrophobicContact CG-CD1 4.2Å; F790-I825 HydrophobicContact CD1-CG2 4.1Å; F790-I825 HydrophobicContact CE1-CG2 4.05Å; L791-I825 HydrophobicContact CD2-CG2 4.26Å; V821-I825 HydrophobicContact CG1-CB 4.42Å; V821-I825 WeakPolarHBondContact O-CA 3.48Å; V821-I825 WeakPolarHBondContact O-CB 3.4Å; V821-I825 PolarHBondContact O-N 3.36Å; I825-P828 WeakPolarHBondContact O-CD 3.13Å; I825-E829 WeakPolarHBondContact O-CB 3.48Å; I825-E829 WeakPolarHBondContact O-CG 3.38Å; I825-E829 PolarHBondContact O-N 3.35Å
826I95.9Very high93.1Very high1 Ų138.2 Ų38.21%0.00521%0.206CC..Iπ-helixtrans-65.6-50.9-171.7-66.2167.3000111.5L791 V794 V821 L822 V830 I846 L868L791-I826 HydrophobicContact CD2-CB 4.27Å; L791-I826 HydrophobicContact CD2-CG1 3.83Å; V794-I826 HydrophobicContact CG1-CD1 4.08Å; V821-I826 HydrophobicContact CG1-CD1 4.11Å; V821-I826 HydrophobicContact CG1-CG1 4.38Å; V821-I826 PolarHBondContact O-N 3.38Å; L822-I826 HydrophobicContact CD2-CB 4.26Å; L822-I826 HydrophobicContact CD2-CD1 3.67Å; L822-I826 HydrophobicContact CD2-CG2 4.36Å; L822-I826 PolarHBondContact O-N 2.93Å; I826-V830 WeakPolarHBondContact O-CB 3.29Å; I826-V830 WeakPolarHBondContact O-CG1 3.04Å; I826-V830 PolarHBondContact O-N 3.16Å; I826-V830 VanDerWaalsContact O-N 3.13Å; I826-I846 HydrophobicContact CG2-CD1 4.17Å; I826-I846 HydrophobicContact CG2-CG1 4.4Å; I826-L868 HydrophobicContact CG2-CD1 3.85Å
827I95.9Very high93.1Very high37 Ų3733.4 Ų33.419%0.1919%0.186CC..Hα-helixtrans-60.4-51.7-179.4-69.1163.9000112.4L822 L864 P867 L868 A871L822-I827 WeakPolarHBondContact O-CB 3.49Å; L822-I827 WeakPolarHBondContact O-CD1 3.43Å; L822-I827 VanDerWaalsContact O-CG1 3.28Å; L822-I827 WeakPolarHBondContact O-CG1 3.33Å; L822-I827 PolarHBondContact O-N 2.88Å; I827-L864 HydrophobicContact CD1-CB 4.43Å; I827-L864 HydrophobicContact CD1-CD2 4.41Å; I827-P867 HydrophobicContact CD1-CB 3.99Å; I827-P867 HydrophobicContact CG2-CB 4.35Å; I827-L868 HydrophobicContact CD1-CB 4.25Å; I827-L868 HydrophobicContact CG1-CB 4.16Å; I827-L868 HydrophobicContact CG1-CD1 3.99Å; I827-A871 HydrophobicContact CG2-CB 4.41Å
828P94.3Very high93.1Very high60 Ų6036.2 Ų36.239%0.3920%0.199SC..Hα-helixtrans-73.3-32.5-177.124.3-32.3000114.2E823 K824 I825E823-P828 WeakPolarHBondContact O-CD 3.35Å; K824-P828 VanDerWaalsContact C-CG 3.47Å; K824-P828 VanDerWaalsContact O-CG 3.27Å; K824-P828 WeakPolarHBondContact O-CG 3.32Å; I825-P828 WeakPolarHBondContact O-CD 3.13Å
829E94.3Very high93.1Very high35 Ų3538.5 Ų38.516%0.16421%0.209CC..Hα-helixtrans-104.6-9.1-167.3-53.5-70.214600114.2I787 L791 I825 Q831 K832I787-E829 HydrophobicContact CG2-CB 3.62Å; I787-E829 HydrophobicContact CG2-CG 3.9Å; L791-E829 HydrophobicContact CD1-CB 3.96Å; L791-E829 WeakPolarHBondContact CD1-O 3.36Å; I825-E829 WeakPolarHBondContact O-CB 3.48Å; I825-E829 WeakPolarHBondContact O-CG 3.38Å; I825-E829 PolarHBondContact O-N 3.35Å; E829-Q831 PolarHBondContact O-N 3.36Å; E829-Q831 VanDerWaalsContact O-N 3.14Å; E829-K832 WeakPolarHBondContact O-CB 3.5Å; E829-K832 PolarHBondContact O-N 2.97Å; E829-K832 IonicContact OE1-NZ 2.85Å; E829-K832 VanDerWaalsContact OE2-CD 3.23Å; E829-K832 WeakPolarHBondContact OE2-CD 3.47Å; E829-K832 WeakPolarHBondContact OE2-CE 3.5Å; E829-K832 IonicContact OE2-NZ 3.72Å; E829-K832 PolarHBondContact OE2-NZ 3.29Å
830V95.3Very high93.1Very high0 Ų039.6 Ų39.60%021%0.212CC..G310 helixtrans-60-28.2-176.470.70000113.6I826 K832 V833 C842 I846 A871 L875I826-V830 WeakPolarHBondContact O-CB 3.29Å; I826-V830 WeakPolarHBondContact O-CG1 3.04Å; I826-V830 PolarHBondContact O-N 3.16Å; I826-V830 VanDerWaalsContact O-N 3.13Å; V830-K832 PolarHBondContact O-N 3.5Å; V830-V833 WeakPolarHBondContact O-CB 3.39Å; V830-V833 WeakPolarHBondContact O-CG2 3.44Å; V830-V833 PolarHBondContact O-N 3.49Å; V830-V833 VanDerWaalsContact O-N 3.13Å; V830-C842 HydrophobicContact CG2-CB 4.4Å; V830-I846 HydrophobicContact CG2-CD1 3.79Å; V830-A871 HydrophobicContact CG1-CB 3.83Å; V830-L875 HydrophobicContact CG2-CD1 4.28Å; V830-L875 HydrophobicContact CG2-CD2 4.01Å; V830-L875 WeakPolarHBondContact O-CD1 3.48Å
831Q93.8Very high93.2Very high30 Ų3036.3 Ų36.314%0.1420%0.196CC..G310 helixtrans-61.9-21.3175.2-71.5-52-49.100113.8E829 V833 A871 G874 D881E829-Q831 PolarHBondContact O-N 3.36Å; E829-Q831 VanDerWaalsContact O-N 3.14Å; Q831-V833 VanDerWaalsContact C-N 3.27Å; Q831-V833 PolarHBondContact O-N 3.06Å; Q831-A871 PolarHBondContact NE2-O 3.12Å; Q831-A871 VanDerWaalsContact NE2-O 3.14Å; Q831-G874 PolarHBondContact OE1-O 3.02Å; Q831-D881 HydrophobicContact CB-CB 3.77Å; Q831-D881 PolarHBondContact O-N 3.12Å; Q831-D881 VanDerWaalsContact O-N 3.09Å
832K91.8Very high93.3Very high11 Ų1136.2 Ų36.25%0.04820%0.195CC..G310 helixtrans-76.6-15.3178.7-59.2-169.9176171.50112.7K788 E829 V830 S834 D881 S883K788-K832 WeakPolarHBondContact CD-O 3.39Å; K788-K832 WeakPolarHBondContact CE-O 3.48Å; K788-K832 HydrophobicContact CG-CB 4.21Å; K788-K832 WeakPolarHBondContact CG-O 3.48Å; K788-K832 PolarHBondContact NZ-O 3.22Å; E829-K832 WeakPolarHBondContact O-CB 3.5Å; E829-K832 PolarHBondContact O-N 2.97Å; E829-K832 IonicContact OE1-NZ 2.85Å; E829-K832 VanDerWaalsContact OE2-CD 3.23Å; E829-K832 WeakPolarHBondContact OE2-CD 3.47Å; E829-K832 WeakPolarHBondContact OE2-CE 3.5Å; E829-K832 IonicContact OE2-NZ 3.72Å; E829-K832 PolarHBondContact OE2-NZ 3.29Å; V830-K832 PolarHBondContact O-N 3.5Å; K832-S834 PolarHBondContact O-N 3.45Å; K832-D881 VanDerWaalsContact CE-OD2 3.31Å; K832-D881 WeakPolarHBondContact CE-OD2 3.49Å; K832-D881 HydrophobicContact CG-CB 3.93Å; K832-S883 WeakPolarHBondContact CE-OG 3.47Å; K832-S883 PolarHBondContact NZ-O 3.17Å
833V92.3Very high93.4Very high1 Ų136.2 Ų36.21%0.00620%0.195CC..  trans-66.5120.4-178.9178.20000109.7L791 V792 V830 Q831 E838 K839L791-V833 HydrophobicContact CB-CG2 3.93Å; L791-V833 HydrophobicContact CD1-CG2 3.77Å; V792-V833 HydrophobicContact CG2-CG1 4.07Å; V830-V833 WeakPolarHBondContact O-CB 3.39Å; V830-V833 WeakPolarHBondContact O-CG2 3.44Å; V830-V833 PolarHBondContact O-N 3.49Å; V830-V833 VanDerWaalsContact O-N 3.13Å; Q831-V833 VanDerWaalsContact C-N 3.27Å; Q831-V833 PolarHBondContact O-N 3.06Å; V833-E838 HydrophobicContact CG1-CB 3.76Å; V833-K839 HydrophobicContact CG1-CG 4.29Å; V833-K839 WeakPolarHBondContact O-CE 3.28Å
834S86.9Confident93.4Very high47 Ų4732.9 Ų32.933%0.32918%0.18SC..  trans-110.6149.4-17955.50000110.6K832 E838 E880K832-S834 PolarHBondContact O-N 3.45Å; S834-E838 WeakPolarHBondContact O-CB 3.43Å; S834-E880 WeakPolarHBondContact CB-OE2 3.34Å
835G87.8Confident93.6Very high31 Ų3126.8 Ų26.832%0.3215%0.153SC..SBendtrans102.1142.7179.200000113.8K839G835-K839 VanDerWaalsContact O-CB 3.26Å; G835-K839 WeakPolarHBondContact O-CB 3.4Å; G835-K839 WeakPolarHBondContact O-CG 3.27Å; G835-K839 PolarHBondContact O-N 3.27Å
836T88.3Confident93.8Very high116 Ų11625.8 Ų25.871%0.71215%0.148SC*.Hα-helixtrans-66-44.1-173.2-51.60000111.8K840T836-K840 WeakPolarHBondContact O-CB 3.48Å; T836-K840 PolarHBondContact O-N 3.26Å; T836-K840 VanDerWaalsContact O-N 3.12Å
837V91Very high93.9Very high13 Ų1325.8 Ų25.88%0.07915%0.148CC..Hα-helixtrans-72.1-44.7-179.51760000110.7K839 K840 I841 E913 D915V837-K839 PolarHBondContact O-N 3.44Å; V837-K840 WeakPolarHBondContact O-CB 3.4Å; V837-K840 PolarHBondContact O-N 2.81Å; V837-K840 VanDerWaalsContact O-N 3.13Å; V837-I841 HydrophobicContact CG1-CD1 3.96Å; V837-I841 HydrophobicContact CG1-CG1 4.42Å; V837-I841 WeakPolarHBondContact O-CG1 3.36Å; V837-I841 PolarHBondContact O-N 3.1Å; V837-E913 HydrophobicContact CG2-CG 4.01Å; V837-D915 HydrophobicContact CG1-CB 4.34Å; V837-D915 HydrophobicContact CG2-CB 4.32Å
838E93.5Very high93.9Very high67 Ų6726.4 Ų26.431%0.31315%0.15SC..Hα-helixtrans-61.1-45.6179.2-69.972-159.200111.5V792 V833 S834 K840 I841 C842V792-E838 HydrophobicContact CG1-CG 4.43Å; V792-E838 HydrophobicContact CG2-CB 3.71Å; V792-E838 HydrophobicContact CG2-CG 3.84Å; V833-E838 HydrophobicContact CG1-CB 3.76Å; S834-E838 WeakPolarHBondContact O-CB 3.43Å; E838-K840 VanDerWaalsContact C-N 3.31Å; E838-K840 PolarHBondContact O-N 2.97Å; E838-I841 PolarHBondContact O-N 3.32Å; E838-C842 PolarHBondContact O-N 3.46Å
839K93.9Very high94.1Very high50 Ų5023.6 Ų23.622%0.21713%0.131CC..Hα-helixtrans-60.7-41173.7-76.1178.6169.5177.30111.6V833 G835 V837 C842 A843 L875 E880V833-K839 HydrophobicContact CG1-CG 4.29Å; V833-K839 WeakPolarHBondContact O-CE 3.28Å; G835-K839 VanDerWaalsContact O-CB 3.26Å; G835-K839 WeakPolarHBondContact O-CB 3.4Å; G835-K839 WeakPolarHBondContact O-CG 3.27Å; G835-K839 PolarHBondContact O-N 3.27Å; V837-K839 PolarHBondContact O-N 3.44Å; K839-C842 PolarHBondContact O-N 3.05Å; K839-A843 VanDerWaalsContact O-CB 3.24Å; K839-A843 WeakPolarHBondContact O-CB 3.43Å; K839-A843 PolarHBondContact O-N 3.46Å; K839-L875 HydrophobicContact CG-CD1 4.09Å; K839-E880 WeakPolarHBondContact CE-OE1 3.17Å; K839-E880 IonicContact NZ-OE1 3.26Å; K839-E880 PolarHBondContact NZ-OE1 3.19Å
840K94.6Very high94.1Very high28 Ų2822 Ų2212%0.12212%0.124CC..Hα-helixtrans-62.7-44.4176-179.7175.5175-179.30111.7T836 V837 E838 A843 V844 D915 I917 G918 V921 P924T836-K840 WeakPolarHBondContact O-CB 3.48Å; T836-K840 PolarHBondContact O-N 3.26Å; T836-K840 VanDerWaalsContact O-N 3.12Å; V837-K840 WeakPolarHBondContact O-CB 3.4Å; V837-K840 PolarHBondContact O-N 2.81Å; V837-K840 VanDerWaalsContact O-N 3.13Å; E838-K840 VanDerWaalsContact C-N 3.31Å; E838-K840 PolarHBondContact O-N 2.97Å; K840-A843 PolarHBondContact O-N 3.27Å; K840-V844 WeakPolarHBondContact O-CG2 3.5Å; K840-V844 PolarHBondContact O-N 3.43Å; K840-D915 WeakPolarHBondContact CD-OD2 3.43Å; K840-D915 VanDerWaalsContact CE-OD2 3.32Å; K840-D915 WeakPolarHBondContact CE-OD2 3.45Å; K840-D915 IonicContact NZ-OD2 2.83Å; K840-D915 PolarHBondContact NZ-OD2 2.9Å; K840-I917 HydrophobicContact CG-CD1 4.03Å; K840-G918 PolarHBondContact NZ-O 3.16Å; K840-V921 WeakPolarHBondContact CE-O 3.4Å; K840-V921 PolarHBondContact NZ-O 2.66Å; K840-P924 HydrophobicContact CB-CG 4.45Å; K840-P924 HydrophobicContact CG-CG 4Å
841I95.6Very high94.1Very high8 Ų823 Ų234%0.04113%0.13CC..Hα-helixtrans-58.1-51.6175.6-67.6165.5000110.8V792 N795 L796 V837 E838 A843 V844 G845 P916 I917V792-I841 HydrophobicContact CG1-CD1 4.02Å; V792-I841 HydrophobicContact CG1-CG2 4.21Å; N795-I841 HydrophobicContact CB-CG2 4.19Å; L796-I841 HydrophobicContact CB-CG2 3.85Å; L796-I841 HydrophobicContact CD1-CG2 4.46Å; V837-I841 HydrophobicContact CG1-CD1 3.96Å; V837-I841 HydrophobicContact CG1-CG1 4.42Å; V837-I841 WeakPolarHBondContact O-CG1 3.36Å; V837-I841 PolarHBondContact O-N 3.1Å; E838-I841 PolarHBondContact O-N 3.32Å; I841-A843 VanDerWaalsContact C-N 3.33Å; I841-A843 PolarHBondContact O-N 3.49Å; I841-V844 PolarHBondContact O-N 3.26Å; I841-G845 PolarHBondContact O-N 3.03Å; I841-P916 HydrophobicContact CD1-CG 3.53Å; I841-P916 HydrophobicContact CG1-CG 3.78Å; I841-I917 HydrophobicContact CB-CD1 4.41Å; I841-I917 HydrophobicContact CG1-CD1 4.03Å
842C96.9Very high94.1Very high0 Ų025.8 Ų25.80%014%0.143CC..Hα-helixtrans-59.7-43.6177.9-72.40000111.9V830 E838 K839 G845 I846 L875V830-C842 HydrophobicContact CG2-CB 4.4Å; E838-C842 PolarHBondContact O-N 3.46Å; K839-C842 PolarHBondContact O-N 3.05Å; C842-G845 PolarHBondContact O-N 3.06Å; C842-I846 WeakPolarHBondContact O-CB 3.43Å; C842-I846 VanDerWaalsContact O-CG1 3.27Å; C842-I846 WeakPolarHBondContact O-CG1 3.36Å; C842-I846 PolarHBondContact O-N 3.2Å; C842-L875 HydrophobicContact CB-CD2 3.99Å
843A96.6Very high94.2Very high1 Ų125.5 Ų25.51%0.00814%0.143CC..Hα-helixtrans-62.7-45.6-179.600000113.2K839 K840 I841 T847 L872 F876 P924K839-A843 VanDerWaalsContact O-CB 3.24Å; K839-A843 WeakPolarHBondContact O-CB 3.43Å; K839-A843 PolarHBondContact O-N 3.46Å; K840-A843 PolarHBondContact O-N 3.27Å; I841-A843 VanDerWaalsContact C-N 3.33Å; I841-A843 PolarHBondContact O-N 3.49Å; A843-T847 WeakPolarHBondContact O-CB 3.46Å; A843-T847 PolarHBondContact O-N 2.67Å; A843-T847 PolarHBondContact O-OG1 3.44Å; A843-L872 HydrophobicContact CB-CD1 3.92Å; A843-F876 HydrophobicContact CB-CE1 3.48Å; A843-F876 VanDerWaalsContact CB-CE1 3.48Å; A843-F876 HydrophobicContact CB-CZ 3.77Å; A843-P924 HydrophobicContact CB-CB 3.79Å
844V96.8Very high94.1Very high5 Ų529 Ų293%0.0317%0.165CC..Hα-helixtrans-68.9-42.3178.1179.50000110.7V799 K840 I841 T847 K848 I917 V921 L927V799-V844 HydrophobicContact CG2-CB 4.1Å; V799-V844 HydrophobicContact CG2-CG1 3.86Å; K840-V844 WeakPolarHBondContact O-CG2 3.5Å; K840-V844 PolarHBondContact O-N 3.43Å; I841-V844 PolarHBondContact O-N 3.26Å; V844-T847 PolarHBondContact O-N 2.95Å; V844-K848 WeakPolarHBondContact O-CG 3.46Å; V844-K848 PolarHBondContact O-N 3.26Å; V844-I917 HydrophobicContact CB-CD1 3.88Å; V844-I917 HydrophobicContact CG1-CD1 4.42Å; V844-I917 HydrophobicContact CG2-CD1 3.77Å; V844-V921 HydrophobicContact CG2-CB 4.42Å; V844-V921 HydrophobicContact CG2-CG1 4.04Å; V844-V921 HydrophobicContact CG2-CG2 4.26Å; V844-L927 HydrophobicContact CB-CD2 4.28Å; V844-L927 HydrophobicContact CG1-CD2 3.91Å; V844-L927 HydrophobicContact CG2-CD2 3.79Å
845G96.9Very high94.2Very high0 Ų027.4 Ų27.40%016%0.155CC..Hα-helixtrans-58.6-50.8176.300000112.6I841 C842 T847 K848 I849I841-G845 PolarHBondContact O-N 3.03Å; C842-G845 PolarHBondContact O-N 3.06Å; G845-T847 VanDerWaalsContact C-N 3.34Å; G845-T847 PolarHBondContact O-N 3.04Å; G845-K848 WeakPolarHBondContact O-CB 3.46Å; G845-K848 PolarHBondContact O-N 2.97Å; G845-I849 WeakPolarHBondContact O-CG1 3.5Å; G845-I849 PolarHBondContact O-N 3.08Å
846I97.9Very high94.3Very high0 Ų025.9 Ų25.90%014%0.139CC..Hα-helixtrans-64.7-38.5178.4-64.3169.9000111.3N795 I826 V830 C842 K848 I849 L850 L868 L872N795-I846 WeakPolarHBondContact OD1-CG1 3.31Å; N795-I846 PolarHBondContact OD1-N 3.5Å; I826-I846 HydrophobicContact CG2-CD1 4.17Å; I826-I846 HydrophobicContact CG2-CG1 4.4Å; V830-I846 HydrophobicContact CG2-CD1 3.79Å; C842-I846 WeakPolarHBondContact O-CB 3.43Å; C842-I846 VanDerWaalsContact O-CG1 3.27Å; C842-I846 WeakPolarHBondContact O-CG1 3.36Å; C842-I846 PolarHBondContact O-N 3.2Å; I846-K848 VanDerWaalsContact C-N 3.3Å; I846-K848 PolarHBondContact O-N 3.14Å; I846-I849 PolarHBondContact O-N 3.17Å; I846-I849 VanDerWaalsContact O-N 3.15Å; I846-L850 HydrophobicContact CG2-CD1 3.9Å; I846-L850 HydrophobicContact CG2-CG 4.27Å; I846-L850 WeakPolarHBondContact O-CG 3.43Å; I846-L850 PolarHBondContact O-N 3.46Å; I846-L868 HydrophobicContact CD1-CD1 4.5Å; I846-L868 HydrophobicContact CG1-CD1 4.43Å; I846-L868 HydrophobicContact CG2-CD1 3.69Å; I846-L868 HydrophobicContact CG2-CD2 4.1Å; I846-L868 HydrophobicContact CG2-CG 3.65Å; I846-L872 HydrophobicContact CB-CD1 4.36Å; I846-L872 HydrophobicContact CB-CD2 4.33Å; I846-L872 HydrophobicContact CG2-CB 3.99Å; I846-L872 HydrophobicContact CG2-CD2 3.97Å; I846-L872 HydrophobicContact CG2-CG 4.39Å
847T97.4Very high94.1Very high1 Ų120.8 Ų20.81%0.00611%0.107CC..Hα-helixtrans-58-44.1174.6-61.70000111.1A843 V844 G845 L850 T851 L927 L928A843-T847 WeakPolarHBondContact O-CB 3.46Å; A843-T847 PolarHBondContact O-N 2.67Å; A843-T847 PolarHBondContact O-OG1 3.44Å; V844-T847 PolarHBondContact O-N 2.95Å; G845-T847 VanDerWaalsContact C-N 3.34Å; G845-T847 PolarHBondContact O-N 3.04Å; T847-L850 PolarHBondContact O-N 3.39Å; T847-T851 WeakPolarHBondContact O-CB 3.45Å; T847-T851 WeakPolarHBondContact O-CG2 3.49Å; T847-T851 PolarHBondContact O-N 2.99Å; T847-T851 PolarHBondContact O-OG1 3.35Å; T847-L927 HydrophobicContact CG2-CG 4.44Å; T847-L928 HydrophobicContact CG2-CB 4.45Å; T847-L928 HydrophobicContact CG2-CD1 4.06Å
848K96.8Very high93.4Very high51 Ų5125.2 Ų25.222%0.22213%0.131CC..Hα-helixtrans-65-41.1174.8-71.3-170.3170.4-159.60112.2V799 V844 G845 I846 L850 T851 E852V799-K848 PolarHBondContact O-NZ 2.87Å; V844-K848 WeakPolarHBondContact O-CG 3.46Å; V844-K848 PolarHBondContact O-N 3.26Å; G845-K848 WeakPolarHBondContact O-CB 3.46Å; G845-K848 PolarHBondContact O-N 2.97Å; I846-K848 VanDerWaalsContact C-N 3.3Å; I846-K848 PolarHBondContact O-N 3.14Å; K848-L850 VanDerWaalsContact C-N 3.3Å; K848-L850 PolarHBondContact O-N 3.15Å; K848-T851 PolarHBondContact O-N 3.35Å; K848-E852 WeakPolarHBondContact O-CA 3.35Å; K848-E852 VanDerWaalsContact O-CB 3.29Å; K848-E852 WeakPolarHBondContact O-CB 3.44Å; K848-E852 PolarHBondContact O-N 2.87Å
849I97Very high92.9Very high0 Ų025.1 Ų25.10%014%0.135CC..Hα-helixtrans-58.8-44.3175.1-67167.7000110.9A803 L806 F818 L822 G845 I846 T851 C853 M856 L868A803-I849 HydrophobicContact CB-CG1 4.39Å; L806-I849 HydrophobicContact CD2-CD1 3.94Å; L806-I849 HydrophobicContact CD2-CG1 4.38Å; F818-I849 HydrophobicContact CZ-CG2 3.96Å; L822-I849 HydrophobicContact CD1-CG2 4.47Å; L822-I849 HydrophobicContact CD2-CG2 4.37Å; G845-I849 WeakPolarHBondContact O-CG1 3.5Å; G845-I849 PolarHBondContact O-N 3.08Å; I846-I849 PolarHBondContact O-N 3.17Å; I846-I849 VanDerWaalsContact O-N 3.15Å; I849-T851 PolarHBondContact O-N 3.36Å; I849-C853 WeakPolarHBondContact O-CB 3.28Å; I849-M856 HydrophobicContact CG2-CG 4.2Å; I849-M856 HydrophobicContact CG2-SD 4.41Å; I849-L868 HydrophobicContact CB-CD2 4.42Å; I849-L868 HydrophobicContact CG2-CD2 3.71Å
850L95.1Very high92.2Very high1 Ų127.5 Ų27.51%0.00515%0.147CC..Hα-helixtrans-68-31.7-179.7-73.5166.8000113.5I846 T847 K848 W865 L868 L869 L872I846-L850 HydrophobicContact CG2-CD1 3.9Å; I846-L850 HydrophobicContact CG2-CG 4.27Å; I846-L850 WeakPolarHBondContact O-CG 3.43Å; I846-L850 PolarHBondContact O-N 3.46Å; T847-L850 PolarHBondContact O-N 3.39Å; K848-L850 VanDerWaalsContact C-N 3.3Å; K848-L850 PolarHBondContact O-N 3.15Å; L850-W865 HydrophobicContact CD2-CD2 3.99Å; L850-W865 HydrophobicContact CD2-CG 3.96Å; L850-W865 HydrophobicContact CD2-CZ2 4.47Å; L850-W865 WeakPolarHBondContact CD2-O 3.12Å; L850-W865 PolarHBondContact O-NE1 3.49Å; L850-L868 HydrophobicContact CD2-CB 4.09Å; L850-L868 HydrophobicContact CD2-CD2 3.87Å; L850-L868 HydrophobicContact CD2-CG 4.03Å; L850-L868 HydrophobicContact CG-CD2 4.03Å; L850-L868 HydrophobicContact CG-CG 4.25Å; L850-L869 HydrophobicContact CD1-CB 4.1Å; L850-L869 HydrophobicContact CD1-CD1 4.02Å; L850-L869 HydrophobicContact CD2-CB 4.28Å; L850-L872 HydrophobicContact CD1-CD2 4.01Å
851T94.8Very high92Very high22 Ų2226.9 Ų26.914%0.13514%0.144CC..Hα-helixtrans-117.6-17.3-165.962.10000115.4T847 K848 I849 L932 L935T847-T851 WeakPolarHBondContact O-CB 3.45Å; T847-T851 WeakPolarHBondContact O-CG2 3.49Å; T847-T851 PolarHBondContact O-N 2.99Å; T847-T851 PolarHBondContact O-OG1 3.35Å; K848-T851 PolarHBondContact O-N 3.35Å; I849-T851 PolarHBondContact O-N 3.36Å; T851-L932 HydrophobicContact CG2-CD2 3.98Å; T851-L932 HydrophobicContact CG2-CG 4.39Å; T851-L935 HydrophobicContact CG2-CB 4.42Å; T851-L935 HydrophobicContact CG2-CD2 4.29Å
852E94.3Very high91.7Very high89 Ų8928.5 Ų28.542%0.41615%0.154SC..Hα-helixtrans-122.24.8-175.8-54.8-179.5175.600112.8A803 K848 P854A803-E852 HydrophobicContact CB-CB 4.46Å; K848-E852 WeakPolarHBondContact O-CA 3.35Å; K848-E852 VanDerWaalsContact O-CB 3.29Å; K848-E852 WeakPolarHBondContact O-CB 3.44Å; K848-E852 PolarHBondContact O-N 2.87Å; E852-P854 WeakPolarHBondContact O-CD 3.45Å
853C93.6Very high91.4Very high5 Ų535.3 Ų35.33%0.03418%0.184CC..  trans-108.4101175.6-167.60000111.1A803 I849 A855 M856A803-C853 HydrophobicContact CB-CB 3.86Å; I849-C853 WeakPolarHBondContact O-CB 3.28Å; C853-A855 PolarHBondContact O-N 3.15Å; C853-A855 VanDerWaalsContact O-N 3.16Å; C853-M856 HydrophobicContact CB-CB 4.48Å; C853-M856 HydrophobicContact CB-CG 3.91Å; C853-M856 WeakPolarHBondContact O-CB 3.46Å; C853-M856 PolarHBondContact O-N 2.99Å
854P90.5Very high91.2Very high74 Ų7435.8 Ų35.848%0.48119%0.186SC..THydrogen-bonded Turntrans-57.3-32.3-180-26.635.4000113.6E852 M856 M857 D858E852-P854 WeakPolarHBondContact O-CD 3.45Å; P854-M856 PolarHBondContact O-N 3.32Å; P854-M856 VanDerWaalsContact O-N 3.15Å; P854-M857 PolarHBondContact O-N 3.44Å; P854-D858 PolarHBondContact O-N 3.36Å
855A88.4Confident91.1Very high13 Ų1335.6 Ų35.611%0.10719%0.185CC..Hα-helixtrans-58.5-29.5177.900000112.6Q807 C853 M857 T859 Y861Q807-A855 HydrophobicContact CG-CB 4.3Å; C853-A855 PolarHBondContact O-N 3.15Å; C853-A855 VanDerWaalsContact O-N 3.16Å; A855-M857 PolarHBondContact O-N 3.08Å; A855-T859 HydrophobicContact CB-CG2 4.21Å; A855-T859 WeakPolarHBondContact O-CB 3.38Å; A855-T859 PolarHBondContact O-N 3.03Å; A855-T859 PolarHBondContact O-OG1 3.28Å; A855-Y861 HydrophobicContact CB-CD2 3.98Å; A855-Y861 HydrophobicContact CB-CE2 4.29Å
856M89.9Confident90.9Very high0 Ų035.9 Ų35.90%019%0.187CC..Hα-helixtrans-69.7-20.6176.3-68.6-64.8-66.300113.3F818 L822 I849 C853 P854 T862 L864 W865 L868F818-M856 HydrophobicContact CE1-CG 4.31Å; F818-M856 HydrophobicContact CE1-SD 3.83Å; F818-M856 HydrophobicContact CZ-SD 4.46Å; L822-M856 HydrophobicContact CD1-CE 4.19Å; L822-M856 HydrophobicContact CD1-SD 3.66Å; I849-M856 HydrophobicContact CG2-CG 4.2Å; I849-M856 HydrophobicContact CG2-SD 4.41Å; C853-M856 HydrophobicContact CB-CB 4.48Å; C853-M856 HydrophobicContact CB-CG 3.91Å; C853-M856 WeakPolarHBondContact O-CB 3.46Å; C853-M856 PolarHBondContact O-N 2.99Å; P854-M856 PolarHBondContact O-N 3.32Å; P854-M856 VanDerWaalsContact O-N 3.15Å; M856-T862 WeakPolarHBondContact O-CA 3.44Å; M856-T862 PolarHBondContact O-OG1 3.22Å; M856-L864 HydrophobicContact CE-CB 4.41Å; M856-W865 HydrophobicContact CE-CB 4.18Å; M856-L868 HydrophobicContact CE-CD2 4.02Å
857M83.8Confident90.8Very high8 Ų838.4 Ų38.44%0.03920%0.203CC..Hα-helixtrans-101-38.5179.5-64-61.2-74.900111.8P854 A855 T862 L935 R942 V943 M946P854-M857 PolarHBondContact O-N 3.44Å; A855-M857 PolarHBondContact O-N 3.08Å; M857-T862 PolarHBondContact O-OG1 2.97Å; M857-L935 HydrophobicContact SD-CD2 4.44Å; M857-R942 HydrophobicContact CE-CG 3.92Å; M857-R942 PolarHBondContact O-NH2 2.9Å; M857-V943 HydrophobicContact CE-CG2 4.36Å; M857-M946 HydrophobicContact CE-SD 3.71Å; M857-M946 HydrophobicContact SD-CE 4.19Å; M857-M946 HydrophobicContact SD-SD 4.05Å
858D78.1Confident90.7Very high106 Ų10638.4 Ų38.457%0.56720%0.203SC*.Hα-helixtrans-11113.2-164-61.5-40.3000115P854 R942P854-D858 PolarHBondContact O-N 3.36Å; D858-R942 IonicContact OD1-CZ 2.68Å; D858-R942 VanDerWaalsContact OD1-CZ 3.26Å; D858-R942 IonicContact OD1-NH1 2.59Å; D858-R942 PolarHBondContact OD1-NH1 2.78Å; D858-R942 IonicContact OD1-NH2 3.69Å; D858-R942 PolarHBondContact OD1-NH2 3.36Å
859T81.3Confident90.7Very high65 Ų6536 Ų3640%0.39919%0.192SC..SBendtrans-135.1-172-178.377.10000112.7A855 Y861 T862A855-T859 HydrophobicContact CB-CG2 4.21Å; A855-T859 WeakPolarHBondContact O-CB 3.38Å; A855-T859 PolarHBondContact O-N 3.03Å; A855-T859 PolarHBondContact O-OG1 3.28Å; T859-Y861 PolarHBondContact O-N 2.99Å; T859-Y861 VanDerWaalsContact O-N 3.08Å; T859-Y861 WeakPolarHBondContact OG1-CD2 3.33Å; T859-Y861 PolarHBondContact OG1-N 3.03Å; T859-T862 PolarHBondContact O-N 3.46Å; T859-T862 PolarHBondContact O-OG1 2.96Å
860E80.9Confident90.6Very high100 Ų10039.6 Ų39.647%0.46721%0.209SC..THydrogen-bonded Turntrans-62-10.6173.667.4-171.6143.500114.3K816 T862 K863K816-E860 WeakPolarHBondContact CD-OE1 3.31Å; K816-E860 WeakPolarHBondContact CE-OE1 3.43Å; K816-E860 IonicContact NZ-OE1 3.11Å; K816-E860 PolarHBondContact NZ-OE1 2.96Å; K816-E860 IonicContact NZ-OE2 3.34Å; K816-E860 PolarHBondContact NZ-OE2 3.09Å; E860-T862 VanDerWaalsContact C-N 3.32Å; E860-K863 WeakPolarHBondContact O-CG 3.21Å
861Y88.6Confident90.6Very high16 Ų1640.1 Ų40.16%0.06321%0.214CC..THydrogen-bonded Turntrans-78.2-10.6176.4-53.3-35000114.1D811 K816 F818 A855 T859 K863 L864D811-Y861 PolarHBondContact OD1-OH 3.34Å; D811-Y861 PolarHBondContact OD2-OH 3.03Å; K816-Y861 WeakPolarHBondContact CA-OH 3.34Å; F818-Y861 HydrophobicContact CB-CE2 4.45Å; F818-Y861 AromaticContact CD1-CD2 3.87Å; F818-Y861 HydrophobicContact CD1-CD2 3.87Å; F818-Y861 AromaticContact CD1-CE2 3.74Å; F818-Y861 HydrophobicContact CD1-CE2 3.74Å; F818-Y861 HydrophobicContact CE1-CD2 4.35Å; A855-Y861 HydrophobicContact CB-CD2 3.98Å; A855-Y861 HydrophobicContact CB-CE2 4.29Å; T859-Y861 PolarHBondContact O-N 2.99Å; T859-Y861 VanDerWaalsContact O-N 3.08Å; T859-Y861 WeakPolarHBondContact OG1-CD2 3.33Å; T859-Y861 PolarHBondContact OG1-N 3.03Å; Y861-K863 PolarHBondContact O-N 3.45Å; Y861-K863 VanDerWaalsContact O-N 3.09Å; Y861-L864 WeakPolarHBondContact O-CB 3.44Å; Y861-L864 PolarHBondContact O-N 3.24Å
862T89.7Confident90.8Very high42 Ų4239.1 Ų39.126%0.25821%0.208SC..Hα-helixtrans-55.6-31.3179.1-52.50000113.3M856 M857 T859 E860 L864 W865 M946M856-T862 WeakPolarHBondContact O-CA 3.44Å; M856-T862 PolarHBondContact O-OG1 3.22Å; M857-T862 PolarHBondContact O-OG1 2.97Å; T859-T862 PolarHBondContact O-N 3.46Å; T859-T862 PolarHBondContact O-OG1 2.96Å; E860-T862 VanDerWaalsContact C-N 3.32Å; T862-L864 PolarHBondContact O-N 2.84Å; T862-W865 WeakPolarHBondContact O-CB 3.15Å; T862-W865 PolarHBondContact O-N 3.27Å; T862-M946 HydrophobicContact CG2-CE 3.68Å; T862-M946 HydrophobicContact CG2-SD 4.32Å
863K90.4Very high90.8Very high142 Ų14235 Ų3562%0.61719%0.189SC*.Hα-helixtrans-61.3-24.1174.770.5-174.8179.5168.20113.8E860 Y861 P867E860-K863 WeakPolarHBondContact O-CG 3.21Å; Y861-K863 PolarHBondContact O-N 3.45Å; Y861-K863 VanDerWaalsContact O-N 3.09Å; K863-P867 WeakPolarHBondContact O-CD 3.27Å
864L93.3Very high90.9Very high12 Ų1235.1 Ų35.16%0.06319%0.191CC..Hα-helixtrans-90.9-12.2-179.1-58177.4000112.7G819 L822 E823 I827 M856 Y861 T862 P867 L868G819-L864 WeakPolarHBondContact O-CD1 3.34Å; L822-L864 HydrophobicContact CB-CD1 4.19Å; E823-L864 HydrophobicContact CB-CD1 4.24Å; E823-L864 HydrophobicContact CB-CD2 3.87Å; E823-L864 HydrophobicContact CG-CD2 3.87Å; I827-L864 HydrophobicContact CD1-CB 4.43Å; I827-L864 HydrophobicContact CD1-CD2 4.41Å; M856-L864 HydrophobicContact CE-CB 4.41Å; Y861-L864 WeakPolarHBondContact O-CB 3.44Å; Y861-L864 PolarHBondContact O-N 3.24Å; T862-L864 PolarHBondContact O-N 2.84Å; L864-P867 WeakPolarHBondContact O-CD 3.38Å; L864-L868 VanDerWaalsContact O-CB 3.22Å; L864-L868 WeakPolarHBondContact O-CB 3.29Å; L864-L868 PolarHBondContact O-N 3.33Å
865W94.4Very high91.1Very high0 Ų032 Ų320%017%0.17CC..Hα-helixtrans-61.6-51.2-176.1-169.398.1000112.1L850 M856 T862 L868 L869 L932 L935 V943 M946 L947L850-W865 HydrophobicContact CD2-CD2 3.99Å; L850-W865 HydrophobicContact CD2-CG 3.96Å; L850-W865 HydrophobicContact CD2-CZ2 4.47Å; L850-W865 WeakPolarHBondContact CD2-O 3.12Å; L850-W865 PolarHBondContact O-NE1 3.49Å; M856-W865 HydrophobicContact CE-CB 4.18Å; T862-W865 WeakPolarHBondContact O-CB 3.15Å; T862-W865 PolarHBondContact O-N 3.27Å; W865-L868 PolarHBondContact O-N 3.42Å; W865-L869 HydrophobicContact CH2-CD2 3.73Å; W865-L869 HydrophobicContact CZ3-CB 4.41Å; W865-L869 HydrophobicContact CZ3-CD2 3.61Å; W865-L869 PolarHBondContact O-N 3.19Å; W865-L932 HydrophobicContact CH2-CD2 3.79Å; W865-L932 HydrophobicContact CZ2-CD2 3.6Å; W865-L935 HydrophobicContact CZ2-CD2 4.25Å; W865-V943 HydrophobicContact CH2-CG1 4Å; W865-V943 HydrophobicContact CZ2-CG1 4.42Å; W865-M946 HydrophobicContact CB-CE 3.58Å; W865-M946 HydrophobicContact CD2-CE 3.65Å; W865-M946 HydrophobicContact CE3-CE 3.75Å; W865-M946 HydrophobicContact CG-CE 3.58Å; W865-L947 HydrophobicContact CH2-CD2 4.17Å; W865-L947 HydrophobicContact CZ3-CD2 3.83Å; W865-L947 HydrophobicContact CZ3-CG 4.42Å
866T93.4Very high91.3Very high7 Ų733 Ų334%0.04317%0.172CC..Hα-helixtrans-67.8-44.8-179-48.90000113L868 L869 Q870 S950 L951T866-L868 VanDerWaalsContact C-N 3.3Å; T866-L868 PolarHBondContact O-N 3.22Å; T866-L869 PolarHBondContact O-N 3.46Å; T866-Q870 PolarHBondContact O-N 3.07Å; T866-S950 VanDerWaalsContact CG2-C 3.49Å; T866-L951 HydrophobicContact CG2-CB 3.72Å; T866-L951 HydrophobicContact CG2-CD1 3.9Å; T866-L951 HydrophobicContact CG2-CG 4.42Å
867P94.9Very high91.5Very high53 Ų5336 Ų3634%0.34419%0.186SC..Hα-helixtrans-56.3-40.1171.5-28.736.2000113.9I827 K863 L864 Q870 A871I827-P867 HydrophobicContact CD1-CB 3.99Å; I827-P867 HydrophobicContact CG2-CB 4.35Å; K863-P867 WeakPolarHBondContact O-CD 3.27Å; L864-P867 WeakPolarHBondContact O-CD 3.38Å; P867-Q870 PolarHBondContact O-N 3.4Å; P867-A871 PolarHBondContact O-N 3.44Å
868L96.1Very high91.8Very high0 Ų040.7 Ų40.70%021%0.211CC..Hα-helixtrans-67.6-40.9178-178.163.7000112.3L822 I826 I827 I846 I849 L850 M856 L864 W865 T866 Q870 A871 L872L822-L868 HydrophobicContact CD2-CD1 4.29Å; L822-L868 HydrophobicContact CD2-CD2 4.03Å; I826-L868 HydrophobicContact CG2-CD1 3.85Å; I827-L868 HydrophobicContact CD1-CB 4.25Å; I827-L868 HydrophobicContact CG1-CB 4.16Å; I827-L868 HydrophobicContact CG1-CD1 3.99Å; I846-L868 HydrophobicContact CD1-CD1 4.5Å; I846-L868 HydrophobicContact CG1-CD1 4.43Å; I846-L868 HydrophobicContact CG2-CD1 3.69Å; I846-L868 HydrophobicContact CG2-CD2 4.1Å; I846-L868 HydrophobicContact CG2-CG 3.65Å; I849-L868 HydrophobicContact CB-CD2 4.42Å; I849-L868 HydrophobicContact CG2-CD2 3.71Å; L850-L868 HydrophobicContact CD2-CB 4.09Å; L850-L868 HydrophobicContact CD2-CD2 3.87Å; L850-L868 HydrophobicContact CD2-CG 4.03Å; L850-L868 HydrophobicContact CG-CD2 4.03Å; L850-L868 HydrophobicContact CG-CG 4.25Å; M856-L868 HydrophobicContact CE-CD2 4.02Å; L864-L868 VanDerWaalsContact O-CB 3.22Å; L864-L868 WeakPolarHBondContact O-CB 3.29Å; L864-L868 PolarHBondContact O-N 3.33Å; W865-L868 PolarHBondContact O-N 3.42Å; T866-L868 VanDerWaalsContact C-N 3.3Å; T866-L868 PolarHBondContact O-N 3.22Å; L868-Q870 VanDerWaalsContact C-N 3.33Å; L868-A871 PolarHBondContact O-N 3.23Å; L868-L872 PolarHBondContact O-N 3.07Å
869L96Very high92.2Very high0 Ų041 Ų410%022%0.218CC..Hα-helixtrans-62.5-41.4172.7176.962.8000111.5L850 W865 T866 A871 L872 I873 L928 L932 L947 L951 L959L850-L869 HydrophobicContact CD1-CB 4.1Å; L850-L869 HydrophobicContact CD1-CD1 4.02Å; L850-L869 HydrophobicContact CD2-CB 4.28Å; W865-L869 HydrophobicContact CH2-CD2 3.73Å; W865-L869 HydrophobicContact CZ3-CB 4.41Å; W865-L869 HydrophobicContact CZ3-CD2 3.61Å; W865-L869 PolarHBondContact O-N 3.19Å; T866-L869 PolarHBondContact O-N 3.46Å; L869-A871 VanDerWaalsContact C-N 3.35Å; L869-A871 PolarHBondContact O-N 3.08Å; L869-L872 PolarHBondContact O-N 2.96Å; L869-I873 HydrophobicContact CD1-CD1 4.14Å; L869-I873 HydrophobicContact CD1-CG1 4.36Å; L869-I873 HydrophobicContact CG-CD1 4.01Å; L869-I873 WeakPolarHBondContact O-CG1 3.18Å; L869-I873 PolarHBondContact O-N 3.15Å; L869-L928 HydrophobicContact CD1-CD1 4.11Å; L869-L928 HydrophobicContact CD1-CD2 3.96Å; L869-L932 HydrophobicContact CD1-CD1 4.28Å; L869-L947 HydrophobicContact CD2-CD2 3.33Å; L869-L951 HydrophobicContact CD2-CD2 4.33Å; L869-L959 HydrophobicContact CD2-CD2 4.22Å
870Q95.5Very high92.4Very high76 Ų7641.4 Ų41.436%0.35522%0.216SC..Hα-helixtrans-62.8-42176.6-170.2171.3-52.200111.7T866 P867 L868 L872 I873 G874 L951 A955T866-Q870 PolarHBondContact O-N 3.07Å; P867-Q870 PolarHBondContact O-N 3.4Å; L868-Q870 VanDerWaalsContact C-N 3.33Å; Q870-L872 VanDerWaalsContact C-N 3.33Å; Q870-L872 PolarHBondContact O-N 3.01Å; Q870-I873 PolarHBondContact O-N 3.32Å; Q870-G874 PolarHBondContact O-N 2.93Å; Q870-L951 HydrophobicContact CB-CD1 3.81Å; Q870-L951 HydrophobicContact CG-CD1 4.28Å; Q870-A955 HydrophobicContact CG-CB 4.43Å
871A95.9Very high92.6Very high13 Ų1339.2 Ų39.211%0.10721%0.207CC..Hα-helixtrans-62.8-39.2175.900000112.1I827 V830 Q831 P867 L868 L869 G874 L875I827-A871 HydrophobicContact CG2-CB 4.41Å; V830-A871 HydrophobicContact CG1-CB 3.83Å; Q831-A871 PolarHBondContact NE2-O 3.12Å; Q831-A871 VanDerWaalsContact NE2-O 3.14Å; P867-A871 PolarHBondContact O-N 3.44Å; L868-A871 PolarHBondContact O-N 3.23Å; L869-A871 VanDerWaalsContact C-N 3.35Å; L869-A871 PolarHBondContact O-N 3.08Å; A871-G874 PolarHBondContact O-N 2.99Å; A871-L875 PolarHBondContact O-N 2.87Å
872L96.9Very high92.2Very high0 Ų044.3 Ų44.30%024%0.235CC..Hα-helixtrans-64.8-42.7174.2177.957.8000112.5A843 I846 L850 L868 L869 Q870 G874 L875 F876 L928A843-L872 HydrophobicContact CB-CD1 3.92Å; I846-L872 HydrophobicContact CB-CD1 4.36Å; I846-L872 HydrophobicContact CB-CD2 4.33Å; I846-L872 HydrophobicContact CG2-CB 3.99Å; I846-L872 HydrophobicContact CG2-CD2 3.97Å; I846-L872 HydrophobicContact CG2-CG 4.39Å; L850-L872 HydrophobicContact CD1-CD2 4.01Å; L868-L872 PolarHBondContact O-N 3.07Å; L869-L872 PolarHBondContact O-N 2.96Å; Q870-L872 VanDerWaalsContact C-N 3.33Å; Q870-L872 PolarHBondContact O-N 3.01Å; L872-G874 VanDerWaalsContact C-N 3.3Å; L872-L875 HydrophobicContact CD1-CD2 4.5Å; L872-L875 WeakPolarHBondContact O-CB 3.37Å; L872-L875 PolarHBondContact O-N 3.48Å; L872-L875 VanDerWaalsContact O-N 3.16Å; L872-F876 HydrophobicContact CD1-CE1 4.11Å; L872-F876 HydrophobicContact CD1-CE2 3.97Å; L872-F876 HydrophobicContact CD1-CZ 3.62Å; L872-F876 HydrophobicContact CG-CE2 3.88Å; L872-F876 HydrophobicContact CG-CZ 4.04Å; L872-F876 WeakPolarHBondContact O-CD2 3.37Å; L872-F876 PolarHBondContact O-N 2.72Å; L872-L928 HydrophobicContact CD2-CD1 3.74Å; L872-L928 HydrophobicContact CD2-CD2 3.78Å; L872-L928 HydrophobicContact CD2-CG 4.28Å; L872-L928 HydrophobicContact CG-CD2 4.24Å
873I96.3Very high91.6Very high4 Ų445 Ų452%0.02124%0.242CC..Hα-helixtrans-64.9-39.4175.2-65.3166.5000110.2L869 Q870 L875 F876 E877 L951 A955 F958 L959 Y962L869-I873 HydrophobicContact CD1-CD1 4.14Å; L869-I873 HydrophobicContact CD1-CG1 4.36Å; L869-I873 HydrophobicContact CG-CD1 4.01Å; L869-I873 WeakPolarHBondContact O-CG1 3.18Å; L869-I873 PolarHBondContact O-N 3.15Å; Q870-I873 PolarHBondContact O-N 3.32Å; I873-L875 VanDerWaalsContact C-N 3.26Å; I873-L875 PolarHBondContact O-N 3Å; I873-F876 WeakPolarHBondContact O-CB 3.38Å; I873-F876 PolarHBondContact O-N 2.68Å; I873-F876 VanDerWaalsContact O-N 3.12Å; I873-E877 HydrophobicContact CG2-CG 4.32Å; I873-E877 PolarHBondContact O-N 2.93Å; I873-L951 HydrophobicContact CD1-CD2 4.38Å; I873-A955 HydrophobicContact CB-CB 4.18Å; I873-A955 HydrophobicContact CD1-CB 3.79Å; I873-A955 HydrophobicContact CG2-CB 3.82Å; I873-F958 HydrophobicContact CG2-CB 4Å; I873-F958 HydrophobicContact CG2-CD2 4.42Å; I873-L959 HydrophobicContact CD1-CB 4.14Å; I873-Y962 HydrophobicContact CG1-CE2 4.27Å
874G94Very high90.5Very high7 Ų743.5 Ų43.57%0.07224%0.239CC..Hα-helixtrans-54.2-44.5171.400000111.6Q831 Q870 A871 L872 F876 E877 L878Q831-G874 PolarHBondContact OE1-O 3.02Å; Q870-G874 PolarHBondContact O-N 2.93Å; A871-G874 PolarHBondContact O-N 2.99Å; L872-G874 VanDerWaalsContact C-N 3.3Å; G874-F876 PolarHBondContact O-N 3.1Å; G874-E877 PolarHBondContact O-N 2.88Å; G874-E877 VanDerWaalsContact O-N 3.1Å; G874-L878 WeakPolarHBondContact O-CB 3.33Å; G874-L878 PolarHBondContact O-N 3.05Å
875L94.3Very high89.1Confident9 Ų945 Ų455%0.04725%0.25CS..Hα-helixtrans-62.1-24.1-176.4-173.966.5000111.8V830 K839 C842 A871 L872 I873V830-L875 HydrophobicContact CG2-CD1 4.28Å; V830-L875 HydrophobicContact CG2-CD2 4.01Å; V830-L875 WeakPolarHBondContact O-CD1 3.48Å; K839-L875 HydrophobicContact CG-CD1 4.09Å; C842-L875 HydrophobicContact CB-CD2 3.99Å; A871-L875 PolarHBondContact O-N 2.87Å; L872-L875 HydrophobicContact CD1-CD2 4.5Å; L872-L875 WeakPolarHBondContact O-CB 3.37Å; L872-L875 PolarHBondContact O-N 3.48Å; L872-L875 VanDerWaalsContact O-N 3.16Å; I873-L875 VanDerWaalsContact C-N 3.26Å; I873-L875 PolarHBondContact O-N 3Å
876F93.6Very high86.9Confident33 Ų3351.7 Ų51.715%0.14529%0.286CS..Hα-helixtrans-88.6-27.2179.6-66.9-28.3000115A843 L872 I873 G874 P924 K925 L928 Y962A843-F876 HydrophobicContact CB-CE1 3.48Å; A843-F876 VanDerWaalsContact CB-CE1 3.48Å; A843-F876 HydrophobicContact CB-CZ 3.77Å; L872-F876 HydrophobicContact CD1-CE1 4.11Å; L872-F876 HydrophobicContact CD1-CE2 3.97Å; L872-F876 HydrophobicContact CD1-CZ 3.62Å; L872-F876 HydrophobicContact CG-CE2 3.88Å; L872-F876 HydrophobicContact CG-CZ 4.04Å; L872-F876 WeakPolarHBondContact O-CD2 3.37Å; L872-F876 PolarHBondContact O-N 2.72Å; I873-F876 WeakPolarHBondContact O-CB 3.38Å; I873-F876 PolarHBondContact O-N 2.68Å; I873-F876 VanDerWaalsContact O-N 3.12Å; G874-F876 PolarHBondContact O-N 3.1Å; F876-P924 HydrophobicContact CE1-CB 3.89Å; F876-P924 HydrophobicContact CZ-CB 4.02Å; F876-K925 HydrophobicContact CB-CD 4.27Å; F876-K925 HydrophobicContact CB-CG 4.42Å; F876-K925 HydrophobicContact CD1-CG 4.19Å; F876-K925 HydrophobicContact CD2-CD 4.49Å; F876-K925 HydrophobicContact CD2-CG 3.9Å; F876-K925 HydrophobicContact CE1-CG 4.4Å; F876-K925 HydrophobicContact CE2-CG 4.13Å; F876-K925 HydrophobicContact CG-CD 4.32Å; F876-K925 HydrophobicContact CG-CG 3.93Å; F876-K925 HydrophobicContact CZ-CG 4.37Å; F876-K925 PolarHBondContact O-NZ 3.06Å; F876-L928 HydrophobicContact CE2-CD2 3.89Å; F876-Y962 AromaticContact CD2-CE2 4Å; F876-Y962 HydrophobicContact CD2-CE2 4Å
877E93.6Very high85Confident64 Ų6459.3 Ų59.330%0.29933%0.326SS..Hα-helixtrans-124.9-25.8-164.8-56.9-57.5154.900113.9I873 G874 K925 F958 Y962I873-E877 HydrophobicContact CG2-CG 4.32Å; I873-E877 PolarHBondContact O-N 2.93Å; G874-E877 PolarHBondContact O-N 2.88Å; G874-E877 VanDerWaalsContact O-N 3.1Å; E877-K925 IonicContact OE1-NZ 2.79Å; E877-K925 PolarHBondContact OE1-NZ 3.49Å; E877-K925 IonicContact OE2-NZ 2.72Å; E877-F958 HydrophobicContact CB-CD2 4.47Å; E877-F958 HydrophobicContact CB-CE1 4.39Å; E877-F958 HydrophobicContact CB-CE2 4.25Å; E877-F958 HydrophobicContact CB-CZ 4.21Å; E877-F958 HydrophobicContact CG-CB 4.33Å; E877-F958 HydrophobicContact CG-CD1 3.76Å; E877-F958 HydrophobicContact CG-CD2 4.04Å; E877-F958 HydrophobicContact CG-CE1 3.98Å; E877-F958 HydrophobicContact CG-CE2 4.25Å; E877-F958 HydrophobicContact CG-CG 3.8Å; E877-F958 HydrophobicContact CG-CZ 4.21Å; E877-Y962 VanDerWaalsContact CD-OH 3.24Å; E877-Y962 WeakPolarHBondContact CG-OH 3.35Å; E877-Y962 VanDerWaalsContact OE1-CE1 3.3Å; E877-Y962 WeakPolarHBondContact OE1-CE1 3.35Å; E877-Y962 VanDerWaalsContact OE1-CZ 3.29Å; E877-Y962 PolarHBondContact OE1-OH 3.01Å
878L90.4Very high83.1Confident106 Ų10659 Ų5956%0.55532%0.32SS*.SBendtrans-92.5153-179.4-61.7179000111G874G874-L878 WeakPolarHBondContact O-CB 3.33Å; G874-L878 PolarHBondContact O-N 3.05Å
879P86.8Confident80.5Confident111 Ų11166.9 Ų66.972%0.72136%0.357SS*.PPolyproline II helixtrans-63.4160.8170.329.1-35.3000111
880E86Confident77.9Confident75 Ų7572.9 Ų72.935%0.3538%0.383SS..PPolyproline II helixtrans-60.3140.2175.9-63.3-178.7-174.300110.6S834 K839 D882S834-E880 WeakPolarHBondContact CB-OE2 3.34Å; K839-E880 WeakPolarHBondContact CE-OE1 3.17Å; K839-E880 IonicContact NZ-OE1 3.26Å; K839-E880 PolarHBondContact NZ-OE1 3.19Å; E880-D882 PolarHBondContact O-N 3.14Å
881D85.2Confident75Confident53 Ų5375.5 Ų75.528%0.28340%0.398SS..  trans-84.1107.8172.3177.711.4000109.5Q831 K832 S883Q831-D881 HydrophobicContact CB-CB 3.77Å; Q831-D881 PolarHBondContact O-N 3.12Å; Q831-D881 VanDerWaalsContact O-N 3.09Å; K832-D881 VanDerWaalsContact CE-OD2 3.31Å; K832-D881 WeakPolarHBondContact CE-OD2 3.49Å; K832-D881 HydrophobicContact CG-CB 3.93Å; D881-S883 VanDerWaalsContact C-N 3.34Å; D881-S883 VanDerWaalsContact CG-OG 3.22Å; D881-S883 WeakPolarHBondContact OD1-CB 3.47Å; D881-S883 PolarHBondContact OD1-N 3.41Å; D881-S883 PolarHBondContact OD1-OG 3.46Å; D881-S883 PolarHBondContact OD2-OG 3.36Å; D881-S883 VanDerWaalsContact OD2-OG 3.12Å
882D78.5Confident72Confident123 Ų12381.7 Ų81.766%0.65843%0.43SS*.  trans-92.711.5179-68-36000113E880 I884E880-D882 PolarHBondContact O-N 3.14Å; D882-I884 PolarHBondContact O-N 2.92Å
883S77.6Confident69.1Low57 Ų5784.4 Ų84.440%0.39944%0.443SS..PPolyproline II helixtrans-65.712717764.50000112K832 D881K832-S883 WeakPolarHBondContact CE-OG 3.47Å; K832-S883 PolarHBondContact NZ-O 3.17Å; D881-S883 VanDerWaalsContact C-N 3.34Å; D881-S883 VanDerWaalsContact CG-OG 3.22Å; D881-S883 WeakPolarHBondContact OD1-CB 3.47Å; D881-S883 PolarHBondContact OD1-N 3.41Å; D881-S883 PolarHBondContact OD1-OG 3.46Å; D881-S883 PolarHBondContact OD2-OG 3.36Å; D881-S883 VanDerWaalsContact OD2-OG 3.12Å
884I68.8Low66.1Low110 Ų11092.5 Ų92.556%0.56448%0.481SS*.PPolyproline II helixtrans-102.8133.1175-57.9173.9000107.2D882 E888D882-I884 PolarHBondContact O-N 2.92Å; I884-E888 HydrophobicContact CG2-CB 3.71Å; I884-E888 HydrophobicContact CG2-CG 4.13Å
885P62.5Low63.3Low45 Ų4598.9 Ų98.929%0.29251%0.514SS..PPolyproline II helixtrans-54.9140.4172.5-2232.1000112T784 D887 E888T784-P885 VanDerWaalsContact OG1-CD 3.24Å; T784-P885 WeakPolarHBondContact OG1-CD 3.34Å; P885-D887 PolarHBondContact O-N 2.83Å; P885-E888 HydrophobicContact CB-CB 4.4Å; P885-E888 VanDerWaalsContact CD-OE2 3.27Å; P885-E888 WeakPolarHBondContact CD-OE2 3.45Å; P885-E888 WeakPolarHBondContact O-CB 3.31Å; P885-E888 PolarHBondContact O-N 3.48Å
886D49Very low60.4Low140 Ų140102.3 Ų102.375%0.74954%0.535SS*.THydrogen-bonded Turntrans-56.2-26.5179.8-65.5-29.2000113.1E888 H889D886-E888 VanDerWaalsContact C-N 3.3Å; D886-E888 PolarHBondContact O-N 3.4Å; D886-H889 PolarHBondContact O-CD2 3.22Å; D886-H889 VanDerWaalsContact O-CD2 3.25Å
887D53.3Low57.5Low166 Ų166105.3 Ų105.389%0.88856%0.558SS**THydrogen-bonded Turntrans-81.2-6.5178.4-49.8-33.2000113.3P885P885-D887 PolarHBondContact O-N 2.83Å
888E54Low54.8Low46 Ų46104.4 Ų104.422%0.21557%0.565CS.*  trans-101.238.3-179.5-161.2178.2-169.800111.2T783 T784 I884 P885 D886 F890T783-E888 VanDerWaalsContact CA-OE1 3.29Å; T783-E888 WeakPolarHBondContact CA-OE1 3.21Å; T783-E888 VanDerWaalsContact CB-OE1 3.23Å; T783-E888 WeakPolarHBondContact CB-OE1 3.3Å; T784-E888 WeakPolarHBondContact CB-OE2 3.43Å; T784-E888 PolarHBondContact N-OE1 2.9Å; T784-E888 PolarHBondContact N-OE2 3.45Å; T784-E888 PolarHBondContact OG1-OE2 2.91Å; I884-E888 HydrophobicContact CG2-CB 3.71Å; I884-E888 HydrophobicContact CG2-CG 4.13Å; P885-E888 HydrophobicContact CB-CB 4.4Å; P885-E888 VanDerWaalsContact CD-OE2 3.27Å; P885-E888 WeakPolarHBondContact CD-OE2 3.45Å; P885-E888 WeakPolarHBondContact O-CB 3.31Å; P885-E888 PolarHBondContact O-N 3.48Å; D886-E888 VanDerWaalsContact C-N 3.3Å; D886-E888 PolarHBondContact O-N 3.4Å; E888-F890 PolarHBondContact O-N 3.05Å
889H41.9Very low52.4Low166 Ų166110 Ų11077%0.76958%0.581SS**  trans-70.562.1161.2-76.7-50.3000110.4D886 I891D886-H889 PolarHBondContact O-CD2 3.22Å; D886-H889 VanDerWaalsContact O-CD2 3.25Å; H889-I891 VanDerWaalsContact C-N 3.35Å; H889-I891 PolarHBondContact O-N 3.16Å
890F42.7Very low50.4Low126 Ų126110.8 Ų110.855%0.55358%0.575SS**  trans-7099.8162.6-133-95.4000106.1K741 E888 D892K741-F890 HydrophobicContact CD-CE2 4.2Å; E888-F890 PolarHBondContact O-N 3.05Å; F890-D892 VanDerWaalsContact C-N 3.31Å; F890-D892 PolarHBondContact O-N 3.32Å
891I34.6Very low48.9Very low131 Ų131109.2 Ų109.267%0.67257%0.57SS**  trans-63.1107.6157.6-60.7171000103.3H889 I893H889-I891 VanDerWaalsContact C-N 3.35Å; H889-I891 PolarHBondContact O-N 3.16Å; I891-I893 PolarHBondContact O-N 2.98Å
892D32.6Very low47.9Very low144 Ų144109.8 Ų109.877%0.7758%0.582SS**  trans-53.7104.1167.8-140-3000104.4F890 E894F890-D892 VanDerWaalsContact C-N 3.31Å; F890-D892 PolarHBondContact O-N 3.32Å; D892-E894 PolarHBondContact O-N 3.43Å
893I36.1Very low47.9Very low56 Ų56107.3 Ų107.329%0.28757%0.566SS.*  trans-68.798.9175.5-63.6178.5000101.8I891 D895 T896I891-I893 PolarHBondContact O-N 2.98Å; I893-D895 PolarHBondContact O-N 3.45Å; I893-T896 WeakPolarHBondContact CG2-OG1 3.48Å
894E33.2Very low48.1Very low175 Ų175106.9 Ų106.982%0.81856%0.563SS**  trans-36.5116.6159.1-88.3-172.2155.600105.8D892 T896D892-E894 PolarHBondContact O-N 3.43Å; E894-T896 PolarHBondContact O-N 3.39Å
895D35.5Very low48.9Very low141 Ų141107.5 Ų107.575%0.75456%0.563SS**  trans-28.7104.1-176.3-84.4-45000108I893 P897I893-D895 PolarHBondContact O-N 3.45Å; D895-P897 WeakPolarHBondContact O-CD 3.49Å
896T32.6Very low50.1Low80 Ų80105.4 Ų105.449%0.49155%0.55SS..  trans-55.4121.9171.3-57.60000103I893 E894 G898I893-T896 WeakPolarHBondContact CG2-OG1 3.48Å; E894-T896 PolarHBondContact O-N 3.39Å; T896-G898 PolarHBondContact O-N 2.97Å
897P32.4Very low51.8Low96 Ų96101.9 Ų101.962%0.62354%0.54SS*.  trans-71.876.4-17326-31.5000108K71 D895K71-P897 PolarHBondContact NZ-O 3.37Å; D895-P897 WeakPolarHBondContact O-CD 3.49Å
898G36.3Very low53.2Low45 Ų4595.7 Ų95.746%0.46451%0.505SS..  trans-86.3159.516500000108.1T896 Q900T896-G898 PolarHBondContact O-N 2.97Å; G898-Q900 PolarHBondContact O-N 3.27Å
899Y40.7Very low54.5Low225 Ų22593.6 Ų93.688%0.88250%0.496SS*.SBendtrans-67.523.8179.9-86.4-95.5000114
900Q45.5Very low55.9Low126 Ų12686.8 Ų86.859%0.58947%0.47SS*.  trans-90.6126.3174.3-67.9-170.31.300109.4T698 G898 A902T698-Q900 PolarHBondContact OG1-OE1 2.98Å; T698-Q900 VanDerWaalsContact OG1-OE1 3.07Å; G898-Q900 PolarHBondContact O-N 3.27Å; Q900-A902 PolarHBondContact O-N 3.42Å; Q900-A902 VanDerWaalsContact O-N 3.12Å
901T53.2Low57.1Low42 Ų4286.4 Ų86.426%0.25847%0.465SS..  trans-63.9110.8173.331.80000109.9Q657 E658Q657-T901 PolarHBondContact O-OG1 2.72Å; E658-T901 HydrophobicContact CB-CG2 4.21Å; E658-T901 HydrophobicContact CG-CG2 3.78Å
902A64.1Low58.7Low65 Ų6588 Ų8854%0.53747%0.467SS..  trans-61.5142.2178.400000111.3Q900 S904Q900-A902 PolarHBondContact O-N 3.42Å; Q900-A902 VanDerWaalsContact O-N 3.12Å; A902-S904 PolarHBondContact O-N 3.22Å
903F78.6Confident60.5Low72 Ų7288.4 Ų88.432%0.31647%0.465SS..  trans-63.9125.1174.9170.9-113.7000110.2P661 P702 P703 Q905P661-F903 HydrophobicContact CB-CD2 4.39Å; P702-F903 HydrophobicContact CB-CD1 4.27Å; P702-F903 HydrophobicContact CB-CD2 4.45Å; P702-F903 HydrophobicContact CB-CE1 4.03Å; P702-F903 HydrophobicContact CB-CE2 4.24Å; P702-F903 HydrophobicContact CB-CG 4.47Å; P702-F903 HydrophobicContact CB-CZ 4.01Å; P702-F903 HydrophobicContact CG-CD1 4.03Å; P702-F903 HydrophobicContact CG-CD2 4.46Å; P702-F903 HydrophobicContact CG-CE1 4.28Å; P702-F903 HydrophobicContact CG-CG 4.12Å; P703-F903 HydrophobicContact CB-CE2 4.16Å; P703-F903 HydrophobicContact CG-CD2 4.09Å; P703-F903 HydrophobicContact CG-CE2 3.92Å; F903-Q905 HydrophobicContact CE1-CB 3.82Å; F903-Q905 HydrophobicContact CE1-CG 4.49Å; F903-Q905 HydrophobicContact CZ-CB 3.83Å; F903-Q905 HydrophobicContact CZ-CG 4.24Å
904S82.6Confident62.7Low47 Ų4790 Ų9033%0.32947%0.471SS..  trans-116114.8172.7-68.10000109.8Y662 Q665 A902Y662-S904 WeakPolarHBondContact OH-CB 3.47Å; Q665-S904 PolarHBondContact NE2-O 3.4Å; A902-S904 PolarHBondContact O-N 3.22Å
905Q85.6Confident65.2Low124 Ų12483.8 Ų83.858%0.57944%0.443SS*.  trans-75128.1-179.8-173.217511.700110.9H616 F903 A907H616-Q905 PolarHBondContact CE1-O 2.94Å; F903-Q905 HydrophobicContact CE1-CB 3.82Å; F903-Q905 HydrophobicContact CE1-CG 4.49Å; F903-Q905 HydrophobicContact CZ-CB 3.83Å; F903-Q905 HydrophobicContact CZ-CG 4.24Å; Q905-A907 PolarHBondContact O-N 3.02Å
906L87.1Confident67.6Low0 Ų078 Ų780%041%0.413CS..  trans-78.4115.8169-64.3173.7000109.2F619 E620 Y662 Q665 V666 F908 A909 G910F619-L906 HydrophobicContact CB-CD1 3.98Å; F619-L906 HydrophobicContact CB-CD2 3.74Å; E620-L906 HydrophobicContact CB-CD2 4.5Å; E620-L906 HydrophobicContact CG-CD2 3.65Å; E620-L906 WeakPolarHBondContact OE1-CA 3.22Å; Y662-L906 HydrophobicContact CD1-CD1 3.91Å; Y662-L906 HydrophobicContact CD1-CD2 3.62Å; Y662-L906 HydrophobicContact CD1-CG 3.71Å; Y662-L906 HydrophobicContact CE1-CD2 3.62Å; Y662-L906 HydrophobicContact CE1-CG 4.02Å; Q665-L906 HydrophobicContact CB-CD1 3.92Å; V666-L906 HydrophobicContact CG2-CD1 4.24Å; L906-F908 VanDerWaalsContact C-N 3.25Å; L906-F908 PolarHBondContact O-N 3.38Å; L906-A909 HydrophobicContact CB-CB 3.64Å; L906-A909 HydrophobicContact CD1-CB 4.14Å; L906-A909 CarbonylContact O-C 3.58Å; L906-A909 PolarHBondContact O-N 3.14Å; L906-A909 VanDerWaalsContact O-N 3.09Å; L906-G910 PolarHBondContact O-N 3.28Å
907A84.8Confident70.2Confident66 Ų6675.2 Ų75.255%0.54540%0.395SS..G310 helixtrans-58.7-39.117700000111.3E620 Q905 A909 G910E620-A907 WeakPolarHBondContact OE1-CB 3.42Å; E620-A907 PolarHBondContact OE1-N 3.38Å; E620-A907 PolarHBondContact OE2-N 3.36Å; Q905-A907 PolarHBondContact O-N 3.02Å; A907-A909 VanDerWaalsContact C-N 3.31Å; A907-G910 PolarHBondContact O-N 3.13Å
908F84.1Confident72.6Confident37 Ų3771.9 Ų71.916%0.16238%0.378CS..G310 helixtrans-83.1-10.2179.2-58.4-65.7000113.1M577 E620 C623 L624 R627 L906M577-F908 HydrophobicContact CG-CE2 3.99Å; M577-F908 HydrophobicContact SD-CE2 3.9Å; E620-F908 HydrophobicContact CB-CD2 4.07Å; E620-F908 HydrophobicContact CG-CD2 4.41Å; E620-F908 WeakPolarHBondContact OE2-CB 3.38Å; E620-F908 WeakPolarHBondContact OE2-CD2 3.18Å; E620-F908 PolarHBondContact OE2-N 3.21Å; C623-F908 HydrophobicContact CB-CB 3.86Å; L624-F908 HydrophobicContact CD1-CD1 4.45Å; L624-F908 HydrophobicContact CD1-CD2 3.65Å; L624-F908 HydrophobicContact CD1-CE1 4.34Å; L624-F908 HydrophobicContact CD1-CE2 3.53Å; L624-F908 HydrophobicContact CD1-CG 4.13Å; L624-F908 HydrophobicContact CD1-CZ 3.89Å; L624-F908 HydrophobicContact CD2-CB 4.22Å; L624-F908 HydrophobicContact CD2-CD1 3.34Å; L624-F908 HydrophobicContact CD2-CD2 3.98Å; L624-F908 HydrophobicContact CD2-CE1 3.57Å; L624-F908 HydrophobicContact CD2-CE2 4.19Å; L624-F908 HydrophobicContact CD2-CG 3.56Å; L624-F908 HydrophobicContact CD2-CZ 3.99Å; L624-F908 HydrophobicContact CG-CB 3.99Å; L624-F908 HydrophobicContact CG-CD1 3.81Å; L624-F908 HydrophobicContact CG-CD2 3.46Å; L624-F908 VanDerWaalsContact CG-CD2 3.46Å; L624-F908 HydrophobicContact CG-CE1 4.15Å; L624-F908 HydrophobicContact CG-CE2 3.84Å; L624-F908 HydrophobicContact CG-CG 3.45Å; L624-F908 VanDerWaalsContact CG-CG 3.45Å; L624-F908 HydrophobicContact CG-CZ 4.16Å; R627-F908 WeakPolarHBondContact CD-O 3.17Å; R627-F908 PolarHBondContact NH1-O 2.96Å; L906-F908 VanDerWaalsContact C-N 3.25Å; L906-F908 PolarHBondContact O-N 3.38Å
909A81.4Confident74.6Confident1 Ų177.5 Ų77.51%0.00840%0.397CS..G310 helixtrans-97.114.2164.300000112.5Q665 R706 L906 A907Q665-A909 HydrophobicContact CB-CB 4.16Å; R706-A909 PolarHBondContact NH1-O 3.06Å; R706-A909 PolarHBondContact NH2-O 3.24Å; L906-A909 HydrophobicContact CB-CB 3.64Å; L906-A909 HydrophobicContact CD1-CB 4.14Å; L906-A909 CarbonylContact O-C 3.58Å; L906-A909 PolarHBondContact O-N 3.14Å; L906-A909 VanDerWaalsContact O-N 3.09Å; A907-A909 VanDerWaalsContact C-N 3.31Å
910G71.4Confident76.3Confident23 Ų2371.3 Ų71.324%0.23739%0.393CS..PPolyproline II helixtrans-55.6146.5-177.300000114.7L906 A907L906-G910 PolarHBondContact O-N 3.28Å; A907-G910 PolarHBondContact O-N 3.13Å
911R67.3Low78.1Confident119 Ų11966.1 Ų66.145%0.44937%0.37SS..PPolyproline II helixtrans-62.2136.8175.7-171.4177.2178.5-165-5.9109.9
912K68.1Low79.3Confident163 Ų16367.8 Ų67.871%0.70940%0.395SS*.PPolyproline II helixtrans-74136.5169-69.5179.4-177171.20109.3H914K912-H914 PolarHBondContact O-N 3.39Å
913E69.4Low80.6Confident154 Ų15468.3 Ų68.372%0.7239%0.389SS*.PPolyproline II helixtrans-63.4120.1171.1-164173.8-174.100108.1V837V837-E913 HydrophobicContact CG2-CG 4.01Å
914H82.5Confident81.2Confident90 Ų9066 Ų6642%0.41738%0.381SS..  trans-115.5119.8-176.5174.364.4000109E756 K912 P916E756-H914 IonicContact OE1-CD2 3.66Å; E756-H914 IonicContact OE1-CE1 2.68Å; E756-H914 IonicContact OE1-NE2 2.72Å; E756-H914 PolarHBondContact OE1-NE2 2.9Å; E756-H914 IonicContact OE2-CD2 3.12Å; E756-H914 PolarHBondContact OE2-CD2 3.22Å; E756-H914 IonicContact OE2-NE2 3.63Å; E756-H914 PolarHBondContact OE2-NE2 3.03Å; E756-H914 VanDerWaalsContact OE2-NE2 3.11Å; K912-H914 PolarHBondContact O-N 3.39Å; H914-P916 WeakPolarHBondContact O-CD 3.36Å
915D86.6Confident81.8Confident44 Ų4466.5 Ų66.524%0.23538%0.377CS..  trans-98.5107174.6-178.4-8.6000109.6V837 K840 I917 G918V837-D915 HydrophobicContact CG1-CB 4.34Å; V837-D915 HydrophobicContact CG2-CB 4.32Å; K840-D915 WeakPolarHBondContact CD-OD2 3.43Å; K840-D915 VanDerWaalsContact CE-OD2 3.32Å; K840-D915 WeakPolarHBondContact CE-OD2 3.45Å; K840-D915 IonicContact NZ-OD2 2.83Å; K840-D915 PolarHBondContact NZ-OD2 2.9Å; D915-I917 PolarHBondContact O-N 3.24Å; D915-I917 VanDerWaalsContact O-N 3.11Å; D915-I917 WeakPolarHBondContact OD1-CB 3.41Å; D915-I917 PolarHBondContact OD1-N 3.27Å; D915-G918 PolarHBondContact O-N 2.98Å; D915-G918 VanDerWaalsContact O-N 3.1Å; D915-G918 PolarHBondContact OD1-N 3.3Å
916P85.8Confident82.3Confident18 Ų1862.5 Ų62.512%0.11736%0.36CS..SBendtrans-69-9.5-17730.4-37.2000114E756 L796 K800 I841 H914E756-P916 VanDerWaalsContact OE1-CA 3.31Å; E756-P916 WeakPolarHBondContact OE1-CA 3.19Å; E756-P916 WeakPolarHBondContact OE1-CB 3.39Å; L796-P916 HydrophobicContact CD1-CB 3.86Å; L796-P916 HydrophobicContact CD1-CG 3.75Å; K800-P916 PolarHBondContact NZ-O 3.49Å; I841-P916 HydrophobicContact CD1-CG 3.53Å; I841-P916 HydrophobicContact CG1-CG 3.78Å; H914-P916 WeakPolarHBondContact O-CD 3.36Å
917I86.8Confident82.6Confident22 Ų2264.4 Ų64.411%0.11337%0.37CS..SBendtrans-97.6-29.5175.5-63160.8000110.6V799 K840 I841 V844 D915 V921V799-I917 HydrophobicContact CG1-CG1 4.12Å; K840-I917 HydrophobicContact CG-CD1 4.03Å; I841-I917 HydrophobicContact CB-CD1 4.41Å; I841-I917 HydrophobicContact CG1-CD1 4.03Å; V844-I917 HydrophobicContact CB-CD1 3.88Å; V844-I917 HydrophobicContact CG1-CD1 4.42Å; V844-I917 HydrophobicContact CG2-CD1 3.77Å; D915-I917 PolarHBondContact O-N 3.24Å; D915-I917 VanDerWaalsContact O-N 3.11Å; D915-I917 WeakPolarHBondContact OD1-CB 3.41Å; D915-I917 PolarHBondContact OD1-N 3.27Å; I917-V921 HydrophobicContact CG2-CB 3.75Å; I917-V921 HydrophobicContact CG2-CG2 3.61Å
918G82.7Confident83.2Confident26 Ų2661.3 Ų61.327%0.26834%0.344SS..G310 helixtrans59.9-159.4-179.200000114K840 D915 A920K840-G918 PolarHBondContact NZ-O 3.16Å; D915-G918 PolarHBondContact O-N 2.98Å; D915-G918 VanDerWaalsContact O-N 3.1Å; D915-G918 PolarHBondContact OD1-N 3.3Å; G918-A920 PolarHBondContact O-N 3.18Å; G918-A920 VanDerWaalsContact O-N 3.14Å
919D78.3Confident83.7Confident163 Ų16359.5 Ų59.587%0.87234%0.336SS*.G310 helixtrans-70.8-5.5-178.4-65.6-35.7000114.1V921D919-V921 PolarHBondContact O-N 3.05Å; D919-V921 VanDerWaalsContact O-N 3.12Å
920A75.9Confident84.4Confident95 Ų9564 Ų6479%0.78536%0.357SS*.G310 helixtrans-57.9-26.7176.500000112.4G918G918-A920 PolarHBondContact O-N 3.18Å; G918-A920 VanDerWaalsContact O-N 3.14Å
921V83.7Confident85.5Confident18 Ų1863.9 Ų63.911%0.10935%0.352CS..  trans-125.991.1173.2-176.40000109.4K840 V844 I917 D919 P924 L927K840-V921 WeakPolarHBondContact CE-O 3.4Å; K840-V921 PolarHBondContact NZ-O 2.66Å; V844-V921 HydrophobicContact CG2-CB 4.42Å; V844-V921 HydrophobicContact CG2-CG1 4.04Å; V844-V921 HydrophobicContact CG2-CG2 4.26Å; I917-V921 HydrophobicContact CG2-CB 3.75Å; I917-V921 HydrophobicContact CG2-CG2 3.61Å; D919-V921 PolarHBondContact O-N 3.05Å; D919-V921 VanDerWaalsContact O-N 3.12Å; V921-P924 HydrophobicContact CG1-CG 4.38Å; V921-L927 HydrophobicContact CG1-CB 4.04Å; V921-L927 HydrophobicContact CG1-CD2 3.89Å; V921-L927 HydrophobicContact CG1-CG 4.5Å; V921-L927 HydrophobicContact CG2-CD2 3.94Å
922G79Confident86.8Confident76 Ų7658.2 Ų58.278%0.78433%0.331SS*.SBendtrans-69.3-38.2176.800000113.6
923N90.6Very high88.1Confident77 Ų7753.3 Ų53.341%0.41231%0.31SS..  trans-135.4108.5178.5-173.3-24.4000111.2K925 I926 L927N923-K925 PolarHBondContact O-N 3.45Å; N923-K925 VanDerWaalsContact OD1-CB 3.28Å; N923-K925 WeakPolarHBondContact OD1-CB 3.34Å; N923-K925 PolarHBondContact OD1-N 3.17Å; N923-I926 HydrophobicContact CB-CB 4.16Å; N923-I926 HydrophobicContact CB-CG1 3.86Å; N923-I926 PolarHBondContact O-N 2.8Å; N923-I926 VanDerWaalsContact O-N 3.11Å; N923-L927 PolarHBondContact O-N 2.75Å; N923-L927 VanDerWaalsContact O-N 3.11Å
924P92.7Very high89.3Confident24 Ų2453.2 Ų53.216%0.15631%0.308CS..Hα-helixtrans-58.8-29179.2-2736.4000114.5K840 A843 F876 V921 L927 L928K840-P924 HydrophobicContact CB-CG 4.45Å; K840-P924 HydrophobicContact CG-CG 4Å; A843-P924 HydrophobicContact CB-CB 3.79Å; F876-P924 HydrophobicContact CE1-CB 3.89Å; F876-P924 HydrophobicContact CZ-CB 4.02Å; V921-P924 HydrophobicContact CG1-CG 4.38Å; P924-L927 PolarHBondContact O-N 2.85Å; P924-L928 PolarHBondContact O-N 3.49Å
925K95Very high89.8Confident56 Ų5650 Ų5024%0.24329%0.293CS..Hα-helixtrans-67-39.4177.3-50.1-171.9-173.8-160.80111.1F876 E877 N923 L928 A929 Y962F876-K925 HydrophobicContact CB-CD 4.27Å; F876-K925 HydrophobicContact CB-CG 4.42Å; F876-K925 HydrophobicContact CD1-CG 4.19Å; F876-K925 HydrophobicContact CD2-CD 4.49Å; F876-K925 HydrophobicContact CD2-CG 3.9Å; F876-K925 HydrophobicContact CE1-CG 4.4Å; F876-K925 HydrophobicContact CE2-CG 4.13Å; F876-K925 HydrophobicContact CG-CD 4.32Å; F876-K925 HydrophobicContact CG-CG 3.93Å; F876-K925 HydrophobicContact CZ-CG 4.37Å; F876-K925 PolarHBondContact O-NZ 3.06Å; E877-K925 IonicContact OE1-NZ 2.79Å; E877-K925 PolarHBondContact OE1-NZ 3.49Å; E877-K925 IonicContact OE2-NZ 2.72Å; N923-K925 PolarHBondContact O-N 3.45Å; N923-K925 VanDerWaalsContact OD1-CB 3.28Å; N923-K925 WeakPolarHBondContact OD1-CB 3.34Å; N923-K925 PolarHBondContact OD1-N 3.17Å; K925-L928 PolarHBondContact O-N 2.89Å; K925-A929 PolarHBondContact O-N 3.48Å; K925-Y962 HydrophobicContact CB-CD1 4.01Å; K925-Y962 HydrophobicContact CB-CD2 4.41Å; K925-Y962 HydrophobicContact CB-CE1 4.27Å; K925-Y962 HydrophobicContact CB-CG 4.1Å; K925-Y962 HydrophobicContact CD-CD1 4.13Å; K925-Y962 HydrophobicContact CD-CE1 3.64Å; K925-Y962 HydrophobicContact CG-CE1 4.34Å
926I94.3Very high90Very high41 Ų4147.9 Ų47.921%0.2128%0.282CS..Hα-helixtrans-70.7-40.4176.8-61-61.7000110.8N923 L928 A929 Q930 A966N923-I926 HydrophobicContact CB-CB 4.16Å; N923-I926 HydrophobicContact CB-CG1 3.86Å; N923-I926 PolarHBondContact O-N 2.8Å; N923-I926 VanDerWaalsContact O-N 3.11Å; I926-L928 VanDerWaalsContact C-N 3.33Å; I926-L928 PolarHBondContact O-N 3.43Å; I926-A929 PolarHBondContact O-N 3.03Å; I926-Q930 HydrophobicContact CG2-CG 4.39Å; I926-Q930 WeakPolarHBondContact O-CG 3.37Å; I926-Q930 PolarHBondContact O-N 3.46Å; I926-A966 HydrophobicContact CD1-CB 4.03Å; I926-A966 HydrophobicContact CG2-CB 3.99Å
927L94.9Very high90.3Very high40 Ų4050.3 Ų50.321%0.20930%0.296CS..Hα-helixtrans-57.9-47173.8-179.671.7000111.1V844 T847 V921 N923 P924 A929 Q930 S931V844-L927 HydrophobicContact CB-CD2 4.28Å; V844-L927 HydrophobicContact CG1-CD2 3.91Å; V844-L927 HydrophobicContact CG2-CD2 3.79Å; T847-L927 HydrophobicContact CG2-CG 4.44Å; V921-L927 HydrophobicContact CG1-CB 4.04Å; V921-L927 HydrophobicContact CG1-CD2 3.89Å; V921-L927 HydrophobicContact CG1-CG 4.5Å; V921-L927 HydrophobicContact CG2-CD2 3.94Å; N923-L927 PolarHBondContact O-N 2.75Å; N923-L927 VanDerWaalsContact O-N 3.11Å; P924-L927 PolarHBondContact O-N 2.85Å; L927-A929 VanDerWaalsContact C-N 3.33Å; L927-A929 PolarHBondContact O-N 3.08Å; L927-Q930 PolarHBondContact O-N 2.94Å; L927-S931 WeakPolarHBondContact O-CB 3.44Å; L927-S931 PolarHBondContact O-N 3.37Å; L927-S931 PolarHBondContact O-OG 3.04Å; L927-S931 VanDerWaalsContact O-OG 3.12Å
928L96.4Very high90.4Very high0 Ų052.9 Ų52.90%032%0.321CS..Hα-helixtrans-55.7-48.4176.8175.762.6000111.5T847 L869 L872 F876 P924 K925 I926 Q930 S931 L932T847-L928 HydrophobicContact CG2-CB 4.45Å; T847-L928 HydrophobicContact CG2-CD1 4.06Å; L869-L928 HydrophobicContact CD1-CD1 4.11Å; L869-L928 HydrophobicContact CD1-CD2 3.96Å; L872-L928 HydrophobicContact CD2-CD1 3.74Å; L872-L928 HydrophobicContact CD2-CD2 3.78Å; L872-L928 HydrophobicContact CD2-CG 4.28Å; L872-L928 HydrophobicContact CG-CD2 4.24Å; F876-L928 HydrophobicContact CE2-CD2 3.89Å; P924-L928 PolarHBondContact O-N 3.49Å; K925-L928 PolarHBondContact O-N 2.89Å; I926-L928 VanDerWaalsContact C-N 3.33Å; I926-L928 PolarHBondContact O-N 3.43Å; L928-Q930 PolarHBondContact O-N 3.02Å; L928-S931 PolarHBondContact O-N 3.24Å; L928-L932 HydrophobicContact CD1-CD1 3.77Å; L928-L932 HydrophobicContact CD1-CG 3.95Å; L928-L932 HydrophobicContact CG-CD1 3.88Å; L928-L932 HydrophobicContact CG-CG 4.43Å; L928-L932 WeakPolarHBondContact O-CB 3.43Å; L928-L932 VanDerWaalsContact O-CG 3.29Å; L928-L932 WeakPolarHBondContact O-CG 3.38Å; L928-L932 PolarHBondContact O-N 3.35Å
929A95.6Very high90.6Very high0 Ų053.6 Ų53.60%032%0.321CS..Hα-helixtrans-59.9-46.2179.100000112.7K925 I926 L927 L932 H933 L963 A966 V968K925-A929 PolarHBondContact O-N 3.48Å; I926-A929 PolarHBondContact O-N 3.03Å; L927-A929 VanDerWaalsContact C-N 3.33Å; L927-A929 PolarHBondContact O-N 3.08Å; A929-L932 PolarHBondContact O-N 3.41Å; A929-H933 WeakPolarHBondContact O-CB 3.44Å; A929-H933 PolarHBondContact O-N 3.31Å; A929-L963 HydrophobicContact CB-CD2 4Å; A929-L963 HydrophobicContact CB-CG 4.48Å; A929-A966 HydrophobicContact CB-CB 3.62Å; A929-V968 HydrophobicContact CB-CG2 4.25Å
930Q95.1Very high91Very high95 Ų9550.1 Ų50.144%0.44431%0.308SS..Hα-helixtrans-65.2-42.4178.5-70.4175.6-15.600112.2I926 L927 L928 H933 K934 A966I926-Q930 HydrophobicContact CG2-CG 4.39Å; I926-Q930 WeakPolarHBondContact O-CG 3.37Å; I926-Q930 PolarHBondContact O-N 3.46Å; L927-Q930 PolarHBondContact O-N 2.94Å; L928-Q930 PolarHBondContact O-N 3.02Å; Q930-H933 PolarHBondContact O-N 3.34Å; Q930-K934 PolarHBondContact O-N 2.85Å; Q930-A966 HydrophobicContact CG-CB 4.25Å
931S95.2Very high91.4Very high21 Ų2147.5 Ų47.515%0.14729%0.29CS..Hα-helixtrans-67.3-38.9178-64.70000112.1L927 L928 K934 L935L927-S931 WeakPolarHBondContact O-CB 3.44Å; L927-S931 PolarHBondContact O-N 3.37Å; L927-S931 PolarHBondContact O-OG 3.04Å; L927-S931 VanDerWaalsContact O-OG 3.12Å; L928-S931 PolarHBondContact O-N 3.24Å; S931-K934 PolarHBondContact O-N 3.47Å; S931-L935 PolarHBondContact O-N 3.41Å
932L94.8Very high91.5Very high0 Ų051.2 Ų51.20%030%0.302CS..Hα-helixtrans-66.4-38.8173.9-73.8173.2000112.1T851 W865 L869 L928 A929 L935 S936 L959 L970T851-L932 HydrophobicContact CG2-CD2 3.98Å; T851-L932 HydrophobicContact CG2-CG 4.39Å; W865-L932 HydrophobicContact CH2-CD2 3.79Å; W865-L932 HydrophobicContact CZ2-CD2 3.6Å; L869-L932 HydrophobicContact CD1-CD1 4.28Å; L928-L932 HydrophobicContact CD1-CD1 3.77Å; L928-L932 HydrophobicContact CD1-CG 3.95Å; L928-L932 HydrophobicContact CG-CD1 3.88Å; L928-L932 HydrophobicContact CG-CG 4.43Å; L928-L932 WeakPolarHBondContact O-CB 3.43Å; L928-L932 VanDerWaalsContact O-CG 3.29Å; L928-L932 WeakPolarHBondContact O-CG 3.38Å; L928-L932 PolarHBondContact O-N 3.35Å; A929-L932 PolarHBondContact O-N 3.41Å; L932-L935 PolarHBondContact O-N 3.15Å; L932-S936 WeakPolarHBondContact O-CB 3.4Å; L932-S936 PolarHBondContact O-N 3.05Å; L932-S936 PolarHBondContact O-OG 3.24Å; L932-L959 HydrophobicContact CD1-CD1 3.79Å; L932-L970 HydrophobicContact CB-CD2 3.91Å
933H94.1Very high91.8Very high59 Ų5947.6 Ų47.627%0.27326%0.264SS..Hα-helixtrans-59.6-47.9172.7173.362.6000111.3A929 Q930 L935 S936 T937 V968 Q969A929-H933 WeakPolarHBondContact O-CB 3.44Å; A929-H933 PolarHBondContact O-N 3.31Å; Q930-H933 PolarHBondContact O-N 3.34Å; H933-L935 VanDerWaalsContact C-N 3.32Å; H933-L935 PolarHBondContact O-N 3.19Å; H933-S936 WeakPolarHBondContact CA-OG 3.16Å; H933-S936 PolarHBondContact O-N 3.2Å; H933-S936 PolarHBondContact O-OG 3.35Å; H933-T937 WeakPolarHBondContact O-CG2 3.26Å; H933-T937 PolarHBondContact O-N 3.27Å; H933-T937 PolarHBondContact O-OG1 3.17Å; H933-T937 VanDerWaalsContact O-OG1 3.1Å; H933-V968 HydrophobicContact CB-CB 3.82Å; H933-V968 HydrophobicContact CB-CG1 4.24Å; H933-V968 HydrophobicContact CB-CG2 3.96Å; H933-Q969 PolarHBondContact CE1-O 2.88Å; H933-Q969 PolarHBondContact ND1-O 3.35Å
934K94.5Very high91.7Very high153 Ų15345.4 Ų45.467%0.66525%0.254SS*.Hα-helixtrans-60-40.5176.1-170.9-178.8177.4-173.20112.3Q930 S931 T937 A938Q930-K934 PolarHBondContact O-N 2.85Å; S931-K934 PolarHBondContact O-N 3.47Å; K934-T937 WeakPolarHBondContact CA-OG1 3.36Å; K934-T937 PolarHBondContact O-OG1 3.1Å; K934-A938 PolarHBondContact O-N 2.96Å
935L93.1Very high91.3Very high22 Ų2247.5 Ų47.512%0.11527%0.27CS..Hα-helixtrans-66-44174.7-17768.4000111.8T851 M857 W865 S931 L932 H933 T937 A938 C939 V943T851-L935 HydrophobicContact CG2-CB 4.42Å; T851-L935 HydrophobicContact CG2-CD2 4.29Å; M857-L935 HydrophobicContact SD-CD2 4.44Å; W865-L935 HydrophobicContact CZ2-CD2 4.25Å; S931-L935 PolarHBondContact O-N 3.41Å; L932-L935 PolarHBondContact O-N 3.15Å; H933-L935 VanDerWaalsContact C-N 3.32Å; H933-L935 PolarHBondContact O-N 3.19Å; L935-T937 VanDerWaalsContact C-N 3.34Å; L935-T937 PolarHBondContact O-N 2.81Å; L935-A938 PolarHBondContact O-N 3.15Å; L935-C939 PolarHBondContact O-N 2.76Å; L935-V943 HydrophobicContact CD2-CG2 3.83Å; L935-V943 HydrophobicContact CG-CG2 3.9Å
936S92.5Very high90.8Very high0 Ų046 Ų460%026%0.264CS..Hα-helixtrans-63.4-39-179.970.80000112.3L932 H933 A938 C939 P940 L970 V971L932-S936 WeakPolarHBondContact O-CB 3.4Å; L932-S936 PolarHBondContact O-N 3.05Å; L932-S936 PolarHBondContact O-OG 3.24Å; H933-S936 WeakPolarHBondContact CA-OG 3.16Å; H933-S936 PolarHBondContact O-N 3.2Å; H933-S936 PolarHBondContact O-OG 3.35Å; S936-A938 VanDerWaalsContact C-N 3.34Å; S936-A938 PolarHBondContact O-N 3.45Å; S936-C939 CarbonylContact O-C 3.15Å; S936-C939 PolarHBondContact O-N 2.88Å; S936-P940 VanDerWaalsContact O-CA 3.25Å; S936-P940 WeakPolarHBondContact O-CA 3.4Å; S936-L970 WeakPolarHBondContact OG-CA 3.37Å; S936-V971 PolarHBondContact OG-N 2.8Å; S936-V971 VanDerWaalsContact OG-N 3.16Å
937T91.9Very high90.5Very high68 Ų6844.5 Ų44.542%0.41726%0.256SS..Hα-helixtrans-68.2-33175.450.60000112.5H933 K934 L935 V971H933-T937 WeakPolarHBondContact O-CG2 3.26Å; H933-T937 PolarHBondContact O-N 3.27Å; H933-T937 PolarHBondContact O-OG1 3.17Å; H933-T937 VanDerWaalsContact O-OG1 3.1Å; K934-T937 WeakPolarHBondContact CA-OG1 3.36Å; K934-T937 PolarHBondContact O-OG1 3.1Å; L935-T937 VanDerWaalsContact C-N 3.34Å; L935-T937 PolarHBondContact O-N 2.81Å; T937-V971 HydrophobicContact CG2-CB 4.34Å; T937-V971 HydrophobicContact CG2-CG2 4.02Å
938A88.3Confident89.8Confident77 Ų7748.5 Ų48.564%0.63628%0.278SS*.Hα-helixtrans-73.3-25.3173.700000113.3K934 L935 S936K934-A938 PolarHBondContact O-N 2.96Å; L935-A938 PolarHBondContact O-N 3.15Å; S936-A938 VanDerWaalsContact C-N 3.34Å; S936-A938 PolarHBondContact O-N 3.45Å
939C86.8Confident88.8Confident40 Ų4053.7 Ų53.727%0.2731%0.31SS..SBendtrans-135.470.2178.9-70.90000111.5L935 S936 G941 R942L935-C939 PolarHBondContact O-N 2.76Å; S936-C939 CarbonylContact O-C 3.15Å; S936-C939 PolarHBondContact O-N 2.88Å; C939-G941 PolarHBondContact O-N 2.98Å; C939-R942 HydrophobicContact CB-CB 4.25Å; C939-R942 WeakPolarHBondContact O-CB 3.44Å; C939-R942 PolarHBondContact O-N 2.89Å
940P86.8Confident88Confident91 Ų9157.4 Ų57.459%0.59134%0.336SS*.THydrogen-bonded Turntrans-55.2135.6-171.3-27.635.9000113.5S936 R942S936-P940 VanDerWaalsContact O-CA 3.25Å; S936-P940 WeakPolarHBondContact O-CA 3.4Å; P940-R942 PolarHBondContact O-N 2.94Å; P940-R942 VanDerWaalsContact O-N 3.14Å
941G83.4Confident87.6Confident39 Ų3953.7 Ų53.740%0.40232%0.319SS..THydrogen-bonded Turntrans76.3-15.4178.100000115.9C939 S945 V971C939-G941 PolarHBondContact O-N 2.98Å; G941-S945 VanDerWaalsContact O-CB 3.31Å; G941-S945 WeakPolarHBondContact O-CB 3.33Å; G941-S945 PolarHBondContact O-N 3.4Å; G941-V971 PolarHBondContact N-O 3.46Å; G941-V971 PolarHBondContact N-OXT 2.67Å
942R85.9Confident87.3Confident96 Ų9655.7 Ų55.736%0.36233%0.328SS..Hα-helixtrans-76.7-48.9-178.1-165.7172.9-176.2176.94.2112.5M857 D858 C939 P940 S945 M946M857-R942 HydrophobicContact CE-CG 3.92Å; M857-R942 PolarHBondContact O-NH2 2.9Å; D858-R942 IonicContact OD1-CZ 2.68Å; D858-R942 VanDerWaalsContact OD1-CZ 3.26Å; D858-R942 IonicContact OD1-NH1 2.59Å; D858-R942 PolarHBondContact OD1-NH1 2.78Å; D858-R942 IonicContact OD1-NH2 3.69Å; D858-R942 PolarHBondContact OD1-NH2 3.36Å; C939-R942 HydrophobicContact CB-CB 4.25Å; C939-R942 WeakPolarHBondContact O-CB 3.44Å; C939-R942 PolarHBondContact O-N 2.89Å; P940-R942 PolarHBondContact O-N 2.94Å; P940-R942 VanDerWaalsContact O-N 3.14Å; R942-S945 PolarHBondContact O-N 3.25Å; R942-M946 HydrophobicContact CG-SD 4.32Å; R942-M946 WeakPolarHBondContact O-CG 3.36Å; R942-M946 PolarHBondContact O-N 3.25Å; R942-M946 VanDerWaalsContact O-N 3.09Å
943V87.2Confident86.9Confident0 Ų059.8 Ų59.80%036%0.362CS..Hα-helixtrans-63.2-48.5179.2-179.80000111.4M857 W865 L935 S945 M946 L947 L970M857-V943 HydrophobicContact CE-CG2 4.36Å; W865-V943 HydrophobicContact CH2-CG1 4Å; W865-V943 HydrophobicContact CZ2-CG1 4.42Å; L935-V943 HydrophobicContact CD2-CG2 3.83Å; L935-V943 HydrophobicContact CG-CG2 3.9Å; V943-S945 VanDerWaalsContact C-N 3.3Å; V943-S945 PolarHBondContact O-N 3.14Å; V943-M946 PolarHBondContact O-N 2.78Å; V943-L947 HydrophobicContact CG1-CD1 4.15Å; V943-L947 WeakPolarHBondContact O-CG 3.41Å; V943-L947 PolarHBondContact O-N 3.3Å; V943-L947 VanDerWaalsContact O-N 3.14Å; V943-L970 HydrophobicContact CG1-CD1 4.34Å
944P86.7Confident86.7Confident31 Ų3163.8 Ų63.820%0.20138%0.38CS..Hα-helixtrans-57.1-39.9174.2-25.635.1000113.6M946 L947 N948 L970P944-M946 PolarHBondContact O-N 3.29Å; P944-L947 PolarHBondContact O-N 2.91Å; P944-N948 PolarHBondContact O-N 3.42Å; P944-N948 VanDerWaalsContact O-N 3.07Å; P944-N948 PolarHBondContact O-ND2 2.93Å; P944-L970 HydrophobicContact CG-CB 4.1Å
945S85.6Confident86.4Confident68 Ų6856.8 Ų56.848%0.47635%0.351SS..Hα-helixtrans-62.7-41.9177.6-173.30000112.2G941 R942 V943 T949G941-S945 VanDerWaalsContact O-CB 3.31Å; G941-S945 WeakPolarHBondContact O-CB 3.33Å; G941-S945 PolarHBondContact O-N 3.4Å; R942-S945 PolarHBondContact O-N 3.25Å; V943-S945 VanDerWaalsContact C-N 3.3Å; V943-S945 PolarHBondContact O-N 3.14Å; S945-T949 WeakPolarHBondContact O-CB 3.17Å; S945-T949 PolarHBondContact O-N 3.22Å; S945-T949 PolarHBondContact O-OG1 3.12Å
946M84.9Confident86.3Confident25 Ų2557.4 Ų57.412%0.12336%0.355CS..Hα-helixtrans-67.9-35.1179.7-69.6173.264.700112.6M857 T862 W865 R942 V943 P944M857-M946 HydrophobicContact CE-SD 3.71Å; M857-M946 HydrophobicContact SD-CE 4.19Å; M857-M946 HydrophobicContact SD-SD 4.05Å; T862-M946 HydrophobicContact CG2-CE 3.68Å; T862-M946 HydrophobicContact CG2-SD 4.32Å; W865-M946 HydrophobicContact CB-CE 3.58Å; W865-M946 HydrophobicContact CD2-CE 3.65Å; W865-M946 HydrophobicContact CE3-CE 3.75Å; W865-M946 HydrophobicContact CG-CE 3.58Å; R942-M946 HydrophobicContact CG-SD 4.32Å; R942-M946 WeakPolarHBondContact O-CG 3.36Å; R942-M946 PolarHBondContact O-N 3.25Å; R942-M946 VanDerWaalsContact O-N 3.09Å; V943-M946 PolarHBondContact O-N 2.78Å; P944-M946 PolarHBondContact O-N 3.29Å
947L86.6Confident86.2Confident9 Ų965.3 Ų65.35%0.04739%0.389CS..Hα-helixtrans-68.1-48.4176.5-65.9171.7000111.5W865 L869 V943 P944 T949 L951 L959 L970W865-L947 HydrophobicContact CH2-CD2 4.17Å; W865-L947 HydrophobicContact CZ3-CD2 3.83Å; W865-L947 HydrophobicContact CZ3-CG 4.42Å; L869-L947 HydrophobicContact CD2-CD2 3.33Å; V943-L947 HydrophobicContact CG1-CD1 4.15Å; V943-L947 WeakPolarHBondContact O-CG 3.41Å; V943-L947 PolarHBondContact O-N 3.3Å; V943-L947 VanDerWaalsContact O-N 3.14Å; P944-L947 PolarHBondContact O-N 2.91Å; L947-T949 VanDerWaalsContact C-N 3.26Å; L947-T949 PolarHBondContact O-N 2.89Å; L947-L951 HydrophobicContact CD2-CD2 3.79Å; L947-L951 VanDerWaalsContact O-CB 3.3Å; L947-L951 WeakPolarHBondContact O-CB 3.42Å; L947-L951 PolarHBondContact O-N 2.89Å; L947-L951 VanDerWaalsContact O-N 3.13Å; L947-L959 HydrophobicContact CD1-CD2 4.01Å; L947-L959 HydrophobicContact CD2-CD2 3.86Å; L947-L970 HydrophobicContact CD1-CD1 3.31Å
948N80.1Confident86.3Confident125 Ų12566.1 Ų66.167%0.66839%0.387SS*.Hα-helixtrans-68.2-23.5-176.6-71.9-26.1000113.8P944P944-N948 PolarHBondContact O-N 3.42Å; P944-N948 VanDerWaalsContact O-N 3.07Å; P944-N948 PolarHBondContact O-ND2 2.93Å
949T76.1Confident86.5Confident109 Ų10962.5 Ų62.567%0.66936%0.357SS*.Hα-helixtrans-86.6-33.6-175.7-51.60000112.5S945 L947S945-T949 WeakPolarHBondContact O-CB 3.17Å; S945-T949 PolarHBondContact O-N 3.22Å; S945-T949 PolarHBondContact O-OG1 3.12Å; L947-T949 VanDerWaalsContact C-N 3.26Å; L947-T949 PolarHBondContact O-N 2.89Å
950S79Confident86.8Confident77 Ų7765.3 Ų65.354%0.53837%0.366SS..Hα-helixtrans-138.9-9-161.4-50.80000115.7T866T866-S950 VanDerWaalsContact CG2-C 3.49Å
951L86.8Confident87.1Confident17 Ų1762.8 Ų62.89%0.08936%0.356CS..SBendtrans-88.1137.3179-169.465.8000109.9T866 L869 Q870 I873 L947 A955 L956 L959T866-L951 HydrophobicContact CG2-CB 3.72Å; T866-L951 HydrophobicContact CG2-CD1 3.9Å; T866-L951 HydrophobicContact CG2-CG 4.42Å; L869-L951 HydrophobicContact CD2-CD2 4.33Å; Q870-L951 HydrophobicContact CB-CD1 3.81Å; Q870-L951 HydrophobicContact CG-CD1 4.28Å; I873-L951 HydrophobicContact CD1-CD2 4.38Å; L947-L951 HydrophobicContact CD2-CD2 3.79Å; L947-L951 VanDerWaalsContact O-CB 3.3Å; L947-L951 WeakPolarHBondContact O-CB 3.42Å; L947-L951 PolarHBondContact O-N 2.89Å; L947-L951 VanDerWaalsContact O-N 3.13Å; L951-A955 HydrophobicContact CD1-CB 4.1Å; L951-A955 HydrophobicContact CD2-CB 4.4Å; L951-A955 HydrophobicContact CG-CB 4.21Å; L951-L956 HydrophobicContact CD2-CB 4.1Å; L951-L959 HydrophobicContact CD2-CD2 4.26Å
952N88.3Confident87.6Confident63 Ų6361.8 Ų61.834%0.33734%0.34SS..  trans-64153.2177.574.7-6.7000112E954 A955 L956N952-E954 VanDerWaalsContact C-N 3.28Å; N952-E954 PolarHBondContact O-N 2.99Å; N952-A955 PolarHBondContact O-N 3.17Å; N952-A955 WeakPolarHBondContact OD1-CA 3.4Å; N952-A955 WeakPolarHBondContact OD1-CB 3.37Å; N952-A955 PolarHBondContact OD1-N 3.32Å; N952-L956 WeakPolarHBondContact O-CB 3.47Å; N952-L956 PolarHBondContact O-N 3.31Å; N952-L956 VanDerWaalsContact O-N 3.09Å
953A87.6Confident88Confident86 Ų8657.8 Ų57.871%0.71133%0.326SS*.Hα-helixtrans-63.3-33.4-173.500000113.3K957A953-K957 PolarHBondContact O-N 3.4Å; A953-K957 VanDerWaalsContact O-N 3.13Å
954E88Confident88.2Confident143 Ų14365.1 Ų65.167%0.66836%0.36SS*.Hα-helixtrans-71.6-47179.3-69.3-175162.600112.4N952 L956 K957 F958N952-E954 VanDerWaalsContact C-N 3.28Å; N952-E954 PolarHBondContact O-N 2.99Å; E954-L956 VanDerWaalsContact C-N 3.26Å; E954-L956 PolarHBondContact O-N 3.39Å; E954-K957 WeakPolarHBondContact O-CB 3.41Å; E954-K957 PolarHBondContact O-N 3.03Å; E954-K957 VanDerWaalsContact O-N 3.13Å; E954-F958 WeakPolarHBondContact O-CD2 3.33Å; E954-F958 PolarHBondContact O-N 3.32Å; E954-F958 VanDerWaalsContact O-N 3.11Å
955A89.2Confident88.4Confident6 Ų666.3 Ų66.35%0.0538%0.378CS..Hα-helixtrans-65.4-34176.700000111.3Q870 I873 L951 N952 K957 F958 L959Q870-A955 HydrophobicContact CG-CB 4.43Å; I873-A955 HydrophobicContact CB-CB 4.18Å; I873-A955 HydrophobicContact CD1-CB 3.79Å; I873-A955 HydrophobicContact CG2-CB 3.82Å; L951-A955 HydrophobicContact CD1-CB 4.1Å; L951-A955 HydrophobicContact CD2-CB 4.4Å; L951-A955 HydrophobicContact CG-CB 4.21Å; N952-A955 PolarHBondContact O-N 3.17Å; N952-A955 WeakPolarHBondContact OD1-CA 3.4Å; N952-A955 WeakPolarHBondContact OD1-CB 3.37Å; N952-A955 PolarHBondContact OD1-N 3.32Å; A955-K957 VanDerWaalsContact C-N 3.31Å; A955-K957 PolarHBondContact O-N 3.09Å; A955-F958 PolarHBondContact O-N 2.95Å; A955-L959 WeakPolarHBondContact O-CB 3.47Å; A955-L959 PolarHBondContact O-N 2.9Å
956L90.6Very high88.6Confident36 Ų3663.7 Ų63.719%0.18836%0.36CS..Hα-helixtrans-62.9-37.1174.5-166.3141000111.9L951 N952 E954 L959 H960L951-L956 HydrophobicContact CD2-CB 4.1Å; N952-L956 WeakPolarHBondContact O-CB 3.47Å; N952-L956 PolarHBondContact O-N 3.31Å; N952-L956 VanDerWaalsContact O-N 3.09Å; E954-L956 VanDerWaalsContact C-N 3.26Å; E954-L956 PolarHBondContact O-N 3.39Å; L956-L959 PolarHBondContact O-N 2.95Å; L956-H960 WeakPolarHBondContact CD2-CE1 3.35Å; L956-H960 PolarHBondContact O-N 3.21Å
957K91.7Very high89Confident165 Ų16567.9 Ų67.972%0.71739%0.392SS*.Hα-helixtrans-64.8-44.8173.4-173.6-176.7177.6-174.40112.2A953 E954 A955 H960 G961A953-K957 PolarHBondContact O-N 3.4Å; A953-K957 VanDerWaalsContact O-N 3.13Å; E954-K957 WeakPolarHBondContact O-CB 3.41Å; E954-K957 PolarHBondContact O-N 3.03Å; E954-K957 VanDerWaalsContact O-N 3.13Å; A955-K957 VanDerWaalsContact C-N 3.31Å; A955-K957 PolarHBondContact O-N 3.09Å; K957-H960 PolarHBondContact O-N 2.81Å; K957-G961 PolarHBondContact O-N 2.64Å
958F93.7Very high89.3Confident85 Ų8568.8 Ų68.837%0.37340%0.398SS..Hα-helixtrans-62.5-44.9175.5-72.3-65.4000111.7I873 E877 E954 A955 H960 G961 Y962I873-F958 HydrophobicContact CG2-CB 4Å; I873-F958 HydrophobicContact CG2-CD2 4.42Å; E877-F958 HydrophobicContact CB-CD2 4.47Å; E877-F958 HydrophobicContact CB-CE1 4.39Å; E877-F958 HydrophobicContact CB-CE2 4.25Å; E877-F958 HydrophobicContact CB-CZ 4.21Å; E877-F958 HydrophobicContact CG-CB 4.33Å; E877-F958 HydrophobicContact CG-CD1 3.76Å; E877-F958 HydrophobicContact CG-CD2 4.04Å; E877-F958 HydrophobicContact CG-CE1 3.98Å; E877-F958 HydrophobicContact CG-CE2 4.25Å; E877-F958 HydrophobicContact CG-CG 3.8Å; E877-F958 HydrophobicContact CG-CZ 4.21Å; E954-F958 WeakPolarHBondContact O-CD2 3.33Å; E954-F958 PolarHBondContact O-N 3.32Å; E954-F958 VanDerWaalsContact O-N 3.11Å; A955-F958 PolarHBondContact O-N 2.95Å; F958-H960 VanDerWaalsContact C-N 3.33Å; F958-H960 PolarHBondContact O-N 3.45Å; F958-G961 WeakPolarHBondContact O-CA 3.45Å; F958-G961 PolarHBondContact O-N 3.33Å; F958-Y962 HydrophobicContact CB-CE1 4.33Å; F958-Y962 HydrophobicContact CB-CE2 4.47Å; F958-Y962 VanDerWaalsContact O-CD1 3.25Å; F958-Y962 WeakPolarHBondContact O-CD1 3.34Å; F958-Y962 WeakPolarHBondContact O-CE1 3.5Å; F958-Y962 PolarHBondContact O-N 3.44Å
959L92.6Very high89.7Confident2 Ų270.3 Ų70.31%0.0140%0.401CS..Hα-helixtrans-59.3-41.2177.6-177.561.4000112.4L869 I873 L932 L947 L951 A955 L956 G961 Y962 L963L869-L959 HydrophobicContact CD2-CD2 4.22Å; I873-L959 HydrophobicContact CD1-CB 4.14Å; L932-L959 HydrophobicContact CD1-CD1 3.79Å; L947-L959 HydrophobicContact CD1-CD2 4.01Å; L947-L959 HydrophobicContact CD2-CD2 3.86Å; L951-L959 HydrophobicContact CD2-CD2 4.26Å; A955-L959 WeakPolarHBondContact O-CB 3.47Å; A955-L959 PolarHBondContact O-N 2.9Å; L956-L959 PolarHBondContact O-N 2.95Å; L959-G961 VanDerWaalsContact C-N 3.29Å; L959-G961 PolarHBondContact O-N 3.39Å; L959-Y962 HydrophobicContact CD1-CD2 4.13Å; L959-Y962 PolarHBondContact O-N 3.2Å; L959-Y962 VanDerWaalsContact O-N 3.13Å; L959-L963 HydrophobicContact CG-CD1 4.28Å; L959-L963 WeakPolarHBondContact O-CG 3.48Å; L959-L963 PolarHBondContact O-N 3.32Å
960H92.1Very high90.4Very high99 Ų9967 Ų6746%0.45838%0.379SS..Hα-helixtrans-59.3-40172.2-73.8163.6000112.4L956 K957 F958 Y962 L963 Q964L956-H960 WeakPolarHBondContact CD2-CE1 3.35Å; L956-H960 PolarHBondContact O-N 3.21Å; K957-H960 PolarHBondContact O-N 2.81Å; F958-H960 VanDerWaalsContact C-N 3.33Å; F958-H960 PolarHBondContact O-N 3.45Å; H960-Y962 VanDerWaalsContact C-N 3.31Å; H960-Y962 PolarHBondContact O-N 3.49Å; H960-L963 PolarHBondContact O-N 3.02Å; H960-Q964 WeakPolarHBondContact O-CB 3.42Å; H960-Q964 VanDerWaalsContact O-CG 3.31Å; H960-Q964 WeakPolarHBondContact O-CG 3.31Å; H960-Q964 PolarHBondContact O-N 3Å
961G92.3Very high90.5Very high37 Ų3767.9 Ų67.938%0.38138%0.381SS..Hα-helixtrans-59.6-40.9173.300000112.5K957 F958 L959 G965K957-G961 PolarHBondContact O-N 2.64Å; F958-G961 WeakPolarHBondContact O-CA 3.45Å; F958-G961 PolarHBondContact O-N 3.33Å; L959-G961 VanDerWaalsContact C-N 3.29Å; L959-G961 PolarHBondContact O-N 3.39Å; G961-G965 PolarHBondContact O-N 3.48Å
962Y95.6Very high90.7Very high18 Ų1870.5 Ų70.57%0.07140%0.396CS..Hα-helixtrans-67.9-43.2177.7-48.6-23.5000112.2I873 F876 E877 K925 F958 L959 H960 Q964 G965 A966I873-Y962 HydrophobicContact CG1-CE2 4.27Å; F876-Y962 AromaticContact CD2-CE2 4Å; F876-Y962 HydrophobicContact CD2-CE2 4Å; E877-Y962 VanDerWaalsContact CD-OH 3.24Å; E877-Y962 WeakPolarHBondContact CG-OH 3.35Å; E877-Y962 VanDerWaalsContact OE1-CE1 3.3Å; E877-Y962 WeakPolarHBondContact OE1-CE1 3.35Å; E877-Y962 VanDerWaalsContact OE1-CZ 3.29Å; E877-Y962 PolarHBondContact OE1-OH 3.01Å; K925-Y962 HydrophobicContact CB-CD1 4.01Å; K925-Y962 HydrophobicContact CB-CD2 4.41Å; K925-Y962 HydrophobicContact CB-CE1 4.27Å; K925-Y962 HydrophobicContact CB-CG 4.1Å; K925-Y962 HydrophobicContact CD-CD1 4.13Å; K925-Y962 HydrophobicContact CD-CE1 3.64Å; K925-Y962 HydrophobicContact CG-CE1 4.34Å; F958-Y962 HydrophobicContact CB-CE1 4.33Å; F958-Y962 HydrophobicContact CB-CE2 4.47Å; F958-Y962 VanDerWaalsContact O-CD1 3.25Å; F958-Y962 WeakPolarHBondContact O-CD1 3.34Å; F958-Y962 WeakPolarHBondContact O-CE1 3.5Å; F958-Y962 PolarHBondContact O-N 3.44Å; L959-Y962 HydrophobicContact CD1-CD2 4.13Å; L959-Y962 PolarHBondContact O-N 3.2Å; L959-Y962 VanDerWaalsContact O-N 3.13Å; H960-Y962 VanDerWaalsContact C-N 3.31Å; H960-Y962 PolarHBondContact O-N 3.49Å; Y962-Q964 VanDerWaalsContact C-N 3.34Å; Y962-Q964 PolarHBondContact O-N 3.17Å; Y962-G965 PolarHBondContact O-N 3.24Å; Y962-A966 VanDerWaalsContact O-CB 3.31Å; Y962-A966 WeakPolarHBondContact O-CB 3.45Å; Y962-A966 PolarHBondContact O-N 2.89Å
963L92.6Very high90.8Very high13 Ų1370.8 Ų70.87%0.06840%0.399CS..Hα-helixtrans-61.5-42.2177-69.4167.4000111.5A929 L959 H960 A966 S967 V968 L970A929-L963 HydrophobicContact CB-CD2 4Å; A929-L963 HydrophobicContact CB-CG 4.48Å; L959-L963 HydrophobicContact CG-CD1 4.28Å; L959-L963 WeakPolarHBondContact O-CG 3.48Å; L959-L963 PolarHBondContact O-N 3.32Å; H960-L963 PolarHBondContact O-N 3.02Å; L963-A966 CarbonylContact O-C 3.31Å; L963-A966 PolarHBondContact O-N 3.19Å; L963-S967 PolarHBondContact O-N 3.05Å; L963-V968 HydrophobicContact CD2-CG2 3.79Å; L963-V968 PolarHBondContact O-N 3.05Å; L963-L970 HydrophobicContact CD1-CD1 3.97Å; L963-L970 HydrophobicContact CD1-CG 3.91Å; L963-L970 HydrophobicContact CD2-CD2 3.88Å; L963-L970 HydrophobicContact CD2-CG 4.07Å
964Q93.2Very high91Very high154 Ų15470 Ų7072%0.7238%0.381SS*.Hα-helixtrans-63.3-47.9173.2-73.7177.8-1.300111.7H960 Y962 A966 S967H960-Q964 WeakPolarHBondContact O-CB 3.42Å; H960-Q964 VanDerWaalsContact O-CG 3.31Å; H960-Q964 WeakPolarHBondContact O-CG 3.31Å; H960-Q964 PolarHBondContact O-N 3Å; Y962-Q964 VanDerWaalsContact C-N 3.34Å; Y962-Q964 PolarHBondContact O-N 3.17Å; Q964-A966 PolarHBondContact O-N 3.17Å; Q964-S967 PolarHBondContact O-N 3.23Å
965G89.1Confident91.2Very high55 Ų5565.7 Ų65.757%0.56737%0.365SS*.Hα-helixtrans-60.3-31.117700000113.2G961 Y962G961-G965 PolarHBondContact O-N 3.48Å; Y962-G965 PolarHBondContact O-N 3.24Å
966A91.6Very high91.3Very high14 Ų1469.4 Ų69.412%0.11638%0.384CS..THydrogen-bonded Turntrans-87.9-4.7176.100000114I926 A929 Q930 Y962 L963 Q964 V968I926-A966 HydrophobicContact CD1-CB 4.03Å; I926-A966 HydrophobicContact CG2-CB 3.99Å; A929-A966 HydrophobicContact CB-CB 3.62Å; Q930-A966 HydrophobicContact CG-CB 4.25Å; Y962-A966 VanDerWaalsContact O-CB 3.31Å; Y962-A966 WeakPolarHBondContact O-CB 3.45Å; Y962-A966 PolarHBondContact O-N 2.89Å; L963-A966 CarbonylContact O-C 3.31Å; L963-A966 PolarHBondContact O-N 3.19Å; Q964-A966 PolarHBondContact O-N 3.17Å; A966-V968 VanDerWaalsContact C-N 3.32Å; A966-V968 HydrophobicContact CB-CG2 3.88Å; A966-V968 PolarHBondContact O-N 3.31Å
967S93Very high91.3Very high113 Ų11371.7 Ų71.779%0.7940%0.397SS*.THydrogen-bonded Turntrans55.539.9-175.7-58.60000114.2L963 Q964L963-S967 PolarHBondContact O-N 3.05Å; Q964-S967 PolarHBondContact O-N 3.23Å
968V92.6Very high91.3Very high28 Ų2865 Ų6517%0.1737%0.374CS..  trans-127.1159.2179.5-64.70000111.9A929 H933 L963 A966A929-V968 HydrophobicContact CB-CG2 4.25Å; H933-V968 HydrophobicContact CB-CB 3.82Å; H933-V968 HydrophobicContact CB-CG1 4.24Å; H933-V968 HydrophobicContact CB-CG2 3.96Å; L963-V968 HydrophobicContact CD2-CG2 3.79Å; L963-V968 PolarHBondContact O-N 3.05Å; A966-V968 VanDerWaalsContact C-N 3.32Å; A966-V968 HydrophobicContact CB-CG2 3.88Å; A966-V968 PolarHBondContact O-N 3.31Å
969Q89.3Confident91.1Very high157 Ų15763.5 Ų63.573%0.73438%0.375SS*.  trans-131.9143.1177.4-66.6-174.8-6.600110.6H933H933-Q969 PolarHBondContact CE1-O 2.88Å; H933-Q969 PolarHBondContact ND1-O 3.35Å
970L89.8Confident91Very high40 Ų4068.6 Ų68.621%0.20941%0.405CS..  trans-78.7131.5176.3-56.1179.4000109.7L932 S936 V943 P944 L947 L963L932-L970 HydrophobicContact CB-CD2 3.91Å; S936-L970 WeakPolarHBondContact OG-CA 3.37Å; V943-L970 HydrophobicContact CG1-CD1 4.34Å; P944-L970 HydrophobicContact CG-CB 4.1Å; L947-L970 HydrophobicContact CD1-CD1 3.31Å; L963-L970 HydrophobicContact CD1-CD1 3.97Å; L963-L970 HydrophobicContact CD1-CG 3.91Å; L963-L970 HydrophobicContact CD2-CD2 3.88Å; L963-L970 HydrophobicContact CD2-CG 4.07Å
971V81.1Confident90.9Very high95 Ų9565.8 Ų65.858%0.57640%0.4SS*.  trans-105.70-174.3-171.60000112.1S936 T937 G941S936-V971 PolarHBondContact OG-N 2.8Å; S936-V971 VanDerWaalsContact OG-N 3.16Å; T937-V971 HydrophobicContact CG2-CB 4.34Å; T937-V971 HydrophobicContact CG2-CG2 4.02Å; G941-V971 PolarHBondContact N-O 3.46Å; G941-V971 PolarHBondContact N-OXT 2.67Å

Retrieved 971 of 971 residues in 553.7 ms (Link to these results)

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