A0A061HWT6_CRIGR Loading...

Regulator of G-protein signaling 7-binding protein

AlphaFold DB , UniProt , Accession A0A061HWT6, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene LOC113837182, Length 237 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
1M73.3Confident91.4Very high191 Ų19170.3 Ų70.394%0.94137%0.371SS*.  0-52.20-66.6-155.8-72.400112R3 E4 E5M1-R3 VanDerWaalsContact C-N 3.27Å; M1-R3 PolarHBondContact O-N 3.02Å; M1-R3 VanDerWaalsContact O-N 3.14Å; M1-E4 PolarHBondContact O-N 3.15Å; M1-E4 VanDerWaalsContact O-N 3.1Å; M1-E5 PolarHBondContact O-N 3.4Å
2A84.7Confident91.9Very high59 Ų5967.6 Ų67.649%0.48837%0.366SS..Hα-helixtrans-51.8-38.2179.300000115.2C6A2-C6 PolarHBondContact O-N 2.91Å; A2-C6 PolarHBondContact O-SG 3.29Å
3R88.3Confident92.4Very high68 Ų6862.4 Ų62.426%0.25734%0.338SS..Hα-helixtrans-59.8-52.8175.1179-161.6164169.814.3112.9M1 E5 C6 K7 E74 F75M1-R3 VanDerWaalsContact C-N 3.27Å; M1-R3 PolarHBondContact O-N 3.02Å; M1-R3 VanDerWaalsContact O-N 3.14Å; R3-E5 PolarHBondContact O-N 3.34Å; R3-C6 PolarHBondContact O-N 3.44Å; R3-K7 WeakPolarHBondContact O-CB 3.41Å; R3-K7 PolarHBondContact O-N 2.84Å; R3-E74 WeakPolarHBondContact CD-OE2 3.48Å; R3-E74 IonicContact CZ-OE1 2.72Å; R3-E74 IonicContact CZ-OE2 3.41Å; R3-E74 IonicContact NE-OE2 3.91Å; R3-E74 PolarHBondContact NE-OE2 3.43Å; R3-E74 IonicContact NH1-OE1 3.58Å; R3-E74 PolarHBondContact NH1-OE1 3.48Å; R3-E74 IonicContact NH1-OE2 3.3Å; R3-E74 PolarHBondContact NH1-OE2 3.14Å; R3-E74 IonicContact NH2-OE1 3.39Å; R3-E74 PolarHBondContact NH2-OE1 3.08Å; R3-E74 IonicContact NH2-OE2 2.64Å; R3-E74 PolarHBondContact NH2-OE2 2.93Å; R3-F75 HydrophobicContact CB-CZ 4.03Å
4E92.4Very high92.7Very high102 Ų10263.7 Ų63.748%0.47735%0.345SS..Hα-helixtrans-64.4-34.4-177.4-65.3-53.7139.100111.1M1 K7 A8M1-E4 PolarHBondContact O-N 3.15Å; M1-E4 VanDerWaalsContact O-N 3.1Å; E4-K7 PolarHBondContact O-N 2.81Å; E4-A8 WeakPolarHBondContact O-CB 3.31Å; E4-A8 PolarHBondContact O-N 3.48Å
5E92.1Very high93.1Very high88 Ų8869.7 Ų69.741%0.41137%0.366SS..Hα-helixtrans-65.5-44.3172.8-66.3174.5-149.500112.4M1 R3 K7 A8 L9 R57M1-E5 PolarHBondContact O-N 3.4Å; R3-E5 PolarHBondContact O-N 3.34Å; E5-K7 VanDerWaalsContact C-N 3.3Å; E5-K7 PolarHBondContact O-N 2.99Å; E5-A8 PolarHBondContact O-N 3.47Å; E5-L9 WeakPolarHBondContact O-CG 3.34Å; E5-L9 PolarHBondContact O-N 3.22Å; E5-R57 IonicContact OE2-CZ 2.7Å; E5-R57 IonicContact OE2-NH1 2.85Å; E5-R57 PolarHBondContact OE2-NH1 3.08Å; E5-R57 IonicContact OE2-NH2 2.84Å
6C93Very high93.4Very high6 Ų666.3 Ų66.34%0.04135%0.349CS..Hα-helixtrans-62.9-40.3176-67.60000111.4A2 R3 L9 L10 L58 F75 L78A2-C6 PolarHBondContact O-N 2.91Å; A2-C6 PolarHBondContact O-SG 3.29Å; R3-C6 PolarHBondContact O-N 3.44Å; C6-L9 PolarHBondContact O-N 2.93Å; C6-L10 WeakPolarHBondContact O-CB 3.39Å; C6-L10 PolarHBondContact O-N 2.96Å; C6-L58 HydrophobicContact CB-CD2 3.96Å; C6-F75 HydrophobicContact CB-CE1 4.21Å; C6-L78 HydrophobicContact CB-CD1 4.29Å
7K95.3Very high93.6Very high82 Ų8262.6 Ų62.636%0.35733%0.33SS..Hα-helixtrans-63.7-45175.1-174.9-174.8173-165.20111.5R3 E4 E5 L9 L10 D11 L78R3-K7 WeakPolarHBondContact O-CB 3.41Å; R3-K7 PolarHBondContact O-N 2.84Å; E4-K7 PolarHBondContact O-N 2.81Å; E5-K7 VanDerWaalsContact C-N 3.3Å; E5-K7 PolarHBondContact O-N 2.99Å; K7-L9 VanDerWaalsContact C-N 3.34Å; K7-L9 PolarHBondContact O-N 2.93Å; K7-L10 PolarHBondContact O-N 3.28Å; K7-D11 WeakPolarHBondContact O-CB 3.33Å; K7-D11 PolarHBondContact O-N 3.25Å; K7-L78 HydrophobicContact CB-CD1 4.44Å; K7-L78 HydrophobicContact CB-CD2 4.19Å; K7-L78 HydrophobicContact CG-CD2 4.22Å
8A96.5Very high93.8Very high58 Ų5861.5 Ų61.548%0.47933%0.331SS..Hα-helixtrans-62.8-40178.300000112.3E4 E5 D11 A12E4-A8 WeakPolarHBondContact O-CB 3.31Å; E4-A8 PolarHBondContact O-N 3.48Å; E5-A8 PolarHBondContact O-N 3.47Å; A8-D11 PolarHBondContact O-N 3.44Å; A8-A12 WeakPolarHBondContact O-CB 3.42Å; A8-A12 PolarHBondContact O-N 3.28Å
9L95.9Very high94Very high39 Ų3961.5 Ų61.520%0.20434%0.336CS..Hα-helixtrans-64.2-43.1173.9-73.8171.7000111.8E5 C6 K7 A12 L13 L50 T54E5-L9 WeakPolarHBondContact O-CG 3.34Å; E5-L9 PolarHBondContact O-N 3.22Å; C6-L9 PolarHBondContact O-N 2.93Å; K7-L9 VanDerWaalsContact C-N 3.34Å; K7-L9 PolarHBondContact O-N 2.93Å; L9-A12 WeakPolarHBondContact O-CB 3.34Å; L9-A12 PolarHBondContact O-N 3.43Å; L9-L13 PolarHBondContact O-N 2.94Å; L9-L50 HydrophobicContact CD2-CD2 4.32Å; L9-T54 HydrophobicContact CB-CG2 4.43Å; L9-T54 WeakPolarHBondContact CB-OG1 3.36Å
10L96.4Very high94.2Very high10 Ų1058.5 Ų58.55%0.05232%0.319CS..Hα-helixtrans-64.5-41.8175.8-179.558.9000112.2C6 K7 A12 L13 N14 T54 L78 A81 F82C6-L10 WeakPolarHBondContact O-CB 3.39Å; C6-L10 PolarHBondContact O-N 2.96Å; K7-L10 PolarHBondContact O-N 3.28Å; L10-A12 VanDerWaalsContact C-N 3.28Å; L10-A12 PolarHBondContact O-N 3.48Å; L10-L13 HydrophobicContact CD1-CD2 4.4Å; L10-L13 PolarHBondContact O-N 3.49Å; L10-N14 WeakPolarHBondContact O-CB 3.29Å; L10-N14 PolarHBondContact O-N 3.39Å; L10-T54 HydrophobicContact CB-CG2 4.32Å; L10-L78 HydrophobicContact CD2-CB 4.24Å; L10-L78 HydrophobicContact CD2-CD2 3.75Å; L10-L78 WeakPolarHBondContact CD2-O 3.45Å; L10-A81 HydrophobicContact CD2-CB 3.84Å; L10-F82 HydrophobicContact CD1-CB 3.77Å; L10-F82 HydrophobicContact CD1-CD2 4.22Å
11D97.2Very high94.4Very high70 Ų7058.8 Ų58.837%0.37432%0.319SS..Hα-helixtrans-63-37.6176-74.7-23.3000111.1K7 A8 K15K7-D11 WeakPolarHBondContact O-CB 3.33Å; K7-D11 PolarHBondContact O-N 3.25Å; A8-D11 PolarHBondContact O-N 3.44Å; D11-K15 WeakPolarHBondContact O-CB 3.29Å; D11-K15 VanDerWaalsContact O-CG 3.25Å; D11-K15 WeakPolarHBondContact O-CG 3.29Å; D11-K15 PolarHBondContact O-N 3.46Å
12A97.8Very high95.5Very high38 Ų3855.4 Ų55.431%0.31430%0.3SS..Hα-helixtrans-67.1-42.1173.700000112.1A8 L9 L10 T16 L50A8-A12 WeakPolarHBondContact O-CB 3.42Å; A8-A12 PolarHBondContact O-N 3.28Å; L9-A12 WeakPolarHBondContact O-CB 3.34Å; L9-A12 PolarHBondContact O-N 3.43Å; L10-A12 VanDerWaalsContact C-N 3.28Å; L10-A12 PolarHBondContact O-N 3.48Å; A12-T16 WeakPolarHBondContact O-CB 3.42Å; A12-T16 PolarHBondContact O-N 3.35Å; A12-T16 PolarHBondContact O-OG1 3.01Å; A12-L50 HydrophobicContact CB-CD1 4.17Å; A12-L50 HydrophobicContact CB-CD2 4.36Å
13L97.7Very high96Very high0 Ų054.3 Ų54.30%029%0.286CS..Hα-helixtrans-61.8-47.1175.1176.861.7000111.1L9 L10 K15 T16 T17 A47 L50 A51 F82 C85L9-L13 PolarHBondContact O-N 2.94Å; L10-L13 HydrophobicContact CD1-CD2 4.4Å; L10-L13 PolarHBondContact O-N 3.49Å; L13-K15 PolarHBondContact O-N 3.28Å; L13-T16 PolarHBondContact O-N 3.39Å; L13-T17 WeakPolarHBondContact O-CB 3.38Å; L13-T17 PolarHBondContact O-N 2.94Å; L13-T17 PolarHBondContact O-OG1 2.96Å; L13-A47 HydrophobicContact CD1-CB 4.42Å; L13-A47 VanDerWaalsContact CD1-O 3.25Å; L13-A47 WeakPolarHBondContact CD1-O 3.35Å; L13-L50 HydrophobicContact CB-CB 4.2Å; L13-L50 HydrophobicContact CD1-CB 4.01Å; L13-A51 HydrophobicContact CD1-CB 4.24Å; L13-A51 HydrophobicContact CD2-CB 4.4Å; L13-F82 HydrophobicContact CD2-CD2 3.67Å; L13-F82 HydrophobicContact CD2-CE2 3.66Å; L13-C85 HydrophobicContact CD2-CB 4.07Å; L13-C85 HydrophobicContact CG-CB 4.23Å
14N97.4Very high96.4Very high81 Ų8151.1 Ų51.143%0.43327%0.274SS..Hα-helixtrans-60.2-46.9179.1-175.327.7000111.4L10 T16 T17 A18L10-N14 WeakPolarHBondContact O-CB 3.29Å; L10-N14 PolarHBondContact O-N 3.39Å; N14-T16 VanDerWaalsContact C-N 3.33Å; N14-T16 PolarHBondContact O-N 3.04Å; N14-T17 PolarHBondContact O-N 2.96Å; N14-A18 WeakPolarHBondContact O-CB 3.45Å; N14-A18 PolarHBondContact O-N 3.34Å
15K97.9Very high96.5Very high153 Ų15351.1 Ų51.167%0.66528%0.276SS*.Hα-helixtrans-60.9-41175.1-73.6171.2-175.51750112.6D11 L13 A18 C19D11-K15 WeakPolarHBondContact O-CB 3.29Å; D11-K15 VanDerWaalsContact O-CG 3.25Å; D11-K15 WeakPolarHBondContact O-CG 3.29Å; D11-K15 PolarHBondContact O-N 3.46Å; L13-K15 PolarHBondContact O-N 3.28Å; K15-A18 PolarHBondContact O-N 2.93Å; K15-C19 WeakPolarHBondContact O-CB 3.13Å; K15-C19 PolarHBondContact O-N 2.94Å
16T98.1Very high96.6Very high15 Ų1549.3 Ų49.39%0.09227%0.272CS..Hα-helixtrans-68.6-39.3179.5-52.50000110.8A12 L13 N14 C19 Y20 T43 K46 A47A12-T16 WeakPolarHBondContact O-CB 3.42Å; A12-T16 PolarHBondContact O-N 3.35Å; A12-T16 PolarHBondContact O-OG1 3.01Å; L13-T16 PolarHBondContact O-N 3.39Å; N14-T16 VanDerWaalsContact C-N 3.33Å; N14-T16 PolarHBondContact O-N 3.04Å; T16-C19 WeakPolarHBondContact O-CB 3.47Å; T16-C19 PolarHBondContact O-N 3.48Å; T16-Y20 WeakPolarHBondContact O-CB 3.37Å; T16-Y20 PolarHBondContact O-N 3.29Å; T16-T43 HydrophobicContact CG2-CG2 3.86Å; T16-K46 HydrophobicContact CG2-CB 4.37Å; T16-K46 HydrophobicContact CG2-CD 4.38Å; T16-K46 HydrophobicContact CG2-CG 4.26Å; T16-A47 HydrophobicContact CG2-CB 3.91Å
17T97.4Very high96.5Very high4 Ų449.5 Ų49.53%0.02527%0.272CS..Hα-helixtrans-65.2-43.1175.9-51.70000111L13 N14 C19 Y20 H21 L88 L89L13-T17 WeakPolarHBondContact O-CB 3.38Å; L13-T17 PolarHBondContact O-N 2.94Å; L13-T17 PolarHBondContact O-OG1 2.96Å; N14-T17 PolarHBondContact O-N 2.96Å; T17-C19 PolarHBondContact O-N 3.37Å; T17-Y20 WeakPolarHBondContact O-CB 3.39Å; T17-Y20 PolarHBondContact O-N 3.01Å; T17-H21 PolarHBondContact O-N 3.38Å; T17-L88 HydrophobicContact CG2-CB 4.08Å; T17-L89 HydrophobicContact CG2-CB 4.04Å
18A97.4Very high96.1Very high43 Ų4347.1 Ų47.136%0.35527%0.271SS..Hα-helixtrans-63.1-40.7173.900000112.4N14 K15 H21 H22N14-A18 WeakPolarHBondContact O-CB 3.45Å; N14-A18 PolarHBondContact O-N 3.34Å; K15-A18 PolarHBondContact O-N 2.93Å; A18-H21 WeakPolarHBondContact O-CB 3.24Å; A18-H21 PolarHBondContact O-N 3.03Å; A18-H22 PolarHBondContact O-CD2 3.45Å; A18-H22 PolarHBondContact O-N 3.3Å; A18-H22 VanDerWaalsContact O-N 3.12Å
19C97.3Very high95.6Very high62 Ų6246.4 Ų46.442%0.41927%0.27SS..Hα-helixtrans-60.7-47.6173.8-171.40000111.1K15 T16 T17 H21 H22 L23 T43K15-C19 WeakPolarHBondContact O-CB 3.13Å; K15-C19 PolarHBondContact O-N 2.94Å; T16-C19 WeakPolarHBondContact O-CB 3.47Å; T16-C19 PolarHBondContact O-N 3.48Å; T17-C19 PolarHBondContact O-N 3.37Å; C19-H21 VanDerWaalsContact C-N 3.35Å; C19-H21 PolarHBondContact O-N 3.41Å; C19-H22 PolarHBondContact O-N 3.46Å; C19-L23 WeakPolarHBondContact O-CG 3.35Å; C19-L23 PolarHBondContact O-N 2.96Å; C19-L23 VanDerWaalsContact O-N 3.08Å; C19-T43 HydrophobicContact CB-CG2 4.43Å
20Y97.9Very high95Very high0 Ų051.1 Ų51.10%031%0.306CS..Hα-helixtrans-57.8-47.1177-173.6-110.9000111.7T16 T17 H22 L23 V24 L40 T43 R44 L89 D92 M93 S96T16-Y20 WeakPolarHBondContact O-CB 3.37Å; T16-Y20 PolarHBondContact O-N 3.29Å; T17-Y20 WeakPolarHBondContact O-CB 3.39Å; T17-Y20 PolarHBondContact O-N 3.01Å; Y20-H22 VanDerWaalsContact C-N 3.32Å; Y20-H22 PolarHBondContact O-N 3.01Å; Y20-L23 PolarHBondContact O-N 3.49Å; Y20-L23 VanDerWaalsContact O-N 3.13Å; Y20-V24 HydrophobicContact CD1-CG2 4.08Å; Y20-V24 HydrophobicContact CD2-CG2 4.48Å; Y20-V24 HydrophobicContact CE1-CG2 3.7Å; Y20-V24 HydrophobicContact CE2-CG2 4.12Å; Y20-V24 HydrophobicContact CG-CG2 4.45Å; Y20-V24 WeakPolarHBondContact O-CG2 3.43Å; Y20-V24 PolarHBondContact O-N 3.15Å; Y20-L40 HydrophobicContact CD2-CD2 3.71Å; Y20-L40 HydrophobicContact CE2-CB 4.27Å; Y20-L40 HydrophobicContact CE2-CD2 3.39Å; Y20-L40 HydrophobicContact CE2-CG 4.47Å; Y20-L40 WeakPolarHBondContact CE2-O 3.44Å; Y20-T43 HydrophobicContact CD2-CG2 4.21Å; Y20-R44 HydrophobicContact CD2-CB 4.12Å; Y20-R44 HydrophobicContact CE2-CB 3.68Å; Y20-L89 HydrophobicContact CD1-CD1 4Å; Y20-L89 HydrophobicContact CE1-CD1 4.39Å; Y20-D92 HydrophobicContact CD1-CB 3.77Å; Y20-D92 HydrophobicContact CE1-CB 3.77Å; Y20-M93 HydrophobicContact CE1-CB 4.42Å; Y20-M93 HydrophobicContact CE1-CG 3.69Å; Y20-S96 VanDerWaalsContact OH-CB 3.25Å; Y20-S96 WeakPolarHBondContact OH-CB 3.44Å; Y20-S96 PolarHBondContact OH-OG 3.03Å
21H97.6Very high94.5Very high66 Ų6653.2 Ų53.231%0.30633%0.325SS..Hα-helixtrans-52.1-49.6175.3-17673.8000112T17 A18 C19 L23 V24 L25 D92T17-H21 PolarHBondContact O-N 3.38Å; A18-H21 WeakPolarHBondContact O-CB 3.24Å; A18-H21 PolarHBondContact O-N 3.03Å; C19-H21 VanDerWaalsContact C-N 3.35Å; C19-H21 PolarHBondContact O-N 3.41Å; H21-L23 VanDerWaalsContact C-N 3.34Å; H21-L23 PolarHBondContact O-N 3.27Å; H21-V24 PolarHBondContact O-N 3.01Å; H21-L25 WeakPolarHBondContact O-CG 3.48Å; H21-L25 PolarHBondContact O-N 3.16Å; H21-D92 WeakPolarHBondContact CB-OD2 3.48Å; H21-D92 IonicContact CE1-OD1 2.96Å; H21-D92 IonicContact CG-OD2 3.75Å; H21-D92 VanDerWaalsContact ND1-CG 3.26Å; H21-D92 IonicContact ND1-OD1 2.75Å; H21-D92 PolarHBondContact ND1-OD1 2.87Å; H21-D92 IonicContact ND1-OD2 3.56Å; H21-D92 PolarHBondContact ND1-OD2 3.47Å
22H96.6Very high94.1Very high120 Ų12051.1 Ų51.156%0.55631%0.313SS*.Hα-helixtrans-62.3-39.4179.6-73-52.7000113.1A18 C19 Y20 L25A18-H22 PolarHBondContact O-CD2 3.45Å; A18-H22 PolarHBondContact O-N 3.3Å; A18-H22 VanDerWaalsContact O-N 3.12Å; C19-H22 PolarHBondContact O-N 3.46Å; Y20-H22 VanDerWaalsContact C-N 3.32Å; Y20-H22 PolarHBondContact O-N 3.01Å; H22-L25 PolarHBondContact O-N 3.2Å
23L96.1Very high93.7Very high36 Ų3652.4 Ų52.419%0.18832%0.318CS..Hα-helixtrans-65.3-42.6175.3-63.4172.3000111C19 Y20 H21 L25 T26 L36 L40 T43C19-L23 WeakPolarHBondContact O-CG 3.35Å; C19-L23 PolarHBondContact O-N 2.96Å; C19-L23 VanDerWaalsContact O-N 3.08Å; Y20-L23 PolarHBondContact O-N 3.49Å; Y20-L23 VanDerWaalsContact O-N 3.13Å; H21-L23 VanDerWaalsContact C-N 3.34Å; H21-L23 PolarHBondContact O-N 3.27Å; L23-L25 VanDerWaalsContact C-N 3.27Å; L23-L25 PolarHBondContact O-N 3.08Å; L23-T26 PolarHBondContact O-N 2.77Å; L23-T26 PolarHBondContact O-OG1 3.47Å; L23-L36 HydrophobicContact CB-CD1 4.36Å; L23-L36 HydrophobicContact CD2-CD1 3.65Å; L23-L40 HydrophobicContact CB-CD2 3.43Å; L23-L40 VanDerWaalsContact CB-CD2 3.43Å; L23-L40 HydrophobicContact CB-CG 3.89Å; L23-L40 HydrophobicContact CD1-CD2 4.38Å; L23-T43 HydrophobicContact CD1-CG2 4.46Å
24V96.7Very high93.2Very high0 Ų053.9 Ų53.90%033%0.325CS..Hα-helixtrans-61.3-37.2179172.70000111.2Y20 H21 T26 V27 L40 R95 L99Y20-V24 HydrophobicContact CD1-CG2 4.08Å; Y20-V24 HydrophobicContact CD2-CG2 4.48Å; Y20-V24 HydrophobicContact CE1-CG2 3.7Å; Y20-V24 HydrophobicContact CE2-CG2 4.12Å; Y20-V24 HydrophobicContact CG-CG2 4.45Å; Y20-V24 WeakPolarHBondContact O-CG2 3.43Å; Y20-V24 PolarHBondContact O-N 3.15Å; H21-V24 PolarHBondContact O-N 3.01Å; V24-T26 PolarHBondContact O-N 3.21Å; V24-V27 WeakPolarHBondContact O-CB 3.46Å; V24-V27 WeakPolarHBondContact O-CG2 3.47Å; V24-V27 PolarHBondContact O-N 3.28Å; V24-L40 HydrophobicContact CG2-CD2 3.56Å; V24-R95 HydrophobicContact CG1-CB 4.11Å; V24-R95 HydrophobicContact CG1-CG 3.82Å; V24-L99 HydrophobicContact CG1-CD1 4.12Å
25L94.9Very high92.8Very high102 Ų10255.5 Ų55.553%0.53433%0.333SS..Hα-helixtrans-63.3-22.9176.9-68.7178.2000113.8H21 H22 L23H21-L25 WeakPolarHBondContact O-CG 3.48Å; H21-L25 PolarHBondContact O-N 3.16Å; H22-L25 PolarHBondContact O-N 3.2Å; L23-L25 VanDerWaalsContact C-N 3.27Å; L23-L25 PolarHBondContact O-N 3.08Å
26T93.4Very high92.6Very high51 Ų5149.2 Ų49.231%0.31331%0.307SS..Hα-helixtrans-87.6-10.6179.259.80000114.2L23 V24 G29 L36L23-T26 PolarHBondContact O-N 2.77Å; L23-T26 PolarHBondContact O-OG1 3.47Å; V24-T26 PolarHBondContact O-N 3.21Å; T26-G29 PolarHBondContact O-N 3.38Å; T26-G29 VanDerWaalsContact O-N 3.12Å; T26-L36 WeakPolarHBondContact OG1-CD1 3.25Å; T26-L36 VanDerWaalsContact OG1-CD2 3.26Å; T26-L36 WeakPolarHBondContact OG1-CD2 3.3Å
27V91.8Very high92.3Very high9 Ų949 Ų496%0.05530%0.304CS..THydrogen-bonded Turntrans-65.1136.1179.2178.90000111.1V24 G29 L36 R37 L40 L99V24-V27 WeakPolarHBondContact O-CB 3.46Å; V24-V27 WeakPolarHBondContact O-CG2 3.47Å; V24-V27 PolarHBondContact O-N 3.28Å; V27-G29 PolarHBondContact O-N 3.22Å; V27-L36 HydrophobicContact CG2-CD2 4.45Å; V27-R37 VanDerWaalsContact CG1-NH1 3.33Å; V27-R37 VanDerWaalsContact CG1-NH2 3.29Å; V27-L40 HydrophobicContact CG2-CD1 3.46Å; V27-L40 VanDerWaalsContact CG2-CD1 3.46Å; V27-L99 HydrophobicContact CB-CB 4.2Å; V27-L99 HydrophobicContact CB-CD1 4.08Å; V27-L99 HydrophobicContact CG1-CB 3.58Å; V27-L99 HydrophobicContact CG1-CD1 4.37Å
28G86.3Confident92Very high32 Ų3251.6 Ų51.633%0.3332%0.316SS..THydrogen-bonded Turntrans75.8-2-174.200000114.3D32G28-D32 WeakPolarHBondContact CA-OD2 3.5Å; G28-D32 PolarHBondContact N-OD2 2.94Å
29G85.8Confident91.9Very high44 Ų4453.7 Ų53.745%0.45432%0.319SS..SBendtrans-89.4-171.2176.200000113.8T26 V27 A31 D32T26-G29 PolarHBondContact O-N 3.38Å; T26-G29 VanDerWaalsContact O-N 3.12Å; V27-G29 PolarHBondContact O-N 3.22Å; G29-A31 PolarHBondContact O-N 2.96Å; G29-D32 VanDerWaalsContact O-CB 3.31Å; G29-D32 WeakPolarHBondContact O-CB 3.47Å; G29-D32 PolarHBondContact O-N 2.85Å
30S83.6Confident91.8Very high138 Ų13850.9 Ų50.997%0.96530%0.299SS*.THydrogen-bonded Turntrans-72.5-15.5176.857.40000114.1
31A86.2Confident91.7Very high54 Ų5453.7 Ų53.745%0.44631%0.313SS..THydrogen-bonded Turntrans-94.13.8176.600000112.5G29 T33G29-A31 PolarHBondContact O-N 2.96Å; A31-T33 PolarHBondContact O-N 2.93Å
32D88.6Confident91.7Very high25 Ų2555.6 Ų55.613%0.13432%0.32CS..  trans-76.7105.3-177.4-169.29.4000111.3G28 G29 R37G28-D32 WeakPolarHBondContact CA-OD2 3.5Å; G28-D32 PolarHBondContact N-OD2 2.94Å; G29-D32 VanDerWaalsContact O-CB 3.31Å; G29-D32 WeakPolarHBondContact O-CB 3.47Å; G29-D32 PolarHBondContact O-N 2.85Å; D32-R37 IonicContact OD1-CZ 3.29Å; D32-R37 IonicContact OD1-NE 3.95Å; D32-R37 PolarHBondContact OD1-NE 3.13Å; D32-R37 IonicContact OD1-NH2 2.66Å; D32-R37 PolarHBondContact OD1-NH2 3.3Å; D32-R37 IonicContact OD2-CZ 3.29Å; D32-R37 IonicContact OD2-NE 2.61Å; D32-R37 IonicContact OD2-NH2 3.63Å; D32-R37 PolarHBondContact OD2-NH2 2.99Å
33T88.3Confident91.7Very high65 Ų6550.7 Ų50.740%0.39930%0.298SS..  trans-130.7164.3-177.4640000110.7A31 D35 L36 R37A31-T33 PolarHBondContact O-N 2.93Å; T33-D35 VanDerWaalsContact C-N 3.29Å; T33-D35 PolarHBondContact O-N 3.32Å; T33-L36 WeakPolarHBondContact O-CB 3.29Å; T33-L36 PolarHBondContact O-N 2.93Å; T33-L36 VanDerWaalsContact O-N 3.11Å; T33-L36 PolarHBondContact OG1-N 2.89Å; T33-R37 WeakPolarHBondContact O-CG 3.48Å; T33-R37 PolarHBondContact O-N 2.94Å; T33-R37 VanDerWaalsContact O-N 3.14Å
34Q88.5Confident91.7Very high32 Ų3249 Ų4915%0.1529%0.289CS..Hα-helixtrans-57.2-43.6173.9-179.7166-18.700111.6L36 R37 E38 L105 H106 E139Q34-L36 VanDerWaalsContact C-N 3.28Å; Q34-L36 PolarHBondContact O-N 3.08Å; Q34-R37 WeakPolarHBondContact O-CA 3.47Å; Q34-R37 WeakPolarHBondContact O-CB 3.4Å; Q34-R37 PolarHBondContact O-N 3.19Å; Q34-E38 PolarHBondContact O-N 2.92Å; Q34-L105 HydrophobicContact CB-CD1 4.36Å; Q34-H106 PolarHBondContact OE1-CE1 3.3Å; Q34-H106 PolarHBondContact OE1-NE2 3.41Å; Q34-E139 PolarHBondContact NE2-O 3Å
35D89.4Confident91.7Very high114 Ų11452.4 Ų52.461%0.6131%0.305SS*.Hα-helixtrans-55.3-41.8174.6-57-22000112.2T33 R37 E38 E39T33-D35 VanDerWaalsContact C-N 3.29Å; T33-D35 PolarHBondContact O-N 3.32Å; D35-R37 VanDerWaalsContact C-N 3.33Å; D35-R37 PolarHBondContact O-N 3.09Å; D35-E38 PolarHBondContact O-N 3.24Å; D35-E39 WeakPolarHBondContact O-CG 3.34Å; D35-E39 PolarHBondContact O-N 3.42Å
36L92.1Very high91.9Very high21 Ų2153.3 Ų53.311%0.1131%0.305CS..Hα-helixtrans-62.3-40.9175.8179.375000111.4L23 T26 V27 T33 Q34 E39 L40L23-L36 HydrophobicContact CB-CD1 4.36Å; L23-L36 HydrophobicContact CD2-CD1 3.65Å; T26-L36 WeakPolarHBondContact OG1-CD1 3.25Å; T26-L36 VanDerWaalsContact OG1-CD2 3.26Å; T26-L36 WeakPolarHBondContact OG1-CD2 3.3Å; V27-L36 HydrophobicContact CG2-CD2 4.45Å; T33-L36 WeakPolarHBondContact O-CB 3.29Å; T33-L36 PolarHBondContact O-N 2.93Å; T33-L36 VanDerWaalsContact O-N 3.11Å; T33-L36 PolarHBondContact OG1-N 2.89Å; Q34-L36 VanDerWaalsContact C-N 3.28Å; Q34-L36 PolarHBondContact O-N 3.08Å; L36-E39 PolarHBondContact O-N 3.26Å; L36-L40 HydrophobicContact CG-CD1 4.49Å; L36-L40 WeakPolarHBondContact O-CG 3.43Å; L36-L40 PolarHBondContact O-N 2.95Å
37R92.2Very high92.1Very high11 Ų1150.9 Ų50.94%0.04229%0.29CS..Hα-helixtrans-68-38.5179.3-58.2-51.6-173.2119.112.4112.3V27 D32 T33 Q34 D35 L40 Q41 G100 F103 L105 F142V27-R37 VanDerWaalsContact CG1-NH1 3.33Å; V27-R37 VanDerWaalsContact CG1-NH2 3.29Å; D32-R37 IonicContact OD1-CZ 3.29Å; D32-R37 IonicContact OD1-NE 3.95Å; D32-R37 PolarHBondContact OD1-NE 3.13Å; D32-R37 IonicContact OD1-NH2 2.66Å; D32-R37 PolarHBondContact OD1-NH2 3.3Å; D32-R37 IonicContact OD2-CZ 3.29Å; D32-R37 IonicContact OD2-NE 2.61Å; D32-R37 IonicContact OD2-NH2 3.63Å; D32-R37 PolarHBondContact OD2-NH2 2.99Å; T33-R37 WeakPolarHBondContact O-CG 3.48Å; T33-R37 PolarHBondContact O-N 2.94Å; T33-R37 VanDerWaalsContact O-N 3.14Å; Q34-R37 WeakPolarHBondContact O-CA 3.47Å; Q34-R37 WeakPolarHBondContact O-CB 3.4Å; Q34-R37 PolarHBondContact O-N 3.19Å; D35-R37 VanDerWaalsContact C-N 3.33Å; D35-R37 PolarHBondContact O-N 3.09Å; R37-L40 WeakPolarHBondContact O-CB 3.37Å; R37-L40 PolarHBondContact O-N 3.44Å; R37-Q41 PolarHBondContact O-N 3.12Å; R37-G100 VanDerWaalsContact NH1-CA 3.33Å; R37-F103 PolarHBondContact NH2-O 2.9Å; R37-L105 HydrophobicContact CG-CD1 3.54Å; R37-F142 HydrophobicContact CB-CD1 3.95Å; R37-F142 HydrophobicContact CB-CE1 3.48Å; R37-F142 VanDerWaalsContact CB-CE1 3.48Å; R37-F142 HydrophobicContact CB-CZ 4.15Å
38E92.4Very high92.3Very high59 Ų5952.1 Ų52.128%0.27629%0.294SS..Hα-helixtrans-64.9-42.2172.3-69.4179.5-165.700111.8Q34 D35 L40 Q41 K42 F142Q34-E38 PolarHBondContact O-N 2.92Å; D35-E38 PolarHBondContact O-N 3.24Å; E38-L40 VanDerWaalsContact C-N 3.31Å; E38-L40 PolarHBondContact O-N 3.02Å; E38-Q41 PolarHBondContact O-N 3.29Å; E38-K42 WeakPolarHBondContact O-CG 3.47Å; E38-K42 PolarHBondContact O-N 3.3Å; E38-F142 HydrophobicContact CG-CD2 4.18Å; E38-F142 HydrophobicContact CG-CE2 3.69Å; E38-F142 HydrophobicContact CG-CZ 4.22Å
39E94.8Very high92.8Very high87 Ų8755.9 Ų55.941%0.40730%0.303SS..Hα-helixtrans-65.3-34175.6-72.3-54.3123.400112.2D35 L36 K42 T43D35-E39 WeakPolarHBondContact O-CG 3.34Å; D35-E39 PolarHBondContact O-N 3.42Å; L36-E39 PolarHBondContact O-N 3.26Å; E39-K42 WeakPolarHBondContact OE1-CD 3.34Å; E39-K42 IonicContact OE1-NZ 2.77Å; E39-K42 PolarHBondContact OE1-NZ 3.3Å; E39-T43 WeakPolarHBondContact O-CB 3.39Å; E39-T43 PolarHBondContact O-N 3.48Å; E39-T43 PolarHBondContact O-OG1 3.5Å
40L95.3Very high93.4Very high3 Ų355.2 Ų55.22%0.01629%0.289CS..Hα-helixtrans-60.9-46.7170.2-82.7165.1000111.7Y20 L23 V24 V27 L36 R37 E38 T43 R44Y20-L40 HydrophobicContact CD2-CD2 3.71Å; Y20-L40 HydrophobicContact CE2-CB 4.27Å; Y20-L40 HydrophobicContact CE2-CD2 3.39Å; Y20-L40 HydrophobicContact CE2-CG 4.47Å; Y20-L40 WeakPolarHBondContact CE2-O 3.44Å; L23-L40 HydrophobicContact CB-CD2 3.43Å; L23-L40 VanDerWaalsContact CB-CD2 3.43Å; L23-L40 HydrophobicContact CB-CG 3.89Å; L23-L40 HydrophobicContact CD1-CD2 4.38Å; V24-L40 HydrophobicContact CG2-CD2 3.56Å; V27-L40 HydrophobicContact CG2-CD1 3.46Å; V27-L40 VanDerWaalsContact CG2-CD1 3.46Å; L36-L40 HydrophobicContact CG-CD1 4.49Å; L36-L40 WeakPolarHBondContact O-CG 3.43Å; L36-L40 PolarHBondContact O-N 2.95Å; R37-L40 WeakPolarHBondContact O-CB 3.37Å; R37-L40 PolarHBondContact O-N 3.44Å; E38-L40 VanDerWaalsContact C-N 3.31Å; E38-L40 PolarHBondContact O-N 3.02Å; L40-T43 PolarHBondContact O-N 3.11Å; L40-R44 WeakPolarHBondContact O-CG 3.48Å; L40-R44 PolarHBondContact O-N 3.32Å
41Q95.8Very high94Very high59 Ų5948.7 Ų48.728%0.27624%0.243SC..Hα-helixtrans-61.3-47.2176.7-177.6-179.231.400111.8R37 E38 T43 R44 Q45 F142 E149R37-Q41 PolarHBondContact O-N 3.12Å; E38-Q41 PolarHBondContact O-N 3.29Å; Q41-T43 VanDerWaalsContact C-N 3.34Å; Q41-T43 PolarHBondContact O-N 3.5Å; Q41-R44 VanDerWaalsContact O-CG 3.25Å; Q41-R44 WeakPolarHBondContact O-CG 3.46Å; Q41-Q45 WeakPolarHBondContact O-CB 3.42Å; Q41-Q45 PolarHBondContact O-N 3.3Å; Q41-F142 HydrophobicContact CB-CZ 4.41Å; Q41-E149 PolarHBondContact NE2-OE2 3.47Å
42K96.6Very high94.4Very high106 Ų10650.5 Ų50.546%0.46125%0.248SC..Hα-helixtrans-62.2-42.5177.1-67.4169.9-159161.50111.7E38 E39 Q45 K46E38-K42 WeakPolarHBondContact O-CG 3.47Å; E38-K42 PolarHBondContact O-N 3.3Å; E39-K42 WeakPolarHBondContact OE1-CD 3.34Å; E39-K42 IonicContact OE1-NZ 2.77Å; E39-K42 PolarHBondContact OE1-NZ 3.3Å; K42-Q45 PolarHBondContact O-N 3.36Å; K42-K46 WeakPolarHBondContact O-CB 3.43Å; K42-K46 PolarHBondContact O-N 3.45Å
43T97.3Very high94.7Very high17 Ų1751.2 Ų51.210%0.10426%0.258CS..Hα-helixtrans-68.7-42.8-177.6-56.60000111.5T16 C19 Y20 L23 E39 L40 Q41 K46 A47T16-T43 HydrophobicContact CG2-CG2 3.86Å; C19-T43 HydrophobicContact CB-CG2 4.43Å; Y20-T43 HydrophobicContact CD2-CG2 4.21Å; L23-T43 HydrophobicContact CD1-CG2 4.46Å; E39-T43 WeakPolarHBondContact O-CB 3.39Å; E39-T43 PolarHBondContact O-N 3.48Å; E39-T43 PolarHBondContact O-OG1 3.5Å; L40-T43 PolarHBondContact O-N 3.11Å; Q41-T43 VanDerWaalsContact C-N 3.34Å; Q41-T43 PolarHBondContact O-N 3.5Å; T43-K46 PolarHBondContact O-N 3.02Å; T43-A47 WeakPolarHBondContact O-CB 3.37Å; T43-A47 PolarHBondContact O-N 2.73Å
44R96.1Very high95.1Very high0 Ų048.1 Ų48.10%024%0.239CC..Hα-helixtrans-66.8-38.2176.472.7-173.3-168.5-124.80.7112.4Y20 L40 Q41 A47 R48 D146 E149 E153Y20-R44 HydrophobicContact CD2-CB 4.12Å; Y20-R44 HydrophobicContact CE2-CB 3.68Å; L40-R44 WeakPolarHBondContact O-CG 3.48Å; L40-R44 PolarHBondContact O-N 3.32Å; Q41-R44 VanDerWaalsContact O-CG 3.25Å; Q41-R44 WeakPolarHBondContact O-CG 3.46Å; R44-A47 PolarHBondContact O-N 3.13Å; R44-R48 WeakPolarHBondContact O-CG 3.42Å; R44-R48 PolarHBondContact O-N 3.11Å; R44-D146 IonicContact CZ-OD1 2.74Å; R44-D146 VanDerWaalsContact CZ-OD1 3.24Å; R44-D146 IonicContact CZ-OD2 3.7Å; R44-D146 VanDerWaalsContact NH1-CG 3.33Å; R44-D146 IonicContact NH1-OD1 2.62Å; R44-D146 PolarHBondContact NH1-OD1 2.87Å; R44-D146 IonicContact NH1-OD2 3.18Å; R44-D146 PolarHBondContact NH1-OD2 3.18Å; R44-D146 IonicContact NH2-OD1 2.66Å; R44-D146 PolarHBondContact NH2-OD1 2.91Å; R44-D146 IonicContact NH2-OD2 3.74Å; R44-E149 IonicContact NH2-OE2 3.81Å; R44-E153 WeakPolarHBondContact CD-OE2 3.47Å; R44-E153 IonicContact CZ-OE2 3.08Å; R44-E153 IonicContact NE-OE2 3.11Å; R44-E153 PolarHBondContact NE-OE2 3.03Å; R44-E153 IonicContact NH2-OE2 3.72Å
45Q97.1Very high95.3Very high72 Ų7246.9 Ų46.934%0.33623%0.234SC..Hα-helixtrans-60.5-48.6175.3178.258.124.800110.8Q41 K42 A47 R48 E49Q41-Q45 WeakPolarHBondContact O-CB 3.42Å; Q41-Q45 PolarHBondContact O-N 3.3Å; K42-Q45 PolarHBondContact O-N 3.36Å; Q45-A47 VanDerWaalsContact C-N 3.34Å; Q45-A47 PolarHBondContact O-N 3.36Å; Q45-R48 PolarHBondContact O-N 2.69Å; Q45-E49 PolarHBondContact NE2-OE1 2.88Å; Q45-E49 WeakPolarHBondContact O-CG 3.49Å; Q45-E49 PolarHBondContact O-N 3.26Å
46K97.8Very high95.5Very high120 Ų12044.1 Ų44.152%0.52223%0.227SC..Hα-helixtrans-60.8-41.4175.6-175.9176.4-1801780112.6T16 K42 T43 R48 E49 L50T16-K46 HydrophobicContact CG2-CB 4.37Å; T16-K46 HydrophobicContact CG2-CD 4.38Å; T16-K46 HydrophobicContact CG2-CG 4.26Å; K42-K46 WeakPolarHBondContact O-CB 3.43Å; K42-K46 PolarHBondContact O-N 3.45Å; T43-K46 PolarHBondContact O-N 3.02Å; K46-R48 VanDerWaalsContact C-N 3.34Å; K46-R48 PolarHBondContact O-N 3.49Å; K46-E49 PolarHBondContact O-N 3.46Å; K46-L50 HydrophobicContact CG-CD1 4.26Å; K46-L50 WeakPolarHBondContact O-CB 3.43Å; K46-L50 WeakPolarHBondContact O-CG 3.43Å; K46-L50 PolarHBondContact O-N 3.09Å
47A97.8Very high95.5Very high0 Ų048.3 Ų48.30%024%0.242CC..Hα-helixtrans-61.3-43176.700000111.3L13 T16 T43 R44 Q45 L50 A51 L89L13-A47 HydrophobicContact CD1-CB 4.42Å; L13-A47 VanDerWaalsContact CD1-O 3.25Å; L13-A47 WeakPolarHBondContact CD1-O 3.35Å; T16-A47 HydrophobicContact CG2-CB 3.91Å; T43-A47 WeakPolarHBondContact O-CB 3.37Å; T43-A47 PolarHBondContact O-N 2.73Å; R44-A47 PolarHBondContact O-N 3.13Å; Q45-A47 VanDerWaalsContact C-N 3.34Å; Q45-A47 PolarHBondContact O-N 3.36Å; A47-L50 PolarHBondContact O-N 3.41Å; A47-A51 WeakPolarHBondContact O-CB 3.41Å; A47-A51 PolarHBondContact O-N 2.64Å; A47-L89 HydrophobicContact CB-CD1 3.81Å; A47-L89 HydrophobicContact CB-CD2 3.84Å
48R96.7Very high95.5Very high35 Ų3547.9 Ų47.913%0.13224%0.24CC..Hα-helixtrans-64.7-42.6176.9-75.2171.157.1-131.55112.7R44 Q45 K46 L50 A51 V52 E153 V157R44-R48 WeakPolarHBondContact O-CG 3.42Å; R44-R48 PolarHBondContact O-N 3.11Å; Q45-R48 PolarHBondContact O-N 2.69Å; K46-R48 VanDerWaalsContact C-N 3.34Å; K46-R48 PolarHBondContact O-N 3.49Å; R48-L50 PolarHBondContact O-N 2.92Å; R48-A51 WeakPolarHBondContact O-CB 3.49Å; R48-A51 PolarHBondContact O-N 3.13Å; R48-V52 WeakPolarHBondContact O-CG2 3.38Å; R48-V52 PolarHBondContact O-N 3.23Å; R48-E153 IonicContact CZ-OE1 3.7Å; R48-E153 VanDerWaalsContact NH1-CG 3.34Å; R48-E153 IonicContact NH1-OE1 2.7Å; R48-E153 PolarHBondContact NH1-OE1 2.84Å; R48-E153 IonicContact NH1-OE2 2.74Å; R48-V157 HydrophobicContact CG-CG2 3.9Å
49E96.9Very high95.5Very high112 Ų11245.8 Ų45.852%0.52323%0.231SC..Hα-helixtrans-60.6-45.3175.1-72.7171.2-169.200111.9Q45 K46 A51 V52 A53Q45-E49 PolarHBondContact NE2-OE1 2.88Å; Q45-E49 WeakPolarHBondContact O-CG 3.49Å; Q45-E49 PolarHBondContact O-N 3.26Å; K46-E49 PolarHBondContact O-N 3.46Å; E49-A51 VanDerWaalsContact C-N 3.32Å; E49-A51 PolarHBondContact O-N 3.48Å; E49-V52 PolarHBondContact O-N 3.23Å; E49-A53 WeakPolarHBondContact O-CB 3Å; E49-A53 PolarHBondContact O-N 3.36Å
50L97.2Very high95.4Very high30 Ų3046.8 Ų46.816%0.15724%0.243CC..Hα-helixtrans-63.5-38.9174.7-71.4172.6000111.6L9 A12 L13 K46 A47 R48 A53 T54L9-L50 HydrophobicContact CD2-CD2 4.32Å; A12-L50 HydrophobicContact CB-CD1 4.17Å; A12-L50 HydrophobicContact CB-CD2 4.36Å; L13-L50 HydrophobicContact CB-CB 4.2Å; L13-L50 HydrophobicContact CD1-CB 4.01Å; K46-L50 HydrophobicContact CG-CD1 4.26Å; K46-L50 WeakPolarHBondContact O-CB 3.43Å; K46-L50 WeakPolarHBondContact O-CG 3.43Å; K46-L50 PolarHBondContact O-N 3.09Å; A47-L50 PolarHBondContact O-N 3.41Å; R48-L50 PolarHBondContact O-N 2.92Å; L50-A53 PolarHBondContact O-N 2.84Å; L50-T54 WeakPolarHBondContact O-CB 3.44Å; L50-T54 PolarHBondContact O-N 3.29Å; L50-T54 PolarHBondContact O-OG1 3.29Å
51A96.4Very high95.2Very high0 Ų047.6 Ų47.60%025%0.25CS..Hα-helixtrans-61.5-48.7177.400000111.9L13 A47 R48 E49 T54 G55 F82 L86 M160L13-A51 HydrophobicContact CD1-CB 4.24Å; L13-A51 HydrophobicContact CD2-CB 4.4Å; A47-A51 WeakPolarHBondContact O-CB 3.41Å; A47-A51 PolarHBondContact O-N 2.64Å; R48-A51 WeakPolarHBondContact O-CB 3.49Å; R48-A51 PolarHBondContact O-N 3.13Å; E49-A51 VanDerWaalsContact C-N 3.32Å; E49-A51 PolarHBondContact O-N 3.48Å; A51-T54 PolarHBondContact O-N 3.05Å; A51-G55 PolarHBondContact O-N 3.06Å; A51-F82 HydrophobicContact CB-CE2 4.47Å; A51-F82 WeakPolarHBondContact O-CE2 3.21Å; A51-L86 HydrophobicContact CB-CD2 3.61Å; A51-M160 HydrophobicContact CB-CE 3.76Å; A51-M160 HydrophobicContact CB-SD 4.14Å
52V95.5Very high94.9Very high92 Ų9245.3 Ų45.356%0.55824%0.24SC*.Hα-helixtrans-61.3-47.6177.2172.30000111R48 E49 T54 G55 A56 M160R48-V52 WeakPolarHBondContact O-CG2 3.38Å; R48-V52 PolarHBondContact O-N 3.23Å; E49-V52 PolarHBondContact O-N 3.23Å; V52-T54 PolarHBondContact O-N 3.41Å; V52-G55 PolarHBondContact O-N 2.99Å; V52-A56 WeakPolarHBondContact O-CB 3.45Å; V52-A56 PolarHBondContact O-N 2.82Å; V52-M160 HydrophobicContact CG2-SD 4.2Å
53A95.6Very high94.5Very high41 Ų4147.4 Ų47.434%0.33925%0.245SC..Hα-helixtrans-63.4-42.9-179.600000112.4E49 L50 R57E49-A53 WeakPolarHBondContact O-CB 3Å; E49-A53 PolarHBondContact O-N 3.36Å; L50-A53 PolarHBondContact O-N 2.84Å; A53-R57 WeakPolarHBondContact O-CG 3.29Å; A53-R57 PolarHBondContact O-N 3.26Å
54T95.2Very high94.1Very high0 Ų050.7 Ų50.70%026%0.262CS..Hα-helixtrans-68.4-46.6179.2-52.70000110.5L9 L10 L50 A51 V52 A56 R57 L58 F82L9-T54 HydrophobicContact CB-CG2 4.43Å; L9-T54 WeakPolarHBondContact CB-OG1 3.36Å; L10-T54 HydrophobicContact CB-CG2 4.32Å; L50-T54 WeakPolarHBondContact O-CB 3.44Å; L50-T54 PolarHBondContact O-N 3.29Å; L50-T54 PolarHBondContact O-OG1 3.29Å; A51-T54 PolarHBondContact O-N 3.05Å; V52-T54 PolarHBondContact O-N 3.41Å; T54-A56 PolarHBondContact O-N 2.88Å; T54-R57 PolarHBondContact O-N 3.48Å; T54-L58 HydrophobicContact CG2-CD1 3.8Å; T54-L58 HydrophobicContact CG2-CG 4.23Å; T54-L58 WeakPolarHBondContact O-CB 3.31Å; T54-L58 WeakPolarHBondContact O-CG 3.21Å; T54-L58 PolarHBondContact O-N 3.21Å; T54-F82 HydrophobicContact CG2-CD2 3.54Å; T54-F82 HydrophobicContact CG2-CE2 4Å; T54-F82 HydrophobicContact CG2-CG 4.41Å
55G93.3Very high93.4Very high5 Ų562 Ų625%0.05230%0.304CS..Hα-helixtrans-63-42.3-179.700000113.1A51 V52 R57 T59 M164A51-G55 PolarHBondContact O-N 3.06Å; V52-G55 PolarHBondContact O-N 2.99Å; G55-R57 PolarHBondContact O-N 3.43Å; G55-T59 VanDerWaalsContact O-CB 3.27Å; G55-T59 WeakPolarHBondContact O-CB 3.39Å; G55-T59 PolarHBondContact O-N 3.04Å; G55-T59 PolarHBondContact O-OG1 3.06Å; G55-M164 VanDerWaalsContact CA-CE 3.4Å
56A92.9Very high92.7Very high56 Ų5661.8 Ų61.846%0.46332%0.322SS..Hα-helixtrans-60.1-4717500000111.7V52 T54 T59 V60V52-A56 WeakPolarHBondContact O-CB 3.45Å; V52-A56 PolarHBondContact O-N 2.82Å; T54-A56 PolarHBondContact O-N 2.88Å; A56-T59 PolarHBondContact O-N 3.33Å; A56-V60 WeakPolarHBondContact O-CG2 3.39Å; A56-V60 PolarHBondContact O-N 2.7Å
57R92.9Very high92.1Very high110 Ų11057.7 Ų57.742%0.41531%0.306SS..Hα-helixtrans-66.3-45.1-179.7-77.1177.3165.2-130.8-2.6112.7E5 A53 T54 G55 T59 V60 A61E5-R57 IonicContact OE2-CZ 2.7Å; E5-R57 IonicContact OE2-NH1 2.85Å; E5-R57 PolarHBondContact OE2-NH1 3.08Å; E5-R57 IonicContact OE2-NH2 2.84Å; A53-R57 WeakPolarHBondContact O-CG 3.29Å; A53-R57 PolarHBondContact O-N 3.26Å; T54-R57 PolarHBondContact O-N 3.48Å; G55-R57 PolarHBondContact O-N 3.43Å; R57-T59 VanDerWaalsContact C-N 3.33Å; R57-T59 PolarHBondContact O-N 2.99Å; R57-V60 PolarHBondContact O-N 2.84Å; R57-A61 PolarHBondContact O-N 3.29Å
58L92.8Very high91.7Very high1 Ų160.2 Ų60.21%0.00533%0.327CS..Hα-helixtrans-64.5-39.1177.2-69.8173.8000111.8C6 T54 A61 L62 F75 L78 W79 F82C6-L58 HydrophobicContact CB-CD2 3.96Å; T54-L58 HydrophobicContact CG2-CD1 3.8Å; T54-L58 HydrophobicContact CG2-CG 4.23Å; T54-L58 WeakPolarHBondContact O-CB 3.31Å; T54-L58 WeakPolarHBondContact O-CG 3.21Å; T54-L58 PolarHBondContact O-N 3.21Å; L58-A61 PolarHBondContact O-N 2.67Å; L58-L62 WeakPolarHBondContact O-CB 3.46Å; L58-L62 WeakPolarHBondContact O-CG 3.26Å; L58-L62 PolarHBondContact O-N 2.88Å; L58-F75 HydrophobicContact CD2-CD1 3.96Å; L58-L78 HydrophobicContact CD2-CB 3.92Å; L58-L78 HydrophobicContact CD2-CD1 4.45Å; L58-W79 HydrophobicContact CB-CE3 3.67Å; L58-W79 HydrophobicContact CB-CZ3 3.91Å; L58-W79 HydrophobicContact CD1-CE3 4.11Å; L58-F82 HydrophobicContact CD1-CB 3.77Å; L58-F82 HydrophobicContact CD1-CD1 4.46Å; L58-F82 HydrophobicContact CD1-CD2 4.29Å; L58-F82 HydrophobicContact CD1-CG 3.88Å
59T92.1Very high91.1Very high15 Ų1563.1 Ų63.19%0.09235%0.352CS..Hα-helixtrans-62.7-43.6176.8-59.20000111.4G55 A56 R57 R63 K167 V168G55-T59 VanDerWaalsContact O-CB 3.27Å; G55-T59 WeakPolarHBondContact O-CB 3.39Å; G55-T59 PolarHBondContact O-N 3.04Å; G55-T59 PolarHBondContact O-OG1 3.06Å; A56-T59 PolarHBondContact O-N 3.33Å; R57-T59 VanDerWaalsContact C-N 3.33Å; R57-T59 PolarHBondContact O-N 2.99Å; T59-R63 HydrophobicContact CG2-CG 4.45Å; T59-R63 WeakPolarHBondContact O-CB 3.27Å; T59-R63 VanDerWaalsContact O-CG 3.23Å; T59-R63 WeakPolarHBondContact O-CG 3.23Å; T59-R63 PolarHBondContact O-N 3.29Å; T59-R63 VanDerWaalsContact O-N 3.13Å; T59-K167 HydrophobicContact CG2-CB 4.38Å; T59-K167 HydrophobicContact CG2-CD 4.49Å; T59-V168 HydrophobicContact CG2-CG2 4.31Å
60V92.2Very high90.6Very high109 Ų10964.1 Ų64.166%0.66136%0.357SS*.Hα-helixtrans-61.7-46.2176.21700000110.7A56 R57 D64A56-V60 WeakPolarHBondContact O-CG2 3.39Å; A56-V60 PolarHBondContact O-N 2.7Å; R57-V60 PolarHBondContact O-N 2.84Å; V60-D64 PolarHBondContact O-N 3.06Å
61A91.1Very high90.2Very high19 Ų1967.4 Ų67.416%0.15737%0.371CS..Hα-helixtrans-60.9-51.9178.100000111.5R57 L58 R63 D64 L67 F75R57-A61 PolarHBondContact O-N 3.29Å; L58-A61 PolarHBondContact O-N 2.67Å; A61-R63 VanDerWaalsContact C-N 3.26Å; A61-R63 PolarHBondContact O-N 2.66Å; A61-D64 WeakPolarHBondContact O-CB 3.29Å; A61-D64 PolarHBondContact O-N 3.36Å; A61-D64 VanDerWaalsContact O-N 3.09Å; A61-L67 WeakPolarHBondContact O-CD1 3.36Å; A61-F75 HydrophobicContact CB-CD1 3.79Å; A61-F75 HydrophobicContact CB-CD2 4.29Å; A61-F75 HydrophobicContact CB-CE1 3.67Å; A61-F75 HydrophobicContact CB-CE2 4.19Å; A61-F75 HydrophobicContact CB-CG 4.11Å; A61-F75 HydrophobicContact CB-CZ 3.88Å
62L89.5Confident89.8Confident11 Ų1170.6 Ų70.66%0.05838%0.383CS..Hα-helixtrans-67.6-24.6-174.5-73.1165.3000114L58 R72 F75 E76 W79 V168L58-L62 WeakPolarHBondContact O-CB 3.46Å; L58-L62 WeakPolarHBondContact O-CG 3.26Å; L58-L62 PolarHBondContact O-N 2.88Å; L62-R72 PolarHBondContact O-NH1 3.21Å; L62-F75 HydrophobicContact CD2-CB 3.55Å; L62-F75 HydrophobicContact CG-CB 3.99Å; L62-E76 HydrophobicContact CD2-CG 3.83Å; L62-W79 HydrophobicContact CD1-CB 3.79Å; L62-W79 HydrophobicContact CD1-CD2 3.89Å; L62-W79 HydrophobicContact CD1-CE3 3.72Å; L62-W79 HydrophobicContact CD1-CG 3.94Å; L62-V168 HydrophobicContact CB-CG1 4.2Å; L62-V168 HydrophobicContact CB-CG2 4.41Å; L62-V168 HydrophobicContact CD1-CG1 3.72Å; L62-V168 HydrophobicContact CD1-CG2 4.47Å; L62-V168 HydrophobicContact CG-CG1 4.49Å
63R88.7Confident89.5Confident150 Ų15067.7 Ų67.757%0.56637%0.369SS*.Hα-helixtrans-77-19.5174.9-75.5179.7174.9-167.9-3.2113.9T59 A61 R65T59-R63 HydrophobicContact CG2-CG 4.45Å; T59-R63 WeakPolarHBondContact O-CB 3.27Å; T59-R63 VanDerWaalsContact O-CG 3.23Å; T59-R63 WeakPolarHBondContact O-CG 3.23Å; T59-R63 PolarHBondContact O-N 3.29Å; T59-R63 VanDerWaalsContact O-N 3.13Å; A61-R63 VanDerWaalsContact C-N 3.26Å; A61-R63 PolarHBondContact O-N 2.66Å; R63-R65 PolarHBondContact O-N 3.28Å
64D88.1Confident89.2Confident86 Ų8667 Ų6746%0.4636%0.359SS..  trans-67.6118.4176.4-175.82.5000110.2V60 A61 G66 L67 R72V60-D64 PolarHBondContact O-N 3.06Å; A61-D64 WeakPolarHBondContact O-CB 3.29Å; A61-D64 PolarHBondContact O-N 3.36Å; A61-D64 VanDerWaalsContact O-N 3.09Å; D64-G66 VanDerWaalsContact C-N 3.32Å; D64-G66 PolarHBondContact OD1-N 3.37Å; D64-L67 HydrophobicContact CB-CD1 4.26Å; D64-L67 HydrophobicContact CB-CG 4.18Å; D64-R72 PolarHBondContact O-NH2 3.46Å
65R80.7Confident89Confident237 Ų23767.4 Ų67.489%0.89436%0.361SS*.THydrogen-bonded Turntrans-80.3-12.5179.6-64.4-168.2-177.2-145.11.8113.2R63 L67R63-R65 PolarHBondContact O-N 3.28Å; R65-L67 VanDerWaalsContact C-N 3.34Å
66G82.7Confident88.8Confident69 Ų6969.5 Ų69.571%0.71137%0.369SS*.THydrogen-bonded Turntrans-82.6-6.1179.500000114.8D64D64-G66 VanDerWaalsContact C-N 3.32Å; D64-G66 PolarHBondContact OD1-N 3.37Å
67L85.4Confident88.7Confident34 Ų3469.5 Ų69.518%0.17836%0.357CS..  trans-64.5136.4-179.8-77.3171.9000112.6A61 D64 R65 E71 F75A61-L67 WeakPolarHBondContact O-CD1 3.36Å; D64-L67 HydrophobicContact CB-CD1 4.26Å; D64-L67 HydrophobicContact CB-CG 4.18Å; R65-L67 VanDerWaalsContact C-N 3.34Å; L67-E71 HydrophobicContact CD2-CB 4.34Å; L67-F75 HydrophobicContact CD1-CD2 4.22Å; L67-F75 HydrophobicContact CD2-CE2 4.33Å
68A89.2Confident88.7Confident53 Ų5365.4 Ų65.444%0.43834%0.343SS..  trans-60.9151.1169.700000110.9E70 E71 R72A68-E70 VanDerWaalsContact C-N 3.3Å; A68-E70 PolarHBondContact O-N 3.37Å; A68-E71 HydrophobicContact CB-CG 4.39Å; A68-E71 PolarHBondContact O-N 3.05Å; A68-R72 WeakPolarHBondContact O-CB 3.36Å; A68-R72 PolarHBondContact O-N 2.74Å
69S85Confident88.7Confident95 Ų9565.9 Ų65.966%0.66435%0.345SS*.Hα-helixtrans-59.2-39.2-176.557.60000113.2A73S69-A73 WeakPolarHBondContact O-CB 3.15Å; S69-A73 PolarHBondContact O-N 3.13Å
70E86.7Confident88.6Confident134 Ų13466.6 Ų66.663%0.62635%0.349SS*.Hα-helixtrans-64.7-47.1177.5-70.5-63.314700112A68 A73 E74A68-E70 VanDerWaalsContact C-N 3.3Å; A68-E70 PolarHBondContact O-N 3.37Å; E70-A73 PolarHBondContact O-N 3.01Å; E70-E74 WeakPolarHBondContact O-CG 3.32Å; E70-E74 PolarHBondContact O-N 2.95Å; E70-E74 VanDerWaalsContact O-N 3.09Å
71E88.1Confident88.7Confident99 Ų9963.8 Ų63.846%0.46334%0.337SS..Hα-helixtrans-65.8-40.4178.8-65.6-175.7138.900111.1L67 A68 E74 F75L67-E71 HydrophobicContact CD2-CB 4.34Å; A68-E71 HydrophobicContact CB-CG 4.39Å; A68-E71 PolarHBondContact O-N 3.05Å; E71-E74 WeakPolarHBondContact O-CB 3.44Å; E71-E74 PolarHBondContact O-N 3.5Å; E71-F75 WeakPolarHBondContact O-CD2 3.4Å; E71-F75 PolarHBondContact O-N 3.41Å
72R88.6Confident88.8Confident67 Ų6762.9 Ų62.925%0.25333%0.33SS..Hα-helixtrans-57.6-49.9173.1178176.5-64.3-76-5.4111L62 D64 A68 E74 F75 E76L62-R72 PolarHBondContact O-NH1 3.21Å; D64-R72 PolarHBondContact O-NH2 3.46Å; A68-R72 WeakPolarHBondContact O-CB 3.36Å; A68-R72 PolarHBondContact O-N 2.74Å; R72-E74 PolarHBondContact O-N 3.07Å; R72-F75 PolarHBondContact O-N 3Å; R72-F75 VanDerWaalsContact O-N 3.08Å; R72-E76 HydrophobicContact CG-CG 4.29Å; R72-E76 WeakPolarHBondContact CG-OE1 3.46Å; R72-E76 VanDerWaalsContact O-CG 3.3Å; R72-E76 WeakPolarHBondContact O-CG 3.47Å; R72-E76 PolarHBondContact O-N 3.44Å
73A88.1Confident89Confident31 Ų3163 Ų6326%0.25633%0.331SS..Hα-helixtrans-60.1-30.8178.900000112.6S69 E70 R77S69-A73 WeakPolarHBondContact O-CB 3.15Å; S69-A73 PolarHBondContact O-N 3.13Å; E70-A73 PolarHBondContact O-N 3.01Å; A73-R77 WeakPolarHBondContact O-CG 2.98Å; A73-R77 PolarHBondContact O-N 2.99Å; A73-R77 VanDerWaalsContact O-N 3.13Å; A73-R77 PolarHBondContact O-NE 3.06Å
74E89.1Confident89.2Confident25 Ų2557 Ų5712%0.11732%0.317CS..Hα-helixtrans-72.4-41173.4-68.4179.314400113.3R3 E70 E71 R72 E76 R77 L78 R178R3-E74 WeakPolarHBondContact CD-OE2 3.48Å; R3-E74 IonicContact CZ-OE1 2.72Å; R3-E74 IonicContact CZ-OE2 3.41Å; R3-E74 IonicContact NE-OE2 3.91Å; R3-E74 PolarHBondContact NE-OE2 3.43Å; R3-E74 IonicContact NH1-OE1 3.58Å; R3-E74 PolarHBondContact NH1-OE1 3.48Å; R3-E74 IonicContact NH1-OE2 3.3Å; R3-E74 PolarHBondContact NH1-OE2 3.14Å; R3-E74 IonicContact NH2-OE1 3.39Å; R3-E74 PolarHBondContact NH2-OE1 3.08Å; R3-E74 IonicContact NH2-OE2 2.64Å; R3-E74 PolarHBondContact NH2-OE2 2.93Å; E70-E74 WeakPolarHBondContact O-CG 3.32Å; E70-E74 PolarHBondContact O-N 2.95Å; E70-E74 VanDerWaalsContact O-N 3.09Å; E71-E74 WeakPolarHBondContact O-CB 3.44Å; E71-E74 PolarHBondContact O-N 3.5Å; R72-E74 PolarHBondContact O-N 3.07Å; E74-E76 VanDerWaalsContact C-N 3.33Å; E74-R77 VanDerWaalsContact CG-NH2 3.26Å; E74-R77 WeakPolarHBondContact O-CB 3.24Å; E74-R77 PolarHBondContact O-N 3.49Å; E74-L78 WeakPolarHBondContact O-CG 3.36Å; E74-L78 PolarHBondContact O-N 3.36Å; E74-R178 IonicContact OE1-CZ 3.98Å; E74-R178 IonicContact OE1-NH2 3.45Å; E74-R178 PolarHBondContact OE1-NH2 3.3Å
75F91.3Very high89.6Confident10 Ų1053.4 Ų53.44%0.04430%0.298CS..Hα-helixtrans-65.8-36.4172.7-78.4-68.5000112.4R3 C6 L58 A61 L62 L67 E71 R72 R77 L78 W79R3-F75 HydrophobicContact CB-CZ 4.03Å; C6-F75 HydrophobicContact CB-CE1 4.21Å; L58-F75 HydrophobicContact CD2-CD1 3.96Å; A61-F75 HydrophobicContact CB-CD1 3.79Å; A61-F75 HydrophobicContact CB-CD2 4.29Å; A61-F75 HydrophobicContact CB-CE1 3.67Å; A61-F75 HydrophobicContact CB-CE2 4.19Å; A61-F75 HydrophobicContact CB-CG 4.11Å; A61-F75 HydrophobicContact CB-CZ 3.88Å; L62-F75 HydrophobicContact CD2-CB 3.55Å; L62-F75 HydrophobicContact CG-CB 3.99Å; L67-F75 HydrophobicContact CD1-CD2 4.22Å; L67-F75 HydrophobicContact CD2-CE2 4.33Å; E71-F75 WeakPolarHBondContact O-CD2 3.4Å; E71-F75 PolarHBondContact O-N 3.41Å; R72-F75 PolarHBondContact O-N 3Å; R72-F75 VanDerWaalsContact O-N 3.08Å; F75-R77 VanDerWaalsContact C-N 3.32Å; F75-R77 PolarHBondContact O-N 2.71Å; F75-L78 HydrophobicContact CD1-CD1 4.33Å; F75-L78 PolarHBondContact O-N 2.92Å; F75-W79 WeakPolarHBondContact O-CB 3.17Å; F75-W79 PolarHBondContact O-N 3.11Å
76E90.8Very high90.3Very high49 Ų4942.2 Ų42.223%0.22926%0.256CS..Hα-helixtrans-62.7-39.9174.3-70.2177.3-179.600111.4L62 R72 E74 W79 V80 V170L62-E76 HydrophobicContact CD2-CG 3.83Å; R72-E76 HydrophobicContact CG-CG 4.29Å; R72-E76 WeakPolarHBondContact CG-OE1 3.46Å; R72-E76 VanDerWaalsContact O-CG 3.3Å; R72-E76 WeakPolarHBondContact O-CG 3.47Å; R72-E76 PolarHBondContact O-N 3.44Å; E74-E76 VanDerWaalsContact C-N 3.33Å; E76-W79 WeakPolarHBondContact O-CB 3.43Å; E76-W79 PolarHBondContact O-N 3.1Å; E76-V80 WeakPolarHBondContact O-CG2 3.2Å; E76-V80 PolarHBondContact O-N 3.44Å; E76-V170 HydrophobicContact CB-CG1 3.83Å; E76-V170 HydrophobicContact CB-CG2 4.44Å; E76-V170 HydrophobicContact CG-CG1 3.97Å; E76-V170 HydrophobicContact CG-CG2 3.7Å
77R90Very high90.9Very high55 Ų5541.4 Ų41.421%0.20824%0.235CC..Hα-helixtrans-61.5-47.1172-82-178.1-75.8-120.4-0.7112.8A73 E74 F75 W79 V80 A81 V175 Q176A73-R77 WeakPolarHBondContact O-CG 2.98Å; A73-R77 PolarHBondContact O-N 2.99Å; A73-R77 VanDerWaalsContact O-N 3.13Å; A73-R77 PolarHBondContact O-NE 3.06Å; E74-R77 VanDerWaalsContact CG-NH2 3.26Å; E74-R77 WeakPolarHBondContact O-CB 3.24Å; E74-R77 PolarHBondContact O-N 3.49Å; F75-R77 VanDerWaalsContact C-N 3.32Å; F75-R77 PolarHBondContact O-N 2.71Å; R77-W79 PolarHBondContact O-N 3.03Å; R77-V80 PolarHBondContact O-N 2.83Å; R77-A81 PolarHBondContact O-N 3.03Å; R77-V175 HydrophobicContact CG-CB 4.39Å; R77-V175 HydrophobicContact CG-CG1 3.54Å; R77-V175 HydrophobicContact CG-CG2 4.06Å; R77-Q176 PolarHBondContact NH1-O 3.05Å
78L92.6Very high91.4Very high24 Ų2444.5 Ų44.513%0.12625%0.252CS..Hα-helixtrans-62.1-37176.4-68.1174.2000111C6 K7 L10 L58 E74 F75 A81 F82C6-L78 HydrophobicContact CB-CD1 4.29Å; K7-L78 HydrophobicContact CB-CD1 4.44Å; K7-L78 HydrophobicContact CB-CD2 4.19Å; K7-L78 HydrophobicContact CG-CD2 4.22Å; L10-L78 HydrophobicContact CD2-CB 4.24Å; L10-L78 HydrophobicContact CD2-CD2 3.75Å; L10-L78 WeakPolarHBondContact CD2-O 3.45Å; L58-L78 HydrophobicContact CD2-CB 3.92Å; L58-L78 HydrophobicContact CD2-CD1 4.45Å; E74-L78 WeakPolarHBondContact O-CG 3.36Å; E74-L78 PolarHBondContact O-N 3.36Å; F75-L78 HydrophobicContact CD1-CD1 4.33Å; F75-L78 PolarHBondContact O-N 2.92Å; L78-A81 PolarHBondContact O-N 3.14Å; L78-F82 WeakPolarHBondContact O-CB 3.12Å; L78-F82 PolarHBondContact O-N 3.1Å
79W92.4Very high91.8Very high11 Ų1142 Ų424%0.04223%0.231CC..Hα-helixtrans-62.7-46.5175.9-176.4-95.9000112.7L58 L62 F75 E76 R77 F82 S83 M164 V168L58-W79 HydrophobicContact CB-CE3 3.67Å; L58-W79 HydrophobicContact CB-CZ3 3.91Å; L58-W79 HydrophobicContact CD1-CE3 4.11Å; L62-W79 HydrophobicContact CD1-CB 3.79Å; L62-W79 HydrophobicContact CD1-CD2 3.89Å; L62-W79 HydrophobicContact CD1-CE3 3.72Å; L62-W79 HydrophobicContact CD1-CG 3.94Å; F75-W79 WeakPolarHBondContact O-CB 3.17Å; F75-W79 PolarHBondContact O-N 3.11Å; E76-W79 WeakPolarHBondContact O-CB 3.43Å; E76-W79 PolarHBondContact O-N 3.1Å; R77-W79 PolarHBondContact O-N 3.03Å; W79-F82 WeakPolarHBondContact O-CB 3.37Å; W79-F82 PolarHBondContact O-N 3.09Å; W79-S83 PolarHBondContact O-N 3.36Å; W79-S83 PolarHBondContact O-OG 3.46Å; W79-M164 HydrophobicContact CE3-CE 4.17Å; W79-M164 HydrophobicContact CH2-CB 3.89Å; W79-M164 HydrophobicContact CH2-CE 3.12Å; W79-M164 HydrophobicContact CH2-CG 4.15Å; W79-M164 HydrophobicContact CZ2-CB 3.8Å; W79-M164 HydrophobicContact CZ2-CE 3.88Å; W79-M164 VanDerWaalsContact CZ2-O 3.29Å; W79-M164 WeakPolarHBondContact CZ2-O 3.4Å; W79-M164 HydrophobicContact CZ3-CE 3.28Å; W79-V168 HydrophobicContact CD2-CB 4.38Å; W79-V168 HydrophobicContact CD2-CG1 4.14Å; W79-V168 HydrophobicContact CE3-CG2 4.45Å; W79-V168 HydrophobicContact CG-CG1 4.46Å; W79-V168 HydrophobicContact CH2-CB 3.91Å; W79-V168 HydrophobicContact CH2-CG2 3.56Å; W79-V168 HydrophobicContact CZ2-CB 3.56Å; W79-V168 HydrophobicContact CZ2-CG1 4.2Å; W79-V168 HydrophobicContact CZ2-CG2 3.79Å; W79-V168 HydrophobicContact CZ3-CB 4.5Å; W79-V168 HydrophobicContact CZ3-CG2 3.94Å
80V91.5Very high92.4Very high31 Ų3138.7 Ų38.719%0.18821%0.205CC..Hα-helixtrans-64.2-44.9177.4173.40000111.1E76 R77 F82 S83 G84 V170 V175E76-V80 WeakPolarHBondContact O-CG2 3.2Å; E76-V80 PolarHBondContact O-N 3.44Å; R77-V80 PolarHBondContact O-N 2.83Å; V80-F82 VanDerWaalsContact C-N 3.3Å; V80-F82 PolarHBondContact O-N 3.21Å; V80-S83 WeakPolarHBondContact CA-OG 3.21Å; V80-S83 PolarHBondContact O-N 2.88Å; V80-S83 PolarHBondContact O-OG 3.2Å; V80-G84 PolarHBondContact O-N 3.32Å; V80-V170 HydrophobicContact CG2-CG1 4.23Å; V80-V175 HydrophobicContact CB-CG2 3.86Å; V80-V175 HydrophobicContact CG1-CG2 4.38Å; V80-V175 HydrophobicContact CG2-CG2 3.44Å; V80-V175 VanDerWaalsContact CG2-CG2 3.44Å
81A92.6Very high92.9Very high49 Ų4934.5 Ų34.541%0.40519%0.194SC..Hα-helixtrans-61.6-39.7175.700000112.2L10 R77 L78 G84 C85L10-A81 HydrophobicContact CD2-CB 3.84Å; R77-A81 PolarHBondContact O-N 3.03Å; L78-A81 PolarHBondContact O-N 3.14Å; A81-G84 PolarHBondContact O-N 2.88Å; A81-C85 PolarHBondContact O-N 2.92Å; A81-C85 VanDerWaalsContact O-N 3.09Å; A81-C85 PolarHBondContact O-SG 3.38Å
82F94.4Very high93.4Very high1 Ų130.2 Ų30.20%0.00417%0.174CC..Hα-helixtrans-60.9-47.6173169.7-87.2000112.2L10 L13 A51 T54 L58 L78 W79 V80 G84 C85 L86 M164L10-F82 HydrophobicContact CD1-CB 3.77Å; L10-F82 HydrophobicContact CD1-CD2 4.22Å; L13-F82 HydrophobicContact CD2-CD2 3.67Å; L13-F82 HydrophobicContact CD2-CE2 3.66Å; A51-F82 HydrophobicContact CB-CE2 4.47Å; A51-F82 WeakPolarHBondContact O-CE2 3.21Å; T54-F82 HydrophobicContact CG2-CD2 3.54Å; T54-F82 HydrophobicContact CG2-CE2 4Å; T54-F82 HydrophobicContact CG2-CG 4.41Å; L58-F82 HydrophobicContact CD1-CB 3.77Å; L58-F82 HydrophobicContact CD1-CD1 4.46Å; L58-F82 HydrophobicContact CD1-CD2 4.29Å; L58-F82 HydrophobicContact CD1-CG 3.88Å; L78-F82 WeakPolarHBondContact O-CB 3.12Å; L78-F82 PolarHBondContact O-N 3.1Å; W79-F82 WeakPolarHBondContact O-CB 3.37Å; W79-F82 PolarHBondContact O-N 3.09Å; V80-F82 VanDerWaalsContact C-N 3.3Å; V80-F82 PolarHBondContact O-N 3.21Å; F82-G84 VanDerWaalsContact C-N 3.29Å; F82-G84 PolarHBondContact O-N 3.45Å; F82-C85 WeakPolarHBondContact O-CB 3.43Å; F82-C85 PolarHBondContact O-N 3.08Å; F82-L86 HydrophobicContact CD1-CD1 4.38Å; F82-L86 HydrophobicContact CD1-CG 4.42Å; F82-L86 HydrophobicContact CE1-CD1 3.32Å; F82-L86 HydrophobicContact CE1-CD2 4.23Å; F82-L86 HydrophobicContact CE1-CG 3.63Å; F82-L86 HydrophobicContact CE2-CD2 4.13Å; F82-L86 HydrophobicContact CE2-CG 4.33Å; F82-L86 HydrophobicContact CZ-CD1 3.52Å; F82-L86 HydrophobicContact CZ-CD2 3.7Å; F82-L86 HydrophobicContact CZ-CG 3.64Å; F82-L86 PolarHBondContact O-N 2.62Å; F82-L86 VanDerWaalsContact O-N 3.1Å; F82-M164 HydrophobicContact CD1-CE 3.62Å; F82-M164 HydrophobicContact CD1-SD 4.4Å; F82-M164 HydrophobicContact CE1-CE 2.95Å; F82-M164 HydrophobicContact CE1-SD 3.26Å; F82-M164 WeakPolarHBondContact CE1-SD 3.42Å; F82-M164 HydrophobicContact CZ-CE 3.5Å; F82-M164 HydrophobicContact CZ-SD 3.53Å; F82-M164 VanDerWaalsContact CZ-SD 3.53Å
83S93.2Very high93.8Very high12 Ų1227 Ų278%0.08416%0.161CC..Hα-helixtrans-59.4-41.2178.5650000111.8W79 V80 C85 L86 D87W79-S83 PolarHBondContact O-N 3.36Å; W79-S83 PolarHBondContact O-OG 3.46Å; V80-S83 WeakPolarHBondContact CA-OG 3.21Å; V80-S83 PolarHBondContact O-N 2.88Å; V80-S83 PolarHBondContact O-OG 3.2Å; S83-C85 VanDerWaalsContact C-N 3.33Å; S83-C85 PolarHBondContact O-N 3.18Å; S83-L86 WeakPolarHBondContact O-CB 3.46Å; S83-L86 PolarHBondContact O-N 3.25Å; S83-L86 VanDerWaalsContact O-N 3.14Å; S83-D87 VanDerWaalsContact O-CG 3.29Å; S83-D87 PolarHBondContact O-N 3.27Å; S83-D87 VanDerWaalsContact O-N 3.08Å
84G92.8Very high94.3Very high26 Ų2631.2 Ų31.227%0.26817%0.171SC..Hα-helixtrans-63.8-34.7174.100000113.5V80 A81 F82 L86 D87 L88V80-G84 PolarHBondContact O-N 3.32Å; A81-G84 PolarHBondContact O-N 2.88Å; F82-G84 VanDerWaalsContact C-N 3.29Å; F82-G84 PolarHBondContact O-N 3.45Å; G84-L86 VanDerWaalsContact C-N 3.33Å; G84-D87 PolarHBondContact O-N 3.42Å; G84-L88 WeakPolarHBondContact O-CG 3.37Å; G84-L88 PolarHBondContact O-N 2.96Å; G84-L88 VanDerWaalsContact O-N 3.11Å
85C95.5Very high94.7Very high9 Ų936.1 Ų36.16%0.06119%0.188CC..Hα-helixtrans-65-37.7173.6-64.70000111.7L13 A81 F82 S83 L89L13-C85 HydrophobicContact CD2-CB 4.07Å; L13-C85 HydrophobicContact CG-CB 4.23Å; A81-C85 PolarHBondContact O-N 2.92Å; A81-C85 VanDerWaalsContact O-N 3.09Å; A81-C85 PolarHBondContact O-SG 3.38Å; F82-C85 WeakPolarHBondContact O-CB 3.43Å; F82-C85 PolarHBondContact O-N 3.08Å; S83-C85 VanDerWaalsContact C-N 3.33Å; S83-C85 PolarHBondContact O-N 3.18Å; C85-L89 WeakPolarHBondContact O-CB 3.47Å; C85-L89 PolarHBondContact O-N 2.61Å
86L95.8Very high94.9Very high2 Ų235.8 Ų35.81%0.0119%0.187CC..Hα-helixtrans-65.9-45.1176.3-64.7-168.6000112.2A51 F82 S83 G84 L88 L89 E90 M160 I161 M164A51-L86 HydrophobicContact CB-CD2 3.61Å; F82-L86 HydrophobicContact CD1-CD1 4.38Å; F82-L86 HydrophobicContact CD1-CG 4.42Å; F82-L86 HydrophobicContact CE1-CD1 3.32Å; F82-L86 HydrophobicContact CE1-CD2 4.23Å; F82-L86 HydrophobicContact CE1-CG 3.63Å; F82-L86 HydrophobicContact CE2-CD2 4.13Å; F82-L86 HydrophobicContact CE2-CG 4.33Å; F82-L86 HydrophobicContact CZ-CD1 3.52Å; F82-L86 HydrophobicContact CZ-CD2 3.7Å; F82-L86 HydrophobicContact CZ-CG 3.64Å; F82-L86 PolarHBondContact O-N 2.62Å; F82-L86 VanDerWaalsContact O-N 3.1Å; S83-L86 WeakPolarHBondContact O-CB 3.46Å; S83-L86 PolarHBondContact O-N 3.25Å; S83-L86 VanDerWaalsContact O-N 3.14Å; G84-L86 VanDerWaalsContact C-N 3.33Å; L86-L88 VanDerWaalsContact C-N 3.29Å; L86-L88 PolarHBondContact O-N 3.11Å; L86-L89 PolarHBondContact O-N 2.98Å; L86-E90 WeakPolarHBondContact O-CB 3.46Å; L86-E90 PolarHBondContact O-N 3.3Å; L86-M160 HydrophobicContact CD1-CE 3.9Å; L86-M160 HydrophobicContact CD1-CG 4.38Å; L86-M160 HydrophobicContact CD2-CE 3.51Å; L86-M160 HydrophobicContact CG-CE 4.31Å; L86-I161 HydrophobicContact CB-CD1 4.06Å; L86-I161 HydrophobicContact CB-CG1 3.71Å; L86-I161 HydrophobicContact CD1-CG1 3.9Å; L86-I161 HydrophobicContact CG-CG1 4.49Å; L86-M164 HydrophobicContact CD1-SD 3.86Å
87D95.4Very high95.1Very high52 Ų5235.3 Ų35.328%0.27819%0.186SC..Hα-helixtrans-61.1-41.9179.2-53.2-41.8000111S83 G84 E90 A91 R172S83-D87 VanDerWaalsContact O-CG 3.29Å; S83-D87 PolarHBondContact O-N 3.27Å; S83-D87 VanDerWaalsContact O-N 3.08Å; G84-D87 PolarHBondContact O-N 3.42Å; D87-E90 PolarHBondContact O-N 3.09Å; D87-A91 VanDerWaalsContact O-CB 3.29Å; D87-A91 WeakPolarHBondContact O-CB 3.33Å; D87-A91 PolarHBondContact O-N 2.95Å; D87-R172 IonicContact OD1-CZ 3.45Å; D87-R172 IonicContact OD1-NH1 3.18Å; D87-R172 IonicContact OD1-NH2 2.87Å; D87-R172 PolarHBondContact OD1-NH2 3.01Å; D87-R172 VanDerWaalsContact OD1-NH2 3.11Å; D87-R172 IonicContact OD2-CZ 2.92Å; D87-R172 IonicContact OD2-NH1 3.68Å; D87-R172 PolarHBondContact OD2-NH1 3.32Å; D87-R172 IonicContact OD2-NH2 3.64Å; D87-R172 PolarHBondContact OD2-NH2 3.25Å
88L96.4Very high95.4Very high100 Ų10035.7 Ų35.752%0.52420%0.201SC..Hα-helixtrans-64.5-45.9176.7-73173.4000111.6T17 G84 L86 E90 A91 D92T17-L88 HydrophobicContact CG2-CB 4.08Å; G84-L88 WeakPolarHBondContact O-CG 3.37Å; G84-L88 PolarHBondContact O-N 2.96Å; G84-L88 VanDerWaalsContact O-N 3.11Å; L86-L88 VanDerWaalsContact C-N 3.29Å; L86-L88 PolarHBondContact O-N 3.11Å; L88-E90 VanDerWaalsContact C-N 3.35Å; L88-E90 PolarHBondContact O-N 3.46Å; L88-A91 PolarHBondContact O-N 3.36Å; L88-D92 WeakPolarHBondContact O-CB 3.25Å; L88-D92 PolarHBondContact O-N 3.34Å
89L97.3Very high95.4Very high0 Ų036.6 Ų36.60%021%0.206CC..Hα-helixtrans-58.9-47.5177177.862.4000111T17 Y20 A47 C85 L86 D92 M93T17-L89 HydrophobicContact CG2-CB 4.04Å; Y20-L89 HydrophobicContact CD1-CD1 4Å; Y20-L89 HydrophobicContact CE1-CD1 4.39Å; A47-L89 HydrophobicContact CB-CD1 3.81Å; A47-L89 HydrophobicContact CB-CD2 3.84Å; C85-L89 WeakPolarHBondContact O-CB 3.47Å; C85-L89 PolarHBondContact O-N 2.61Å; L86-L89 PolarHBondContact O-N 2.98Å; L89-D92 PolarHBondContact O-N 2.85Å; L89-M93 HydrophobicContact CD1-CG 4.19Å; L89-M93 HydrophobicContact CD1-SD 4.08Å; L89-M93 HydrophobicContact CG-CG 4.44Å; L89-M93 HydrophobicContact CG-SD 3.89Å; L89-M93 WeakPolarHBondContact O-CB 3.34Å; L89-M93 WeakPolarHBondContact O-CG 3.22Å; L89-M93 PolarHBondContact O-N 2.98Å
90E97.8Very high95.3Very high25 Ų2536.1 Ų36.112%0.11720%0.204CC..Hα-helixtrans-62.8-43.7179.6-162.7-161.3-162.900111.7L86 D87 L88 M93 R94 V157 G158 I161L86-E90 WeakPolarHBondContact O-CB 3.46Å; L86-E90 PolarHBondContact O-N 3.3Å; D87-E90 PolarHBondContact O-N 3.09Å; L88-E90 VanDerWaalsContact C-N 3.35Å; L88-E90 PolarHBondContact O-N 3.46Å; E90-M93 PolarHBondContact O-N 3.5Å; E90-R94 VanDerWaalsContact CD-CZ 3.41Å; E90-R94 VanDerWaalsContact CD-NH2 3.3Å; E90-R94 VanDerWaalsContact CG-NH1 3.33Å; E90-R94 WeakPolarHBondContact O-CG 3.22Å; E90-R94 PolarHBondContact O-N 3.34Å; E90-R94 IonicContact OE1-CZ 3.11Å; E90-R94 IonicContact OE1-NH1 3.06Å; E90-R94 PolarHBondContact OE1-NH1 3.4Å; E90-R94 VanDerWaalsContact OE1-NH1 3.11Å; E90-R94 IonicContact OE1-NH2 3.81Å; E90-R94 PolarHBondContact OE1-NH2 2.84Å; E90-R94 IonicContact OE2-CZ 2.72Å; E90-R94 IonicContact OE2-NH1 3.24Å; E90-R94 PolarHBondContact OE2-NH1 2.92Å; E90-R94 IonicContact OE2-NH2 3.77Å; E90-V157 HydrophobicContact CB-CG1 3.83Å; E90-V157 HydrophobicContact CG-CB 4.44Å; E90-V157 HydrophobicContact CG-CG1 4.05Å; E90-G158 WeakPolarHBondContact OE1-CA 3.44Å; E90-I161 HydrophobicContact CB-CD1 4.09Å; E90-I161 HydrophobicContact CG-CD1 4.34Å
91A97.9Very high95.2Very high47 Ų4737.9 Ų37.939%0.38822%0.222SC..Hα-helixtrans-61.8-43.4176.400000112D87 L88 R94 R95D87-A91 VanDerWaalsContact O-CB 3.29Å; D87-A91 WeakPolarHBondContact O-CB 3.33Å; D87-A91 PolarHBondContact O-N 2.95Å; L88-A91 PolarHBondContact O-N 3.36Å; A91-R94 PolarHBondContact O-N 2.95Å; A91-R95 WeakPolarHBondContact O-CB 3.42Å; A91-R95 PolarHBondContact O-N 3.43Å
92D98.1Very high95Very high8 Ų838.4 Ų38.44%0.04323%0.226CC..Hα-helixtrans-70.1-35.1177.4-75-28.5000112.1Y20 H21 L88 L89 R95 S96Y20-D92 HydrophobicContact CD1-CB 3.77Å; Y20-D92 HydrophobicContact CE1-CB 3.77Å; H21-D92 WeakPolarHBondContact CB-OD2 3.48Å; H21-D92 IonicContact CE1-OD1 2.96Å; H21-D92 IonicContact CG-OD2 3.75Å; H21-D92 VanDerWaalsContact ND1-CG 3.26Å; H21-D92 IonicContact ND1-OD1 2.75Å; H21-D92 PolarHBondContact ND1-OD1 2.87Å; H21-D92 IonicContact ND1-OD2 3.56Å; H21-D92 PolarHBondContact ND1-OD2 3.47Å; L88-D92 WeakPolarHBondContact O-CB 3.25Å; L88-D92 PolarHBondContact O-N 3.34Å; L89-D92 PolarHBondContact O-N 2.85Å; D92-R95 WeakPolarHBondContact O-CB 3.42Å; D92-R95 PolarHBondContact O-N 2.98Å; D92-R95 IonicContact OD1-NE 3.04Å; D92-S96 WeakPolarHBondContact O-CB 3.44Å; D92-S96 PolarHBondContact O-N 3.49Å
93M97.8Very high94.6Very high0 Ų042.1 Ų42.10%024%0.242CC..Hα-helixtrans-66-42.8174.9-72.9173.769.100111.3Y20 L89 E90 R95 S96 L97 L150 E153 V154 V157Y20-M93 HydrophobicContact CE1-CB 4.42Å; Y20-M93 HydrophobicContact CE1-CG 3.69Å; L89-M93 HydrophobicContact CD1-CG 4.19Å; L89-M93 HydrophobicContact CD1-SD 4.08Å; L89-M93 HydrophobicContact CG-CG 4.44Å; L89-M93 HydrophobicContact CG-SD 3.89Å; L89-M93 WeakPolarHBondContact O-CB 3.34Å; L89-M93 WeakPolarHBondContact O-CG 3.22Å; L89-M93 PolarHBondContact O-N 2.98Å; E90-M93 PolarHBondContact O-N 3.5Å; M93-R95 VanDerWaalsContact C-N 3.32Å; M93-R95 PolarHBondContact O-N 3.47Å; M93-S96 WeakPolarHBondContact O-CB 3.46Å; M93-S96 PolarHBondContact O-N 2.93Å; M93-L97 WeakPolarHBondContact O-CB 3.36Å; M93-L97 PolarHBondContact O-N 2.97Å; M93-L150 HydrophobicContact CB-CD1 4.17Å; M93-L150 HydrophobicContact CE-CD1 3.92Å; M93-L150 HydrophobicContact CG-CD1 4.37Å; M93-E153 HydrophobicContact CE-CB 3.52Å; M93-V154 HydrophobicContact CB-CG2 3.62Å; M93-V154 HydrophobicContact CE-CG2 4.19Å; M93-V157 HydrophobicContact CE-CG2 4.29Å; M93-V157 HydrophobicContact SD-CG2 3.96Å
94R97.9Very high94.2Very high119 Ų11943.6 Ų43.645%0.44925%0.252SS..Hα-helixtrans-60.6-41.8172.2-75.9-171.7-177.8106.63.1112.1E90 A91 L97 A98 V154E90-R94 VanDerWaalsContact CD-CZ 3.41Å; E90-R94 VanDerWaalsContact CD-NH2 3.3Å; E90-R94 VanDerWaalsContact CG-NH1 3.33Å; E90-R94 WeakPolarHBondContact O-CG 3.22Å; E90-R94 PolarHBondContact O-N 3.34Å; E90-R94 IonicContact OE1-CZ 3.11Å; E90-R94 IonicContact OE1-NH1 3.06Å; E90-R94 PolarHBondContact OE1-NH1 3.4Å; E90-R94 VanDerWaalsContact OE1-NH1 3.11Å; E90-R94 IonicContact OE1-NH2 3.81Å; E90-R94 PolarHBondContact OE1-NH2 2.84Å; E90-R94 IonicContact OE2-CZ 2.72Å; E90-R94 IonicContact OE2-NH1 3.24Å; E90-R94 PolarHBondContact OE2-NH1 2.92Å; E90-R94 IonicContact OE2-NH2 3.77Å; A91-R94 PolarHBondContact O-N 2.95Å; R94-L97 PolarHBondContact O-N 3.26Å; R94-A98 PolarHBondContact O-N 3.28Å; R94-V154 HydrophobicContact CG-CG1 3.55Å; R94-V154 HydrophobicContact CG-CG2 4.29Å
95R97.2Very high93.5Very high128 Ų12843.9 Ų43.948%0.48325%0.247SC..Hα-helixtrans-62.3-46.1175.4-175.3-172.5-58.8-81.5-2110.9V24 A91 D92 M93 L97 A98 L99V24-R95 HydrophobicContact CG1-CB 4.11Å; V24-R95 HydrophobicContact CG1-CG 3.82Å; A91-R95 WeakPolarHBondContact O-CB 3.42Å; A91-R95 PolarHBondContact O-N 3.43Å; D92-R95 WeakPolarHBondContact O-CB 3.42Å; D92-R95 PolarHBondContact O-N 2.98Å; D92-R95 IonicContact OD1-NE 3.04Å; M93-R95 VanDerWaalsContact C-N 3.32Å; M93-R95 PolarHBondContact O-N 3.47Å; R95-L97 VanDerWaalsContact C-N 3.31Å; R95-L97 PolarHBondContact O-N 2.78Å; R95-A98 PolarHBondContact O-N 3.24Å; R95-L99 HydrophobicContact CG-CD1 3.9Å; R95-L99 HydrophobicContact CG-CG 4.41Å; R95-L99 WeakPolarHBondContact O-CB 3.39Å; R95-L99 VanDerWaalsContact O-CG 3.28Å; R95-L99 WeakPolarHBondContact O-CG 3.25Å; R95-L99 PolarHBondContact O-N 3.08Å
96S95.9Very high92.5Very high4 Ų446.2 Ų46.23%0.02826%0.257CS..Hα-helixtrans-59.1-42.3176.7-172.30000111.7Y20 D92 M93 L99 G100Y20-S96 VanDerWaalsContact OH-CB 3.25Å; Y20-S96 WeakPolarHBondContact OH-CB 3.44Å; Y20-S96 PolarHBondContact OH-OG 3.03Å; D92-S96 WeakPolarHBondContact O-CB 3.44Å; D92-S96 PolarHBondContact O-N 3.49Å; M93-S96 WeakPolarHBondContact O-CB 3.46Å; M93-S96 PolarHBondContact O-N 2.93Å; S96-L99 PolarHBondContact O-N 3.12Å; S96-G100 PolarHBondContact O-N 2.92Å
97L95.5Very high91.1Very high38 Ų3848.2 Ų48.220%0.19927%0.274CS..Hα-helixtrans-62.4-48.9177.2-17867.1000111.4M93 R94 R95 L99 G100 A101 L147 L150 E151M93-L97 WeakPolarHBondContact O-CB 3.36Å; M93-L97 PolarHBondContact O-N 2.97Å; R94-L97 PolarHBondContact O-N 3.26Å; R95-L97 VanDerWaalsContact C-N 3.31Å; R95-L97 PolarHBondContact O-N 2.78Å; L97-L99 VanDerWaalsContact C-N 3.34Å; L97-L99 PolarHBondContact O-N 2.65Å; L97-G100 PolarHBondContact O-N 2.87Å; L97-A101 WeakPolarHBondContact O-CB 3.41Å; L97-A101 PolarHBondContact O-N 2.9Å; L97-L147 HydrophobicContact CD1-CB 4.42Å; L97-L147 HydrophobicContact CD1-CD2 3.92Å; L97-L147 WeakPolarHBondContact CD1-O 3.49Å; L97-L150 HydrophobicContact CB-CD2 3.81Å; L97-L150 HydrophobicContact CB-CG 4.17Å; L97-L150 HydrophobicContact CD1-CB 4.33Å; L97-L150 HydrophobicContact CD1-CD2 4.09Å; L97-L150 HydrophobicContact CD1-CG 4.17Å; L97-E151 HydrophobicContact CD1-CB 4.19Å; L97-E151 HydrophobicContact CD2-CB 3.98Å; L97-E151 HydrophobicContact CD2-CG 4.15Å
98A94.6Very high89.2Confident63 Ų6352 Ų5252%0.52130%0.301SS..Hα-helixtrans-61.5-42.5178.200000112R94 R95 A102R94-A98 PolarHBondContact O-N 3.28Å; R95-A98 PolarHBondContact O-N 3.24Å; A98-A102 WeakPolarHBondContact O-CB 3.45Å; A98-A102 PolarHBondContact O-N 3.41Å
99L93.1Very high87.4Confident44 Ų4455 Ų5523%0.2331%0.305CS..Hα-helixtrans-69.4-40.9178.3-70.3173.2000112V24 V27 R95 S96 L97 A101 A102 F103V24-L99 HydrophobicContact CG1-CD1 4.12Å; V27-L99 HydrophobicContact CB-CB 4.2Å; V27-L99 HydrophobicContact CB-CD1 4.08Å; V27-L99 HydrophobicContact CG1-CB 3.58Å; V27-L99 HydrophobicContact CG1-CD1 4.37Å; R95-L99 HydrophobicContact CG-CD1 3.9Å; R95-L99 HydrophobicContact CG-CG 4.41Å; R95-L99 WeakPolarHBondContact O-CB 3.39Å; R95-L99 VanDerWaalsContact O-CG 3.28Å; R95-L99 WeakPolarHBondContact O-CG 3.25Å; R95-L99 PolarHBondContact O-N 3.08Å; S96-L99 PolarHBondContact O-N 3.12Å; L97-L99 VanDerWaalsContact C-N 3.34Å; L97-L99 PolarHBondContact O-N 2.65Å; L99-A101 PolarHBondContact O-N 2.9Å; L99-A102 PolarHBondContact O-N 3.28Å; L99-F103 HydrophobicContact CD2-CD2 4.24Å; L99-F103 HydrophobicContact CD2-CE2 3.97Å; L99-F103 WeakPolarHBondContact O-CB 3.47Å; L99-F103 WeakPolarHBondContact O-CD2 3.43Å; L99-F103 PolarHBondContact O-N 3.48Å
100G90.5Very high85.3Confident0 Ų064.4 Ų64.40%034%0.341CS..Hα-helixtrans-62.8-40.5175.400000112.9R37 S96 L97 F103R37-G100 VanDerWaalsContact NH1-CA 3.33Å; S96-G100 PolarHBondContact O-N 2.92Å; L97-G100 PolarHBondContact O-N 2.87Å; G100-F103 CarbonylContact O-C 3.47Å
101A89.3Confident83.3Confident69 Ų6967.6 Ų67.657%0.5736%0.364SS*.Hα-helixtrans-66.9-35.8174.100000113L97 L99L97-A101 WeakPolarHBondContact O-CB 3.41Å; L97-A101 PolarHBondContact O-N 2.9Å; L99-A101 PolarHBondContact O-N 2.9Å
102A88.8Confident81.3Confident59 Ų5971.8 Ų71.849%0.48838%0.379SS..Hα-helixtrans-76.9-30.5179.400000113.4A98 L99 P104A98-A102 WeakPolarHBondContact O-CB 3.45Å; A98-A102 PolarHBondContact O-N 3.41Å; L99-A102 PolarHBondContact O-N 3.28Å; A102-P104 VanDerWaalsContact C-CD 3.5Å; A102-P104 WeakPolarHBondContact O-CD 3.36Å
103F86.6Confident79.2Confident79 Ų7976.8 Ų76.835%0.34641%0.409SS..SBendtrans-126.473-175.5-58.4-78.1000111.4R37 L99 G100R37-F103 PolarHBondContact NH2-O 2.9Å; L99-F103 HydrophobicContact CD2-CD2 4.24Å; L99-F103 HydrophobicContact CD2-CE2 3.97Å; L99-F103 WeakPolarHBondContact O-CB 3.47Å; L99-F103 WeakPolarHBondContact O-CD2 3.43Å; L99-F103 PolarHBondContact O-N 3.48Å; G100-F103 CarbonylContact O-C 3.47Å
104P84.9Confident77Confident43 Ų4386.4 Ų86.428%0.27945%0.446SS..  trans-69.6141.5174.828.6-34.3000111.4A102 A107 R109 D143A102-P104 VanDerWaalsContact C-CD 3.5Å; A102-P104 WeakPolarHBondContact O-CD 3.36Å; P104-A107 HydrophobicContact CB-CB 3.72Å; P104-A107 HydrophobicContact CG-CB 3.8Å; P104-R109 PolarHBondContact O-NH2 3.48Å; P104-D143 WeakPolarHBondContact CA-OD2 3.32Å
105L78.3Confident75.5Confident33 Ų3385.6 Ų85.617%0.17345%0.454CS..SBendtrans-82-44.9177.6-69.1-178.5000111.6Q34 R37 D143Q34-L105 HydrophobicContact CB-CD1 4.36Å; R37-L105 HydrophobicContact CG-CD1 3.54Å; L105-D143 PolarHBondContact N-OD2 2.93Å
106H72.7Confident73.6Confident57 Ų5783.2 Ų83.226%0.26447%0.47SS..SBendtrans-107.8-6.4-169.4-53.983.3000114.9Q34Q34-H106 PolarHBondContact OE1-CE1 3.3Å; Q34-H106 PolarHBondContact OE1-NE2 3.41Å
107A66.1Low71.5Confident44 Ų4488.6 Ų88.636%0.36450%0.502SS..SBendtrans-68.7143.3175.300000111.8P104 R109P104-A107 HydrophobicContact CB-CB 3.72Å; P104-A107 HydrophobicContact CG-CB 3.8Å; A107-R109 PolarHBondContact O-N 2.82Å
108P57.1Low69.6Low132 Ų13291.9 Ų91.986%0.85754%0.535SS*.  trans-62.3103.7-17824.4-32.5000110.3R110P108-R110 PolarHBondContact O-N 2.83Å
109R57.3Low67.5Low162 Ų16290.7 Ų90.761%0.61153%0.529SS*.  trans-64.1109.5-177.9-71.8-176.6167157.2-1109.8P104 A107P104-R109 PolarHBondContact O-NH2 3.48Å; A107-R109 PolarHBondContact O-N 2.82Å
110R55.1Low65.7Low198 Ų19892.7 Ų92.775%0.74756%0.559SS**  trans-59.1129.3142.2-69.5-175.2179.9-135.7-2.4105.3P108 L112P108-R110 PolarHBondContact O-N 2.83Å; R110-L112 PolarHBondContact O-N 3.2Å
111P55.3Low64Low93 Ų9396.1 Ų96.160%0.60458%0.583SS**  trans-55.4115.4-17917.3-28000109.3V113P111-V113 PolarHBondContact O-N 3.47Å
112L55.1Low62.4Low135 Ų13597.4 Ų97.471%0.70759%0.588SS**SBendtrans-61.9-26.4-178.8-71169000111.1R110R110-L112 PolarHBondContact O-N 3.2Å
113V55.3Low60.8Low112 Ų11297.6 Ų97.668%0.67959%0.59SS**  trans-98.494.3172.4-165.60000109.4P111 T115P111-V113 PolarHBondContact O-N 3.47Å; V113-T115 HydrophobicContact CG1-CG2 3.37Å; V113-T115 PolarHBondContact O-N 3.22Å
114R49.8Very low59.5Low203 Ų20398.6 Ų98.677%0.76660%0.602SS**  trans-86.283.7161.4-76.1-177.7169.6-173.2-5.4108.3G116R114-G116 PolarHBondContact O-N 2.88Å
115T66.8Low58.3Low102 Ų10298.6 Ų98.663%0.62661%0.606SS**  trans-65-3177.856.10000113.9V113 V117V113-T115 HydrophobicContact CG1-CG2 3.37Å; V113-T115 PolarHBondContact O-N 3.22Å; T115-V117 PolarHBondContact O-N 3.22Å
116G56.8Low57.3Low78 Ų7899.3 Ų99.380%0.80462%0.617SS**SBendtrans67.7-4.4-178.400000114.5R114 A118R114-G116 PolarHBondContact O-N 2.88Å; G116-A118 PolarHBondContact O-N 3.42Å
117V53.5Low56.3Low116 Ų116105.4 Ų105.470%0.70364%0.637SS**  trans-95.492.7179.6-177.10000109.1T115 G119T115-V117 PolarHBondContact O-N 3.22Å; V117-G119 PolarHBondContact O-N 2.97Å
118A55.3Low55.9Low108 Ų108106.8 Ų106.889%0.89365%0.649SS**  trans-77.568.3161.300000109G116G116-A118 PolarHBondContact O-N 3.42Å
119G50.4Low55.7Low38 Ų38106.8 Ų106.839%0.39264%0.641SS.*  trans-76.7145.2170.200000109.9V117 S121V117-G119 PolarHBondContact O-N 2.97Å; G119-S121 PolarHBondContact O-N 3.47Å; G119-S121 PolarHBondContact O-OG 3.29Å
120G54.8Low55.4Low85 Ų85103.9 Ų103.988%0.87665%0.645SS**SBendtrans-64.232.217800000115.8S122G120-S122 VanDerWaalsContact C-N 3.27Å; G120-S122 PolarHBondContact O-N 3.45Å
121S55.1Low55.1Low72 Ų7298.3 Ų98.350%0.50364%0.641SS.*THydrogen-bonded Turntrans-81.92.717859.80000113.7G119 A123 V124 A125G119-S121 PolarHBondContact O-N 3.47Å; G119-S121 PolarHBondContact O-OG 3.29Å; S121-A123 PolarHBondContact O-N 2.98Å; S121-A123 VanDerWaalsContact O-N 3.12Å; S121-V124 PolarHBondContact O-N 3.47Å; S121-A125 WeakPolarHBondContact O-CB 3.49Å; S121-A125 PolarHBondContact O-N 3.44Å
122S56.3Low54.4Low96 Ų96103.3 Ų103.367%0.67165%0.648SS**Hα-helixtrans-49.3-39177.4173.20000112.6G120 A126G120-S122 VanDerWaalsContact C-N 3.27Å; G120-S122 PolarHBondContact O-N 3.45Å; S122-A126 WeakPolarHBondContact O-CB 3.49Å; S122-A126 PolarHBondContact O-N 2.9Å
123A55.2Low54Low63 Ų63101.3 Ų101.352%0.52165%0.646SS.*Hα-helixtrans-73-31.2177.800000114S121 R127S121-A123 PolarHBondContact O-N 2.98Å; S121-A123 VanDerWaalsContact O-N 3.12Å; A123-R127 WeakPolarHBondContact O-CB 3.35Å; A123-R127 PolarHBondContact O-N 3.18Å
124V58.6Low53.4Low101 Ų101102.4 Ų102.461%0.61265%0.647SS**Hα-helixtrans-79.5-41.3178.4-177.70000110.2S121 R127 A128S121-V124 PolarHBondContact O-N 3.47Å; V124-R127 PolarHBondContact O-N 3.18Å; V124-A128 PolarHBondContact O-N 3.01Å
125A59.2Low53.1Low43 Ų43103 Ų10336%0.35565%0.649SS.*Hα-helixtrans-61.9-45.2171.200000111.2S121 R127 A128 L129S121-A125 WeakPolarHBondContact O-CB 3.49Å; S121-A125 PolarHBondContact O-N 3.44Å; A125-R127 VanDerWaalsContact C-N 3.3Å; A125-R127 PolarHBondContact O-N 3.31Å; A125-A128 PolarHBondContact O-N 2.98Å; A125-L129 VanDerWaalsContact O-CB 3.27Å; A125-L129 WeakPolarHBondContact O-CB 3.41Å; A125-L129 WeakPolarHBondContact O-CD1 3.41Å; A125-L129 WeakPolarHBondContact O-CG 3.28Å; A125-L129 PolarHBondContact O-N 2.81Å
126A56.5Low52Low48 Ų48105.2 Ų105.240%0.39765%0.652SS.*Hα-helixtrans-58.7-40.6175.600000112S122 L129 S130S122-A126 WeakPolarHBondContact O-CB 3.49Å; S122-A126 PolarHBondContact O-N 2.9Å; A126-L129 PolarHBondContact O-N 2.85Å; A126-S130 WeakPolarHBondContact O-CB 3.39Å; A126-S130 PolarHBondContact O-N 3.04Å; A126-S130 PolarHBondContact O-OG 3.19Å
127R53.3Low51.3Low185 Ų185109.7 Ų109.770%0.69865%0.652SS**Hα-helixtrans-72.6-32.1179.7-154.3178.9-74.5128.4-6.5113A123 V124 A125A123-R127 WeakPolarHBondContact O-CB 3.35Å; A123-R127 PolarHBondContact O-N 3.18Å; V124-R127 PolarHBondContact O-N 3.18Å; A125-R127 VanDerWaalsContact C-N 3.3Å; A125-R127 PolarHBondContact O-N 3.31Å
128A56.1Low51.1Low73 Ų73107.4 Ų107.460%0.60365%0.646SS**Hα-helixtrans-72.8-36.9171.300000112.4V124 A125 A131V124-A128 PolarHBondContact O-N 3.01Å; A125-A128 PolarHBondContact O-N 2.98Å; A128-A131 PolarHBondContact O-N 3.46Å
129L53.8Low50.7Low132 Ų132109.9 Ų109.969%0.69164%0.639SS**Hα-helixtrans-74-28.6176.8-68.1168.6000112.6A125 A126 A131A125-L129 VanDerWaalsContact O-CB 3.27Å; A125-L129 WeakPolarHBondContact O-CB 3.41Å; A125-L129 WeakPolarHBondContact O-CD1 3.41Å; A125-L129 WeakPolarHBondContact O-CG 3.28Å; A125-L129 PolarHBondContact O-N 2.81Å; A126-L129 PolarHBondContact O-N 2.85Å; L129-A131 PolarHBondContact O-N 3.47Å
130S50.2Low51.1Low101 Ų101110.4 Ų110.471%0.70664%0.644SS**THydrogen-bonded Turntrans-68.3-16.6172.6-68.20000113.7A126A126-S130 WeakPolarHBondContact O-CB 3.39Å; A126-S130 PolarHBondContact O-N 3.04Å; A126-S130 PolarHBondContact O-OG 3.19Å
131A49.5Very low51.7Low80 Ų80110.4 Ų110.466%0.66162%0.624SS**THydrogen-bonded Turntrans-82-11-177.700000113.9A128 L129A128-A131 PolarHBondContact O-N 3.46Å; L129-A131 PolarHBondContact O-N 3.47Å
132R41.2Very low52.6Low199 Ų199108.3 Ų108.375%0.75161%0.606SS**  trans-162.992.8170.1-112.4164.9-170.2175.21.8108.8L134R132-L134 HydrophobicContact CB-CD1 4.38Å; R132-L134 HydrophobicContact CB-CG 4.05Å; R132-L134 HydrophobicContact CG-CG 4.1Å; R132-L134 PolarHBondContact O-N 3.23Å
133S45.1Very low53.3Low93 Ų93104.2 Ų104.265%0.6558%0.576SS**  trans-57.675143.6168.90000107.8R135S133-R135 PolarHBondContact O-N 3.01Å
134L44.5Very low54.2Low134 Ų134105.9 Ų105.970%0.70258%0.58SS**  trans-72.569.9154-72.3164.7000105.3R132 H136R132-L134 HydrophobicContact CB-CD1 4.38Å; R132-L134 HydrophobicContact CB-CG 4.05Å; R132-L134 HydrophobicContact CG-CG 4.1Å; R132-L134 PolarHBondContact O-N 3.23Å; L134-H136 PolarHBondContact O-N 3.37Å
135R42.8Very low55.4Low217 Ų217104.4 Ų104.482%0.81958%0.578SS**  trans-6284.5144-74.8-178.9-179.5-163.7-0.5103.7S133 E137S133-R135 PolarHBondContact O-N 3.01Å; R135-E137 VanDerWaalsContact C-N 3.3Å; R135-E137 PolarHBondContact O-N 3.28Å; R135-E137 VanDerWaalsContact O-N 3.15Å
136H43.2Very low56.8Low147 Ų147103 Ų10368%0.68157%0.565SS**  trans-60.4111.1152.7-160.265.6000102.6L134 A138L134-H136 PolarHBondContact O-N 3.37Å; H136-A138 VanDerWaalsContact C-N 3.3Å; H136-A138 PolarHBondContact O-N 3.05Å
137E42.1Very low58.4Low172 Ų172102.5 Ų102.580%0.80456%0.555SS**  trans-52.2107.6167.2-63.9-123.9127.600104.7R135 E139R135-E137 VanDerWaalsContact C-N 3.3Å; R135-E137 PolarHBondContact O-N 3.28Å; R135-E137 VanDerWaalsContact O-N 3.15Å; E137-E139 PolarHBondContact O-N 3.32Å
138A49.1Very low60.3Low69 Ų6996.7 Ų96.757%0.5754%0.541SS*.  trans-68.186.9177.500000106H136 G140H136-A138 VanDerWaalsContact C-N 3.3Å; H136-A138 PolarHBondContact O-N 3.05Å; A138-G140 VanDerWaalsContact C-N 3.27Å; A138-G140 PolarHBondContact O-N 3.02Å
139E47.9Very low62.1Low160 Ų16097.1 Ų97.175%0.74853%0.531SS*.  trans-62.397.3162.8-83.4-160.714700107.1Q34 E137Q34-E139 PolarHBondContact NE2-O 3Å; E137-E139 PolarHBondContact O-N 3.32Å
140G57.6Low64.2Low49 Ų4990.9 Ų90.951%0.50550%0.498SS..  trans72.1142.3170.400000115.1A138 F142A138-G140 VanDerWaalsContact C-N 3.27Å; A138-G140 PolarHBondContact O-N 3.02Å; G140-F142 PolarHBondContact O-N 3.44Å
141D67.9Low66.4Low84 Ų8491.3 Ų91.345%0.44949%0.489SS..  trans-7675.1164.3-163.3-4000108D143 V144 A145D141-D143 PolarHBondContact O-N 3.37Å; D141-V144 HydrophobicContact CB-CB 4.06Å; D141-V144 HydrophobicContact CB-CG2 4.34Å; D141-V144 PolarHBondContact O-N 3.26Å; D141-V144 VanDerWaalsContact O-N 3.13Å; D141-V144 WeakPolarHBondContact OD1-CG2 3.33Å; D141-V144 WeakPolarHBondContact OD2-CB 3.47Å; D141-V144 WeakPolarHBondContact OD2-CG2 3.42Å; D141-A145 PolarHBondContact O-N 3.44Å
142F73.5Confident68.6Low29 Ų2996 Ų9613%0.12749%0.489CS..Hα-helixtrans-52.8-44.3-175.7178.3-86.3000110.8R37 E38 Q41 G140 V144 A145 D146R37-F142 HydrophobicContact CB-CD1 3.95Å; R37-F142 HydrophobicContact CB-CE1 3.48Å; R37-F142 VanDerWaalsContact CB-CE1 3.48Å; R37-F142 HydrophobicContact CB-CZ 4.15Å; E38-F142 HydrophobicContact CG-CD2 4.18Å; E38-F142 HydrophobicContact CG-CE2 3.69Å; E38-F142 HydrophobicContact CG-CZ 4.22Å; Q41-F142 HydrophobicContact CB-CZ 4.41Å; G140-F142 PolarHBondContact O-N 3.44Å; F142-V144 VanDerWaalsContact C-N 3.31Å; F142-V144 PolarHBondContact O-N 2.89Å; F142-A145 PolarHBondContact O-N 2.91Å; F142-D146 HydrophobicContact CD1-CB 3.94Å; F142-D146 HydrophobicContact CE1-CB 3.47Å; F142-D146 VanDerWaalsContact CE1-CB 3.47Å; F142-D146 HydrophobicContact CZ-CB 3.82Å; F142-D146 VanDerWaalsContact O-CB 3.3Å; F142-D146 WeakPolarHBondContact O-CB 3.25Å; F142-D146 PolarHBondContact O-N 3.43Å
143D71.4Confident71.3Confident10 Ų1087 Ų875%0.05346%0.456CS..Hα-helixtrans-60.2-38-179.2-67.9-25.5000112.6P104 L105 D141 A145 L147P104-D143 WeakPolarHBondContact CA-OD2 3.32Å; L105-D143 PolarHBondContact N-OD2 2.93Å; D141-D143 PolarHBondContact O-N 3.37Å; D143-A145 VanDerWaalsContact C-N 3.31Å; D143-A145 PolarHBondContact O-N 3.38Å; D143-L147 HydrophobicContact CB-CD1 4.39Å; D143-L147 WeakPolarHBondContact O-CB 3.4Å; D143-L147 WeakPolarHBondContact O-CD1 3.35Å; D143-L147 VanDerWaalsContact O-CG 3.29Å; D143-L147 WeakPolarHBondContact O-CG 3.33Å; D143-L147 PolarHBondContact O-N 2.82Å
144V75Confident73.8Confident98 Ų9883 Ų8359%0.59443%0.427SS*.Hα-helixtrans-69.8-29.2-179.3165.10000112.6D141 F142 P148D141-V144 HydrophobicContact CB-CB 4.06Å; D141-V144 HydrophobicContact CB-CG2 4.34Å; D141-V144 PolarHBondContact O-N 3.26Å; D141-V144 VanDerWaalsContact O-N 3.13Å; D141-V144 WeakPolarHBondContact OD1-CG2 3.33Å; D141-V144 WeakPolarHBondContact OD2-CB 3.47Å; D141-V144 WeakPolarHBondContact OD2-CG2 3.42Å; F142-V144 VanDerWaalsContact C-N 3.31Å; F142-V144 PolarHBondContact O-N 2.89Å; V144-P148 WeakPolarHBondContact O-CD 3.38Å; V144-P148 WeakPolarHBondContact O-CG 3.41Å
145A82.6Confident76.3Confident69 Ų6981.8 Ų81.857%0.5742%0.421SS*.Hα-helixtrans-86.8-41.9175.600000112.6D141 F142 D143 P148D141-A145 PolarHBondContact O-N 3.44Å; F142-A145 PolarHBondContact O-N 2.91Å; D143-A145 VanDerWaalsContact C-N 3.31Å; D143-A145 PolarHBondContact O-N 3.38Å; A145-P148 WeakPolarHBondContact O-CD 3.46Å; A145-P148 WeakPolarHBondContact O-CG 3.49Å
146D88.9Confident78.8Confident14 Ų1476.2 Ų76.28%0.07540%0.404CS..Hα-helixtrans-75.3-41.8-170.8-17269.6000113.3R44 F142 E149 L150R44-D146 IonicContact CZ-OD1 2.74Å; R44-D146 VanDerWaalsContact CZ-OD1 3.24Å; R44-D146 IonicContact CZ-OD2 3.7Å; R44-D146 VanDerWaalsContact NH1-CG 3.33Å; R44-D146 IonicContact NH1-OD1 2.62Å; R44-D146 PolarHBondContact NH1-OD1 2.87Å; R44-D146 IonicContact NH1-OD2 3.18Å; R44-D146 PolarHBondContact NH1-OD2 3.18Å; R44-D146 IonicContact NH2-OD1 2.66Å; R44-D146 PolarHBondContact NH2-OD1 2.91Å; R44-D146 IonicContact NH2-OD2 3.74Å; F142-D146 HydrophobicContact CD1-CB 3.94Å; F142-D146 HydrophobicContact CE1-CB 3.47Å; F142-D146 VanDerWaalsContact CE1-CB 3.47Å; F142-D146 HydrophobicContact CZ-CB 3.82Å; F142-D146 VanDerWaalsContact O-CB 3.3Å; F142-D146 WeakPolarHBondContact O-CB 3.25Å; F142-D146 PolarHBondContact O-N 3.43Å; D146-E149 WeakPolarHBondContact O-CB 3.49Å; D146-E149 PolarHBondContact O-N 3.27Å; D146-L150 WeakPolarHBondContact O-CB 3.46Å; D146-L150 PolarHBondContact O-N 3.19Å
147L91.3Very high81.3Confident38 Ų3869.3 Ų69.320%0.19937%0.372CS..Hα-helixtrans-58.5-49.2-177.9-71.8171000114.2L97 D143 E149 L150 E151L97-L147 HydrophobicContact CD1-CB 4.42Å; L97-L147 HydrophobicContact CD1-CD2 3.92Å; L97-L147 WeakPolarHBondContact CD1-O 3.49Å; D143-L147 HydrophobicContact CB-CD1 4.39Å; D143-L147 WeakPolarHBondContact O-CB 3.4Å; D143-L147 WeakPolarHBondContact O-CD1 3.35Å; D143-L147 VanDerWaalsContact O-CG 3.29Å; D143-L147 WeakPolarHBondContact O-CG 3.33Å; D143-L147 PolarHBondContact O-N 2.82Å; L147-E149 VanDerWaalsContact C-N 3.29Å; L147-E149 PolarHBondContact O-N 2.8Å; L147-L150 PolarHBondContact O-N 3.48Å; L147-E151 PolarHBondContact O-N 3.45Å
148P92.9Very high83.8Confident62 Ų6261.7 Ų61.740%0.40334%0.34SS..Hα-helixtrans-69.4-27.2178.127.5-35.2000112.7V144 A145 R152V144-P148 WeakPolarHBondContact O-CD 3.38Å; V144-P148 WeakPolarHBondContact O-CG 3.41Å; A145-P148 WeakPolarHBondContact O-CD 3.46Å; A145-P148 WeakPolarHBondContact O-CG 3.49Å; P148-R152 PolarHBondContact O-N 3.22Å
149E94.6Very high86Confident82 Ų8264.8 Ų64.838%0.38334%0.343SS..Hα-helixtrans-66.9-51.4170.8-178.5171.8-129.900110.2Q41 R44 D146 L147 E151 R152 E153Q41-E149 PolarHBondContact NE2-OE2 3.47Å; R44-E149 IonicContact NH2-OE2 3.81Å; D146-E149 WeakPolarHBondContact O-CB 3.49Å; D146-E149 PolarHBondContact O-N 3.27Å; L147-E149 VanDerWaalsContact C-N 3.29Å; L147-E149 PolarHBondContact O-N 2.8Å; E149-E151 VanDerWaalsContact C-N 3.27Å; E149-E151 PolarHBondContact O-N 3.49Å; E149-R152 WeakPolarHBondContact O-CB 3.45Å; E149-R152 PolarHBondContact O-N 3.21Å; E149-E153 HydrophobicContact CG-CG 4.35Å; E149-E153 VanDerWaalsContact O-CG 3.31Å; E149-E153 WeakPolarHBondContact O-CG 3.41Å; E149-E153 PolarHBondContact O-N 2.94Å
150L95.9Very high88.1Confident1 Ų158.7 Ų58.71%0.00532%0.315CS..Hα-helixtrans-55.4-41.517717660.4000112.2M93 L97 D146 L147 R152 E153 V154M93-L150 HydrophobicContact CB-CD1 4.17Å; M93-L150 HydrophobicContact CE-CD1 3.92Å; M93-L150 HydrophobicContact CG-CD1 4.37Å; L97-L150 HydrophobicContact CB-CD2 3.81Å; L97-L150 HydrophobicContact CB-CG 4.17Å; L97-L150 HydrophobicContact CD1-CB 4.33Å; L97-L150 HydrophobicContact CD1-CD2 4.09Å; L97-L150 HydrophobicContact CD1-CG 4.17Å; D146-L150 WeakPolarHBondContact O-CB 3.46Å; D146-L150 PolarHBondContact O-N 3.19Å; L147-L150 PolarHBondContact O-N 3.48Å; L150-R152 PolarHBondContact O-N 2.92Å; L150-E153 PolarHBondContact O-N 2.94Å; L150-V154 HydrophobicContact CD1-CG2 4.46Å; L150-V154 WeakPolarHBondContact O-CG2 3.42Å; L150-V154 PolarHBondContact O-N 3.39Å
151E96.8Very high89.7Confident111 Ų11157 Ų5752%0.51929%0.294SS..Hα-helixtrans-59.6-45.2175.8-175.7174.9-158.600112L97 L147 E149 E153 V154 L155L97-E151 HydrophobicContact CD1-CB 4.19Å; L97-E151 HydrophobicContact CD2-CB 3.98Å; L97-E151 HydrophobicContact CD2-CG 4.15Å; L147-E151 PolarHBondContact O-N 3.45Å; E149-E151 VanDerWaalsContact C-N 3.27Å; E149-E151 PolarHBondContact O-N 3.49Å; E151-E153 VanDerWaalsContact C-N 3.32Å; E151-E153 PolarHBondContact O-N 3.49Å; E151-V154 PolarHBondContact O-N 3.33Å; E151-L155 PolarHBondContact O-N 3.2Å
152R97.1Very high90.9Very high178 Ų17857.8 Ų57.867%0.67230%0.298SS*.Hα-helixtrans-62.6-41.4174.9-173-165.9-49.7-79.9-7.3111.5P148 E149 L150 L155 Q156P148-R152 PolarHBondContact O-N 3.22Å; E149-R152 WeakPolarHBondContact O-CB 3.45Å; E149-R152 PolarHBondContact O-N 3.21Å; L150-R152 PolarHBondContact O-N 2.92Å; R152-L155 PolarHBondContact O-N 3.5Å; R152-Q156 PolarHBondContact O-N 3.22Å
153E96.3Very high91.6Very high10 Ų1059.5 Ų59.55%0.04731%0.309CS..Hα-helixtrans-66.7-36.6179.8-65-179.4161.400112.2R44 R48 M93 E149 L150 E151 L155 Q156 V157R44-E153 WeakPolarHBondContact CD-OE2 3.47Å; R44-E153 IonicContact CZ-OE2 3.08Å; R44-E153 IonicContact NE-OE2 3.11Å; R44-E153 PolarHBondContact NE-OE2 3.03Å; R44-E153 IonicContact NH2-OE2 3.72Å; R48-E153 IonicContact CZ-OE1 3.7Å; R48-E153 VanDerWaalsContact NH1-CG 3.34Å; R48-E153 IonicContact NH1-OE1 2.7Å; R48-E153 PolarHBondContact NH1-OE1 2.84Å; R48-E153 IonicContact NH1-OE2 2.74Å; M93-E153 HydrophobicContact CE-CB 3.52Å; E149-E153 HydrophobicContact CG-CG 4.35Å; E149-E153 VanDerWaalsContact O-CG 3.31Å; E149-E153 WeakPolarHBondContact O-CG 3.41Å; E149-E153 PolarHBondContact O-N 2.94Å; L150-E153 PolarHBondContact O-N 2.94Å; E151-E153 VanDerWaalsContact C-N 3.32Å; E151-E153 PolarHBondContact O-N 3.49Å; E153-L155 VanDerWaalsContact C-N 3.33Å; E153-Q156 PolarHBondContact O-N 3.33Å; E153-V157 WeakPolarHBondContact O-CG2 3.49Å; E153-V157 PolarHBondContact O-N 3.44Å
154V97.4Very high92.2Very high8 Ų859.7 Ų59.75%0.04831%0.309CS..Hα-helixtrans-58-48172.1168.10000110.2M93 R94 L150 E151 Q156 V157 G158M93-V154 HydrophobicContact CB-CG2 3.62Å; M93-V154 HydrophobicContact CE-CG2 4.19Å; R94-V154 HydrophobicContact CG-CG1 3.55Å; R94-V154 HydrophobicContact CG-CG2 4.29Å; L150-V154 HydrophobicContact CD1-CG2 4.46Å; L150-V154 WeakPolarHBondContact O-CG2 3.42Å; L150-V154 PolarHBondContact O-N 3.39Å; E151-V154 PolarHBondContact O-N 3.33Å; V154-Q156 VanDerWaalsContact C-N 3.3Å; V154-Q156 PolarHBondContact O-N 3.47Å; V154-V157 PolarHBondContact O-N 3.02Å; V154-G158 PolarHBondContact O-N 3.06Å
155L97.1Very high92.7Very high109 Ų10959.6 Ų59.657%0.57130%0.303SS*.Hα-helixtrans-60.5-42.3178.2-65.6174.3000111.3E151 R152 E153 V157 G158 E159E151-L155 PolarHBondContact O-N 3.2Å; R152-L155 PolarHBondContact O-N 3.5Å; E153-L155 VanDerWaalsContact C-N 3.33Å; L155-V157 PolarHBondContact O-N 3.48Å; L155-G158 PolarHBondContact O-N 3.02Å; L155-E159 WeakPolarHBondContact O-CG 3.4Å; L155-E159 PolarHBondContact O-N 3.05Å
156Q95.4Very high92.8Very high100 Ų10064.1 Ų64.147%0.46731%0.314SS..Hα-helixtrans-65.5-36.8178.5-169179.618.600113R152 E153 V154 G158 M160R152-Q156 PolarHBondContact O-N 3.22Å; E153-Q156 PolarHBondContact O-N 3.33Å; V154-Q156 VanDerWaalsContact C-N 3.3Å; V154-Q156 PolarHBondContact O-N 3.47Å; Q156-G158 VanDerWaalsContact C-N 3.35Å; Q156-M160 WeakPolarHBondContact O-CB 3.36Å; Q156-M160 PolarHBondContact O-N 3.13Å
157V96Very high92.5Very high2 Ų267.6 Ų67.61%0.01233%0.328CS..Hα-helixtrans-67.6-38.9174.1174.80000110.5R48 E90 M93 E153 V154 L155 M160 I161R48-V157 HydrophobicContact CG-CG2 3.9Å; E90-V157 HydrophobicContact CB-CG1 3.83Å; E90-V157 HydrophobicContact CG-CB 4.44Å; E90-V157 HydrophobicContact CG-CG1 4.05Å; M93-V157 HydrophobicContact CE-CG2 4.29Å; M93-V157 HydrophobicContact SD-CG2 3.96Å; E153-V157 WeakPolarHBondContact O-CG2 3.49Å; E153-V157 PolarHBondContact O-N 3.44Å; V154-V157 PolarHBondContact O-N 3.02Å; L155-V157 PolarHBondContact O-N 3.48Å; V157-M160 HydrophobicContact CG1-CE 4.15Å; V157-M160 HydrophobicContact CG2-CE 4.38Å; V157-M160 WeakPolarHBondContact O-CB 3.29Å; V157-M160 PolarHBondContact O-N 3.08Å; V157-I161 HydrophobicContact CG1-CD1 4.27Å; V157-I161 WeakPolarHBondContact O-CG1 3.39Å; V157-I161 PolarHBondContact O-N 3.2Å
158G94.7Very high92Very high12 Ų1266.4 Ų66.412%0.12432%0.322CS..Hα-helixtrans-59.8-48.7172.500000112.8E90 V154 L155 Q156 M160 I161 D162E90-G158 WeakPolarHBondContact OE1-CA 3.44Å; V154-G158 PolarHBondContact O-N 3.06Å; L155-G158 PolarHBondContact O-N 3.02Å; Q156-G158 VanDerWaalsContact C-N 3.35Å; G158-M160 VanDerWaalsContact C-N 3.26Å; G158-M160 PolarHBondContact O-N 3.33Å; G158-I161 WeakPolarHBondContact O-CB 3.37Å; G158-I161 PolarHBondContact O-N 3.43Å; G158-I161 VanDerWaalsContact O-N 3.09Å; G158-D162 PolarHBondContact O-N 2.97Å; G158-D162 VanDerWaalsContact O-N 3.07Å
159E94.8Very high91.2Very high135 Ų13571 Ų7163%0.63134%0.343SS*.Hα-helixtrans-59.4-38174.6-72.4177.2179.200112.1L155 D162 D163L155-E159 WeakPolarHBondContact O-CG 3.4Å; L155-E159 PolarHBondContact O-N 3.05Å; E159-D162 PolarHBondContact O-N 2.7Å; E159-D163 VanDerWaalsContact O-CB 3.24Å; E159-D163 WeakPolarHBondContact O-CB 3.4Å; E159-D163 PolarHBondContact O-N 3.41Å
160M92.3Very high90.5Very high31 Ų3167.9 Ų67.915%0.15333%0.33CS..Hα-helixtrans-65.1-39.4175.7-179.1177.759.600111.7A51 V52 L86 Q156 V157 G158 M164A51-M160 HydrophobicContact CB-CE 3.76Å; A51-M160 HydrophobicContact CB-SD 4.14Å; V52-M160 HydrophobicContact CG2-SD 4.2Å; L86-M160 HydrophobicContact CD1-CE 3.9Å; L86-M160 HydrophobicContact CD1-CG 4.38Å; L86-M160 HydrophobicContact CD2-CE 3.51Å; L86-M160 HydrophobicContact CG-CE 4.31Å; Q156-M160 WeakPolarHBondContact O-CB 3.36Å; Q156-M160 PolarHBondContact O-N 3.13Å; V157-M160 HydrophobicContact CG1-CE 4.15Å; V157-M160 HydrophobicContact CG2-CE 4.38Å; V157-M160 WeakPolarHBondContact O-CB 3.29Å; V157-M160 PolarHBondContact O-N 3.08Å; G158-M160 VanDerWaalsContact C-N 3.26Å; G158-M160 PolarHBondContact O-N 3.33Å; M160-M164 HydrophobicContact CG-CG 4.42Å; M160-M164 HydrophobicContact CG-SD 3.96Å; M160-M164 VanDerWaalsContact O-CB 3.31Å; M160-M164 WeakPolarHBondContact O-CB 3.25Å; M160-M164 WeakPolarHBondContact O-CG 3.36Å; M160-M164 PolarHBondContact O-N 3.49Å
161I92.8Very high89.5Confident15 Ų1570.5 Ų70.58%0.07735%0.347CS..Hα-helixtrans-60.7-50.9175.2-68.7163.9000109.7L86 E90 V157 G158 D163 M164 E165L86-I161 HydrophobicContact CB-CD1 4.06Å; L86-I161 HydrophobicContact CB-CG1 3.71Å; L86-I161 HydrophobicContact CD1-CG1 3.9Å; L86-I161 HydrophobicContact CG-CG1 4.49Å; E90-I161 HydrophobicContact CB-CD1 4.09Å; E90-I161 HydrophobicContact CG-CD1 4.34Å; V157-I161 HydrophobicContact CG1-CD1 4.27Å; V157-I161 WeakPolarHBondContact O-CG1 3.39Å; V157-I161 PolarHBondContact O-N 3.2Å; G158-I161 WeakPolarHBondContact O-CB 3.37Å; G158-I161 PolarHBondContact O-N 3.43Å; G158-I161 VanDerWaalsContact O-N 3.09Å; I161-D163 PolarHBondContact O-N 2.88Å; I161-M164 PolarHBondContact O-N 2.94Å; I161-E165 WeakPolarHBondContact O-CG 3.46Å; I161-E165 PolarHBondContact O-N 3.31Å
162D91.6Very high88.4Confident100 Ų10069.8 Ų69.854%0.53534%0.34SS..Hα-helixtrans-59.9-47.1-180-69.7-23.3000112.3G158 E159 M164 E165 M166G158-D162 PolarHBondContact O-N 2.97Å; G158-D162 VanDerWaalsContact O-N 3.07Å; E159-D162 PolarHBondContact O-N 2.7Å; D162-M164 VanDerWaalsContact C-N 3.28Å; D162-M164 PolarHBondContact O-N 2.72Å; D162-E165 PolarHBondContact O-N 2.72Å; D162-M166 WeakPolarHBondContact O-CG 3.31Å; D162-M166 PolarHBondContact O-N 3.29Å
163D88.6Confident87.1Confident65 Ų6571.6 Ų71.635%0.34835%0.347SS..Hα-helixtrans-61.2-38.1178.3170.871.1000111.7E159 I161 M166 K167E159-D163 VanDerWaalsContact O-CB 3.24Å; E159-D163 WeakPolarHBondContact O-CB 3.4Å; E159-D163 PolarHBondContact O-N 3.41Å; I161-D163 PolarHBondContact O-N 2.88Å; D163-M166 PolarHBondContact O-N 3.34Å; D163-K167 VanDerWaalsContact CG-CE 3.46Å; D163-K167 WeakPolarHBondContact O-CB 3.31Å; D163-K167 WeakPolarHBondContact O-CG 3.37Å; D163-K167 PolarHBondContact O-N 3.48Å; D163-K167 WeakPolarHBondContact OD1-CE 3.48Å; D163-K167 IonicContact OD1-NZ 3.66Å; D163-K167 PolarHBondContact OD1-NZ 3.05Å; D163-K167 VanDerWaalsContact OD1-NZ 3.08Å; D163-K167 WeakPolarHBondContact OD2-CD 3.47Å; D163-K167 WeakPolarHBondContact OD2-CE 3.35Å; D163-K167 IonicContact OD2-NZ 2.9Å; D163-K167 PolarHBondContact OD2-NZ 3.25Å
164M84.3Confident85.9Confident13 Ų1373.8 Ų73.86%0.06436%0.361CS..Hα-helixtrans-69.7-42.4177.8-72.2-171.774.600111.6G55 W79 F82 L86 M160 I161 D162 M166 K167 V168G55-M164 VanDerWaalsContact CA-CE 3.4Å; W79-M164 HydrophobicContact CE3-CE 4.17Å; W79-M164 HydrophobicContact CH2-CB 3.89Å; W79-M164 HydrophobicContact CH2-CE 3.12Å; W79-M164 HydrophobicContact CH2-CG 4.15Å; W79-M164 HydrophobicContact CZ2-CB 3.8Å; W79-M164 HydrophobicContact CZ2-CE 3.88Å; W79-M164 VanDerWaalsContact CZ2-O 3.29Å; W79-M164 WeakPolarHBondContact CZ2-O 3.4Å; W79-M164 HydrophobicContact CZ3-CE 3.28Å; F82-M164 HydrophobicContact CD1-CE 3.62Å; F82-M164 HydrophobicContact CD1-SD 4.4Å; F82-M164 HydrophobicContact CE1-CE 2.95Å; F82-M164 HydrophobicContact CE1-SD 3.26Å; F82-M164 WeakPolarHBondContact CE1-SD 3.42Å; F82-M164 HydrophobicContact CZ-CE 3.5Å; F82-M164 HydrophobicContact CZ-SD 3.53Å; F82-M164 VanDerWaalsContact CZ-SD 3.53Å; L86-M164 HydrophobicContact CD1-SD 3.86Å; M160-M164 HydrophobicContact CG-CG 4.42Å; M160-M164 HydrophobicContact CG-SD 3.96Å; M160-M164 VanDerWaalsContact O-CB 3.31Å; M160-M164 WeakPolarHBondContact O-CB 3.25Å; M160-M164 WeakPolarHBondContact O-CG 3.36Å; M160-M164 PolarHBondContact O-N 3.49Å; I161-M164 PolarHBondContact O-N 2.94Å; D162-M164 VanDerWaalsContact C-N 3.28Å; D162-M164 PolarHBondContact O-N 2.72Å; M164-M166 PolarHBondContact O-N 2.82Å; M164-K167 PolarHBondContact O-N 2.96Å; M164-K167 VanDerWaalsContact O-N 3.13Å; M164-V168 PolarHBondContact O-N 3.44Å
165E84.4Confident84.6Confident97 Ų9776 Ų7645%0.45338%0.375SS..Hα-helixtrans-59.8-34173.9-68.6-169.8166.200112.4I161 D162 R172I161-E165 WeakPolarHBondContact O-CG 3.46Å; I161-E165 PolarHBondContact O-N 3.31Å; D162-E165 PolarHBondContact O-N 2.72Å; E165-R172 IonicContact OE1-CZ 3.66Å; E165-R172 IonicContact OE1-NE 3.43Å; E165-R172 PolarHBondContact OE1-NE 3.28Å; E165-R172 IonicContact OE1-NH2 2.93Å; E165-R172 PolarHBondContact OE1-NH2 3.22Å
166M85Confident83.2Confident163 Ų16378.4 Ų78.480%0.80338%0.383SS*.Hα-helixtrans-74.9-32.1174.6-72.7-173.715600114.1D162 D163 M164D162-M166 WeakPolarHBondContact O-CG 3.31Å; D162-M166 PolarHBondContact O-N 3.29Å; D163-M166 PolarHBondContact O-N 3.34Å; M164-M166 PolarHBondContact O-N 2.82Å
167K84.2Confident82Confident88 Ų8877.7 Ų77.738%0.38339%0.394SS..Hα-helixtrans-78.8-26.1-172.3-81.8174.5172.5164.30114.2T59 D163 M164T59-K167 HydrophobicContact CG2-CB 4.38Å; T59-K167 HydrophobicContact CG2-CD 4.49Å; D163-K167 VanDerWaalsContact CG-CE 3.46Å; D163-K167 WeakPolarHBondContact O-CB 3.31Å; D163-K167 WeakPolarHBondContact O-CG 3.37Å; D163-K167 PolarHBondContact O-N 3.48Å; D163-K167 WeakPolarHBondContact OD1-CE 3.48Å; D163-K167 IonicContact OD1-NZ 3.66Å; D163-K167 PolarHBondContact OD1-NZ 3.05Å; D163-K167 VanDerWaalsContact OD1-NZ 3.08Å; D163-K167 WeakPolarHBondContact OD2-CD 3.47Å; D163-K167 WeakPolarHBondContact OD2-CE 3.35Å; D163-K167 IonicContact OD2-NZ 2.9Å; D163-K167 PolarHBondContact OD2-NZ 3.25Å; M164-K167 PolarHBondContact O-N 2.96Å; M164-K167 VanDerWaalsContact O-N 3.13Å
168V79.8Confident80.7Confident12 Ų1285.8 Ų85.87%0.07342%0.424CS..  trans-138114.9-172.5174.90000109.4T59 L62 W79 M164 V170T59-V168 HydrophobicContact CG2-CG2 4.31Å; L62-V168 HydrophobicContact CB-CG1 4.2Å; L62-V168 HydrophobicContact CB-CG2 4.41Å; L62-V168 HydrophobicContact CD1-CG1 3.72Å; L62-V168 HydrophobicContact CD1-CG2 4.47Å; L62-V168 HydrophobicContact CG-CG1 4.49Å; W79-V168 HydrophobicContact CD2-CB 4.38Å; W79-V168 HydrophobicContact CD2-CG1 4.14Å; W79-V168 HydrophobicContact CE3-CG2 4.45Å; W79-V168 HydrophobicContact CG-CG1 4.46Å; W79-V168 HydrophobicContact CH2-CB 3.91Å; W79-V168 HydrophobicContact CH2-CG2 3.56Å; W79-V168 HydrophobicContact CZ2-CB 3.56Å; W79-V168 HydrophobicContact CZ2-CG1 4.2Å; W79-V168 HydrophobicContact CZ2-CG2 3.79Å; W79-V168 HydrophobicContact CZ3-CB 4.5Å; W79-V168 HydrophobicContact CZ3-CG2 3.94Å; M164-V168 PolarHBondContact O-N 3.44Å; V168-V170 HydrophobicContact CG1-CB 3.97Å; V168-V170 HydrophobicContact CG1-CG2 3.43Å; V168-V170 VanDerWaalsContact CG1-CG2 3.43Å; V168-V170 PolarHBondContact O-N 2.92Å
169N75.6Confident79.5Confident158 Ų15890.5 Ų90.585%0.84544%0.443SS*.  trans-78.861.5178.7-68.7-55.7000111.9P171N169-P171 WeakPolarHBondContact O-CD 3.39Å
170V80.4Confident78.4Confident17 Ų1787.8 Ų87.810%0.10344%0.444CS..  trans-115.195.6175.4177.20000107.6E76 V80 V168E76-V170 HydrophobicContact CB-CG1 3.83Å; E76-V170 HydrophobicContact CB-CG2 4.44Å; E76-V170 HydrophobicContact CG-CG1 3.97Å; E76-V170 HydrophobicContact CG-CG2 3.7Å; V80-V170 HydrophobicContact CG2-CG1 4.23Å; V168-V170 HydrophobicContact CG1-CB 3.97Å; V168-V170 HydrophobicContact CG1-CG2 3.43Å; V168-V170 VanDerWaalsContact CG1-CG2 3.43Å; V168-V170 PolarHBondContact O-N 2.92Å
171P75.7Confident77.5Confident56 Ų5691.4 Ų91.436%0.36448%0.479SS..  trans-64.2139.6179.1-14.626.7000110.6N169 W173 T174N169-P171 WeakPolarHBondContact O-CD 3.39Å; P171-W173 HydrophobicContact CB-CD2 4.44Å; P171-W173 HydrophobicContact CB-CG 4.33Å; P171-W173 HydrophobicContact CB-CZ2 4.4Å; P171-W173 PolarHBondContact O-N 3.35Å; P171-T174 HydrophobicContact CB-CG2 3.95Å; P171-T174 HydrophobicContact CG-CG2 3.82Å; P171-T174 PolarHBondContact O-N 2.96Å; P171-T174 VanDerWaalsContact O-N 3.08Å; P171-T174 PolarHBondContact O-OG1 3.43Å
172R73.6Confident76.5Confident97 Ų9792 Ų9237%0.36649%0.488SS..THydrogen-bonded Turntrans-57.1-21.1-175.7-64.7166.5176.6-110.514114.4D87 E165D87-R172 IonicContact OD1-CZ 3.45Å; D87-R172 IonicContact OD1-NH1 3.18Å; D87-R172 IonicContact OD1-NH2 2.87Å; D87-R172 PolarHBondContact OD1-NH2 3.01Å; D87-R172 VanDerWaalsContact OD1-NH2 3.11Å; D87-R172 IonicContact OD2-CZ 2.92Å; D87-R172 IonicContact OD2-NH1 3.68Å; D87-R172 PolarHBondContact OD2-NH1 3.32Å; D87-R172 IonicContact OD2-NH2 3.64Å; D87-R172 PolarHBondContact OD2-NH2 3.25Å; E165-R172 IonicContact OE1-CZ 3.66Å; E165-R172 IonicContact OE1-NE 3.43Å; E165-R172 PolarHBondContact OE1-NE 3.28Å; E165-R172 IonicContact OE1-NH2 2.93Å; E165-R172 PolarHBondContact OE1-NH2 3.22Å
173W70.1Confident75.6Confident215 Ų21588.5 Ų88.581%0.81447%0.473SS*.THydrogen-bonded Turntrans-93.8-4.4-177.257.1-86.7000114.8P171 V175P171-W173 HydrophobicContact CB-CD2 4.44Å; P171-W173 HydrophobicContact CB-CG 4.33Å; P171-W173 HydrophobicContact CB-CZ2 4.4Å; P171-W173 PolarHBondContact O-N 3.35Å; W173-V175 VanDerWaalsContact C-N 3.32Å; W173-V175 PolarHBondContact O-N 3.25Å
174T69.6Low74.9Confident57 Ų5790.7 Ų90.735%0.3548%0.482SS..  trans-84-5.6-176.757.70000114P171 Q176P171-T174 HydrophobicContact CB-CG2 3.95Å; P171-T174 HydrophobicContact CG-CG2 3.82Å; P171-T174 PolarHBondContact O-N 2.96Å; P171-T174 VanDerWaalsContact O-N 3.08Å; P171-T174 PolarHBondContact O-OG1 3.43Å; T174-Q176 PolarHBondContact O-N 2.87Å
175V69.9Low74.4Confident55 Ų5596.4 Ų96.433%0.33351%0.512SS..  trans-75.4114.4-176.5164.50000111.5R77 V80 W173R77-V175 HydrophobicContact CG-CB 4.39Å; R77-V175 HydrophobicContact CG-CG1 3.54Å; R77-V175 HydrophobicContact CG-CG2 4.06Å; V80-V175 HydrophobicContact CB-CG2 3.86Å; V80-V175 HydrophobicContact CG1-CG2 4.38Å; V80-V175 HydrophobicContact CG2-CG2 3.44Å; V80-V175 VanDerWaalsContact CG2-CG2 3.44Å; W173-V175 VanDerWaalsContact C-N 3.32Å; W173-V175 PolarHBondContact O-N 3.25Å
176Q68.9Low73.5Confident158 Ų15898.2 Ų98.274%0.73852%0.524SS*.  trans-74.2128.5167.5-70-178.1-13.900110.7R77 T174R77-Q176 PolarHBondContact NH1-O 3.05Å; T174-Q176 PolarHBondContact O-N 2.87Å
177A69.4Low72.2Confident86 Ų8693.9 Ų93.971%0.71151%0.509SS*.  trans-61.3134.217500000110.7Q179A177-Q179 VanDerWaalsContact C-N 3.29Å
178R68.3Low71Confident171 Ų17193 Ų9365%0.64552%0.519SS*.SBendtrans-71.8-26.6175.1-80.5-176.6122.1-170.32.4112.7E74E74-R178 IonicContact OE1-CZ 3.98Å; E74-R178 IonicContact OE1-NH2 3.45Å; E74-R178 PolarHBondContact OE1-NH2 3.3Å
179Q70.4Confident69.8Low111 Ų11196.6 Ų96.652%0.51955%0.549SS..SBendtrans-114.5144.8-175.3-62-170.310.800109.8A177 A183A177-Q179 VanDerWaalsContact C-N 3.29Å; Q179-A183 HydrophobicContact CB-CB 3.81Å; Q179-A183 HydrophobicContact CG-CB 4.45Å
180A71.8Confident68.7Low78 Ų7893.5 Ų93.565%0.64554%0.541SS*.  trans-62.1146.3169.500000109.3G182 A183A180-G182 PolarHBondContact O-N 2.72Å; A180-A183 VanDerWaalsContact O-CB 3.24Å; A180-A183 WeakPolarHBondContact O-CB 3.36Å; A180-A183 PolarHBondContact O-N 2.96Å
181A73.1Confident67.3Low108 Ų10896 Ų9689%0.89356%0.563SS**THydrogen-bonded Turntrans-51.8126.2176.900000110.6
182G71.4Confident65.8Low26 Ų2696.6 Ų96.627%0.26858%0.579SS.*THydrogen-bonded Turntrans86.93.6-179.300000115.6A180 E184 L185A180-G182 PolarHBondContact O-N 2.72Å; G182-E184 VanDerWaalsContact C-N 3.27Å; G182-E184 WeakPolarHBondContact CA-OE1 3.43Å; G182-E184 PolarHBondContact N-OE1 2.74Å; G182-E184 VanDerWaalsContact N-OE1 3.15Å; G182-E184 PolarHBondContact O-N 2.75Å; G182-L185 WeakPolarHBondContact O-CB 3.33Å; G182-L185 PolarHBondContact O-N 2.9Å
183A74.1Confident64.7Low27 Ų2796.8 Ų96.822%0.22360%0.601CS.*Hα-helixtrans-63.8-32.2173.600000112.5Q179 A180 L185 L186 S187Q179-A183 HydrophobicContact CB-CB 3.81Å; Q179-A183 HydrophobicContact CG-CB 4.45Å; A180-A183 VanDerWaalsContact O-CB 3.24Å; A180-A183 WeakPolarHBondContact O-CB 3.36Å; A180-A183 PolarHBondContact O-N 2.96Å; A183-L185 VanDerWaalsContact C-N 3.25Å; A183-L185 PolarHBondContact O-N 3.12Å; A183-L186 PolarHBondContact O-N 2.86Å; A183-L186 VanDerWaalsContact O-N 3.16Å; A183-S187 PolarHBondContact O-N 2.94Å
184E73Confident63.5Low112 Ų11292.5 Ų92.552%0.52360%0.604SS.*Hα-helixtrans-59.1-32.4172.951-81.2157.500113.6G182 S187 A188G182-E184 VanDerWaalsContact C-N 3.27Å; G182-E184 WeakPolarHBondContact CA-OE1 3.43Å; G182-E184 PolarHBondContact N-OE1 2.74Å; G182-E184 VanDerWaalsContact N-OE1 3.15Å; G182-E184 PolarHBondContact O-N 2.75Å; E184-S187 PolarHBondContact O-N 3.39Å; E184-A188 WeakPolarHBondContact O-CB 3.26Å; E184-A188 PolarHBondContact O-N 2.92Å
185L74.1Confident61.9Low133 Ų13395.4 Ų95.470%0.69663%0.627SS**Hα-helixtrans-69.6-36.4176.5-71.5165.5000111.8G182 A183 A189G182-L185 WeakPolarHBondContact O-CB 3.33Å; G182-L185 PolarHBondContact O-N 2.9Å; A183-L185 VanDerWaalsContact C-N 3.25Å; A183-L185 PolarHBondContact O-N 3.12Å; L185-A189 WeakPolarHBondContact O-CB 3.44Å; L185-A189 PolarHBondContact O-N 2.7Å; L185-A189 VanDerWaalsContact O-N 3.11Å
186L65.3Low60.8Low134 Ų13498.2 Ų98.270%0.70266%0.656SS**Hα-helixtrans-71.5-37176.7-62.7174.6000111.2A183 A189 S190A183-L186 PolarHBondContact O-N 2.86Å; A183-L186 VanDerWaalsContact O-N 3.16Å; L186-A189 PolarHBondContact O-N 3.49Å; L186-S190 PolarHBondContact O-N 3.27Å
187S57.7Low59.8Low72 Ų7294.4 Ų94.450%0.50366%0.659SS.*Hα-helixtrans-70.9-40.5177.3-129.60000112A183 E184 A189 S190 A191A183-S187 PolarHBondContact O-N 2.94Å; E184-S187 PolarHBondContact O-N 3.39Å; S187-A189 VanDerWaalsContact C-N 3.33Å; S187-A189 PolarHBondContact O-N 3.05Å; S187-S190 PolarHBondContact O-N 2.92Å; S187-S190 VanDerWaalsContact O-N 3.12Å; S187-S190 PolarHBondContact O-OG 3.45Å; S187-A191 PolarHBondContact O-N 3.33Å
188A58Low58.2Low70 Ų7093.5 Ų93.558%0.57966%0.658SS**Hα-helixtrans-66.5-31.6174.800000112.9E184 S190E184-A188 WeakPolarHBondContact O-CB 3.26Å; E184-A188 PolarHBondContact O-N 2.92Å; A188-S190 VanDerWaalsContact C-N 3.27Å; A188-S190 PolarHBondContact O-N 3.42Å
189A54.6Low57.1Low87 Ų8792.5 Ų92.572%0.71967%0.67SS**Hα-helixtrans-68.9-24.6171.900000113.1L185 L186 S187L185-A189 WeakPolarHBondContact O-CB 3.44Å; L185-A189 PolarHBondContact O-N 2.7Å; L185-A189 VanDerWaalsContact O-N 3.11Å; L186-A189 PolarHBondContact O-N 3.49Å; S187-A189 VanDerWaalsContact C-N 3.33Å; S187-A189 PolarHBondContact O-N 3.05Å
190S53.1Low55.3Low94 Ų9491.1 Ų91.166%0.65767%0.673SS**Hα-helixtrans-90.7-24.5178.473.10000114L186 S187 A188 G192L186-S190 PolarHBondContact O-N 3.27Å; S187-S190 PolarHBondContact O-N 2.92Å; S187-S190 VanDerWaalsContact O-N 3.12Å; S187-S190 PolarHBondContact O-OG 3.45Å; A188-S190 VanDerWaalsContact C-N 3.27Å; A188-S190 PolarHBondContact O-N 3.42Å; S190-G192 PolarHBondContact O-N 3.43Å
191A50.9Low54.1Low69 Ų6994.3 Ų94.357%0.5768%0.684SS**SBendtrans-92.687.4174.800000109.1S187 A193S187-A191 PolarHBondContact O-N 3.33Å; A191-A193 PolarHBondContact O-N 2.88Å
192G45.6Very low52.3Low69 Ų6996.2 Ų96.271%0.71168%0.675SS**  trans-45.8131.9177.400000113.1S190 S194S190-G192 PolarHBondContact O-N 3.43Å; G192-S194 PolarHBondContact O-N 3.03Å
193A48.6Very low51Low100 Ų100103.9 Ų103.983%0.82670%0.703SS**  trans-15.3105173.200000115.9A191A191-A193 PolarHBondContact O-N 2.88Å
194S45Very low49.2Very low126 Ų126113 Ų11388%0.88173%0.732SS**  trans-156.975.8154.5-84.70000110G192G192-S194 PolarHBondContact O-N 3.03Å
195S36.7Very low48.1Very low117 Ų117112.8 Ų112.882%0.81875%0.75SS**  trans-176.398.1146.9-178.40000107.1G197S195-G197 PolarHBondContact O-N 3.42Å
196A47.1Very low46.8Very low115 Ų115109.1 Ų109.195%0.9574%0.744SS**  trans-73.8103.9176.200000108.9
197G47.9Very low46.1Very low78 Ų78109 Ų10980%0.80475%0.751SS**  trans174.446.4177.900000113S195S195-G197 PolarHBondContact O-N 3.42Å
198G35.3Very low46Very low66 Ų66110.7 Ų110.768%0.6876%0.762SS**  trans-148.2116.3176.300000110.2S200G198-S200 PolarHBondContact O-N 2.98Å
199V45.4Very low46.4Very low150 Ų150111.1 Ų111.191%0.90975%0.754SS**  trans-62.1106.6170.7700000107.7
200S32.1Very low46.9Very low83 Ų83111.7 Ų111.758%0.5875%0.751SS**  trans-88.4109.3178.1176.30000108.6G198 E202G198-S200 PolarHBondContact O-N 2.98Å; S200-E202 VanDerWaalsContact C-N 3.29Å; S200-E202 PolarHBondContact O-N 3.42Å; S200-E202 WeakPolarHBondContact OG-CB 3.47Å; S200-E202 PolarHBondContact OG-N 3.38Å
201V48.1Very low47.7Very low144 Ų144110.9 Ų110.987%0.87375%0.745SS**  trans-79.990.3153.4174.70000105.5
202E33.6Very low48.7Very low149 Ų149114.3 Ų114.370%0.69675%0.748SS**  trans-106.4102.8170.6-172.8156.9123.300108.9S200 R204S200-E202 VanDerWaalsContact C-N 3.29Å; S200-E202 PolarHBondContact O-N 3.42Å; S200-E202 WeakPolarHBondContact OG-CB 3.47Å; S200-E202 PolarHBondContact OG-N 3.38Å; E202-R204 HydrophobicContact CG-CB 4.25Å; E202-R204 PolarHBondContact O-N 3.31Å
203E44.3Very low50Low186 Ų186113.1 Ų113.187%0.86973%0.731SS**  trans-79.791.6156.9-158.1-175.3151.100107.1
204R36.8Very low51.2Low218 Ų218113.7 Ų113.782%0.82372%0.719SS**SBendtrans-161.6142.2156.9-107.4174.9-168.998.1-0.1109.9E202 G206E202-R204 HydrophobicContact CG-CB 4.25Å; E202-R204 PolarHBondContact O-N 3.31Å; R204-G206 PolarHBondContact O-N 2.69Å; R204-G206 VanDerWaalsContact O-N 3.08Å
205A49.5Very low52.9Low109 Ų109109.6 Ų109.690%0.90169%0.693SS**  trans-42.4107.9-172.600000113.6
206G47.4Very low55.1Low56 Ų56107.2 Ų107.258%0.57768%0.68SS**PPolyproline II helixtrans-68.5155.517400000112.1R204 C208R204-G206 PolarHBondContact O-N 2.69Å; R204-G206 VanDerWaalsContact O-N 3.08Å; G206-C208 PolarHBondContact O-N 2.95Å
207P49.7Very low56.9Low131 Ų131106 Ų10685%0.85166%0.661SS**PPolyproline II helixtrans-53.7127.2167.423.7-31.5000108.1D209P207-D209 PolarHBondContact O-N 3.06Å; P207-D209 VanDerWaalsContact O-N 3.13Å
208C55.8Low58.9Low107 Ų107106.3 Ų106.372%0.72365%0.647SS**PPolyproline II helixtrans-48.9123.9-176-75.80000109.9G206 A213G206-C208 PolarHBondContact O-N 2.95Å; C208-A213 HydrophobicContact CB-CB 4.38Å
209D67.6Low61.4Low79 Ų79110.1 Ų110.142%0.42265%0.645SS.*  trans-45.4120.5168-86.7-45.4000107.6P207 S211 K212 A213P207-D209 PolarHBondContact O-N 3.06Å; P207-D209 VanDerWaalsContact O-N 3.13Å; D209-S211 PolarHBondContact O-N 3.2Å; D209-K212 HydrophobicContact CB-CB 4.01Å; D209-K212 HydrophobicContact CB-CD 4Å; D209-K212 HydrophobicContact CB-CG 3.87Å; D209-K212 WeakPolarHBondContact O-CA 3.21Å; D209-K212 PolarHBondContact O-N 3.22Å; D209-K212 WeakPolarHBondContact OD2-CE 3.33Å; D209-K212 IonicContact OD2-NZ 2.77Å; D209-K212 PolarHBondContact OD2-NZ 2.98Å; D209-A213 PolarHBondContact O-N 3.01Å
210P65.4Low63.6Low99 Ų99104.4 Ų104.464%0.64362%0.617SS**Hα-helixtrans-59.2-25.5-17622.4-32.8000111.5L214P210-L214 VanDerWaalsContact O-CB 3.29Å; P210-L214 WeakPolarHBondContact O-CB 3.42Å; P210-L214 WeakPolarHBondContact O-CG 3.37Å; P210-L214 PolarHBondContact O-N 3.26Å
211S69.1Low66.4Low78 Ų78103 Ų10355%0.54561%0.611SS.*Hα-helixtrans-68.5-39.4171.8590000113.4D209 A215D209-S211 PolarHBondContact O-N 3.2Å; S211-A215 WeakPolarHBondContact O-CB 3.42Å; S211-A215 PolarHBondContact O-N 3.46Å
212K71.9Confident68.6Low141 Ų141100.4 Ų100.461%0.61360%0.595SS**Hα-helixtrans-74-36.1175.5-68-179-177.41380111.6D209 A215 A216D209-K212 HydrophobicContact CB-CB 4.01Å; D209-K212 HydrophobicContact CB-CD 4Å; D209-K212 HydrophobicContact CB-CG 3.87Å; D209-K212 WeakPolarHBondContact O-CA 3.21Å; D209-K212 PolarHBondContact O-N 3.22Å; D209-K212 WeakPolarHBondContact OD2-CE 3.33Å; D209-K212 IonicContact OD2-NZ 2.77Å; D209-K212 PolarHBondContact OD2-NZ 2.98Å; K212-A215 PolarHBondContact O-N 2.87Å; K212-A216 WeakPolarHBondContact O-CB 3.46Å; K212-A216 PolarHBondContact O-N 2.73Å
213A73.7Confident71.4Confident43 Ų4398.9 Ų98.936%0.35559%0.591SS.*Hα-helixtrans-64.3-44.7172.800000111.3C208 D209 A216 T217C208-A213 HydrophobicContact CB-CB 4.38Å; D209-A213 PolarHBondContact O-N 3.01Å; A213-A216 PolarHBondContact O-N 2.66Å; A213-T217 WeakPolarHBondContact O-CG2 3.46Å; A213-T217 PolarHBondContact O-N 2.86Å; A213-T217 PolarHBondContact O-OG1 3.14Å
214L73.6Confident73.7Confident112 Ų11295.5 Ų95.559%0.58658%0.578SS**Hα-helixtrans-62.3-40.3173.2-88.3164.4000112.6P210 T217 V218P210-L214 VanDerWaalsContact O-CB 3.29Å; P210-L214 WeakPolarHBondContact O-CB 3.42Å; P210-L214 WeakPolarHBondContact O-CG 3.37Å; P210-L214 PolarHBondContact O-N 3.26Å; L214-T217 WeakPolarHBondContact CA-OG1 3.49Å; L214-T217 PolarHBondContact O-N 3.4Å; L214-T217 PolarHBondContact O-OG1 2.94Å; L214-V218 WeakPolarHBondContact O-CB 3.4Å; L214-V218 VanDerWaalsContact O-CG2 3.25Å; L214-V218 WeakPolarHBondContact O-CG2 3.47Å; L214-V218 PolarHBondContact O-N 3.42Å
215A80.3Confident76.4Confident41 Ų4190.4 Ų90.434%0.33957%0.565SS.*Hα-helixtrans-62.1-47.2175.600000111S211 K212 T217 V218 F219S211-A215 WeakPolarHBondContact O-CB 3.42Å; S211-A215 PolarHBondContact O-N 3.46Å; K212-A215 PolarHBondContact O-N 2.87Å; A215-T217 VanDerWaalsContact C-N 3.34Å; A215-T217 PolarHBondContact O-N 3.11Å; A215-V218 PolarHBondContact O-N 2.97Å; A215-F219 HydrophobicContact CB-CD2 4.47Å; A215-F219 WeakPolarHBondContact O-CD2 3.46Å; A215-F219 PolarHBondContact O-N 3.22Å
216A83.3Confident78.3Confident66 Ų6687.8 Ų87.855%0.54554%0.544SS..Hα-helixtrans-61.7-40.1179.300000112.6K212 A213 G220K212-A216 WeakPolarHBondContact O-CB 3.46Å; K212-A216 PolarHBondContact O-N 2.73Å; A213-A216 PolarHBondContact O-N 2.66Å; A216-G220 PolarHBondContact O-N 2.91Å
217T84.8Confident80.5Confident89 Ų8989.1 Ų89.155%0.54654%0.54SS..Hα-helixtrans-67.6-41177.2570000112.1A213 L214 A215 G220 A221A213-T217 WeakPolarHBondContact O-CG2 3.46Å; A213-T217 PolarHBondContact O-N 2.86Å; A213-T217 PolarHBondContact O-OG1 3.14Å; L214-T217 WeakPolarHBondContact CA-OG1 3.49Å; L214-T217 PolarHBondContact O-N 3.4Å; L214-T217 PolarHBondContact O-OG1 2.94Å; A215-T217 VanDerWaalsContact C-N 3.34Å; A215-T217 PolarHBondContact O-N 3.11Å; T217-G220 PolarHBondContact O-N 3.25Å; T217-A221 WeakPolarHBondContact O-CB 3.48Å; T217-A221 PolarHBondContact O-N 3.21Å
218V89.9Confident82.5Confident85 Ų8587 Ų8752%0.51552%0.521SS..Hα-helixtrans-65.2-47.6177.1173.10000111L214 A215 G220 A221 V222L214-V218 WeakPolarHBondContact O-CB 3.4Å; L214-V218 VanDerWaalsContact O-CG2 3.25Å; L214-V218 WeakPolarHBondContact O-CG2 3.47Å; L214-V218 PolarHBondContact O-N 3.42Å; A215-V218 PolarHBondContact O-N 2.97Å; V218-G220 VanDerWaalsContact C-N 3.34Å; V218-G220 PolarHBondContact O-N 3.46Å; V218-A221 PolarHBondContact O-N 3.36Å; V218-V222 WeakPolarHBondContact O-CG2 3.36Å; V218-V222 PolarHBondContact O-N 3.28Å
219F87.8Confident84Confident146 Ų14687.2 Ų87.264%0.6451%0.514SS*.Hα-helixtrans-63.9-39.6178.1-79.7-68.5000112.2A215 V222 L223A215-F219 HydrophobicContact CB-CD2 4.47Å; A215-F219 WeakPolarHBondContact O-CD2 3.46Å; A215-F219 PolarHBondContact O-N 3.22Å; F219-V222 PolarHBondContact O-N 3.05Å; F219-L223 WeakPolarHBondContact O-CG 3.37Å; F219-L223 PolarHBondContact O-N 2.94Å
220G90.8Very high85Confident31 Ų3186.3 Ų86.332%0.3252%0.518SS..Hα-helixtrans-62-43.3174.700000112.8A216 T217 V218 L223 L224A216-G220 PolarHBondContact O-N 2.91Å; T217-G220 PolarHBondContact O-N 3.25Å; V218-G220 VanDerWaalsContact C-N 3.34Å; V218-G220 PolarHBondContact O-N 3.46Å; G220-L223 PolarHBondContact O-N 2.85Å; G220-L224 PolarHBondContact O-N 3.32Å
221A92Very high86.1Confident53 Ų5386.3 Ų86.344%0.43851%0.512SS..Hα-helixtrans-63.5-41.9177.100000112.2T217 V218 L224 M225T217-A221 WeakPolarHBondContact O-CB 3.48Å; T217-A221 PolarHBondContact O-N 3.21Å; V218-A221 PolarHBondContact O-N 3.36Å; A221-L224 PolarHBondContact O-N 3.13Å; A221-M225 WeakPolarHBondContact O-CG 3.34Å; A221-M225 PolarHBondContact O-N 3.29Å
222V93.4Very high86.9Confident90 Ų9085.4 Ų85.455%0.54551%0.505SS..Hα-helixtrans-63.9-42.4177.3173.30000111.3V218 F219 M225 A226V218-V222 WeakPolarHBondContact O-CG2 3.36Å; V218-V222 PolarHBondContact O-N 3.28Å; F219-V222 PolarHBondContact O-N 3.05Å; V222-M225 PolarHBondContact O-N 2.77Å; V222-A226 PolarHBondContact O-N 3.32Å
223L92.6Very high87.4Confident117 Ų11783.6 Ų83.661%0.61351%0.505SS*.Hα-helixtrans-63.5-42.5176.7-75.7169000112F219 G220 M225 A226 V227F219-L223 WeakPolarHBondContact O-CG 3.37Å; F219-L223 PolarHBondContact O-N 2.94Å; G220-L223 PolarHBondContact O-N 2.85Å; L223-M225 VanDerWaalsContact C-N 3.35Å; L223-M225 PolarHBondContact O-N 3.19Å; L223-A226 PolarHBondContact O-N 3.43Å; L223-V227 WeakPolarHBondContact O-CG2 3.4Å; L223-V227 PolarHBondContact O-N 3.39Å
224L93.1Very high87.6Confident114 Ų11484.7 Ų84.760%0.59751%0.514SS*.Hα-helixtrans-61-44.1175.7-84.2163.9000111.8G220 A221 A226 V227 I228G220-L224 PolarHBondContact O-N 3.32Å; A221-L224 PolarHBondContact O-N 3.13Å; L224-A226 VanDerWaalsContact C-N 3.33Å; L224-A226 PolarHBondContact O-N 2.94Å; L224-V227 PolarHBondContact O-N 3.12Å; L224-I228 VanDerWaalsContact O-CG1 3.29Å; L224-I228 WeakPolarHBondContact O-CG1 2.94Å; L224-I228 PolarHBondContact O-N 2.85Å
225M91.9Very high87.5Confident111 Ų11185.7 Ų85.755%0.54752%0.52SS..Hα-helixtrans-62.9-40.1176.1-70.9-60.3-6700112A221 V222 L223 I228 L229A221-M225 WeakPolarHBondContact O-CG 3.34Å; A221-M225 PolarHBondContact O-N 3.29Å; V222-M225 PolarHBondContact O-N 2.77Å; L223-M225 VanDerWaalsContact C-N 3.35Å; L223-M225 PolarHBondContact O-N 3.19Å; M225-I228 PolarHBondContact O-N 2.96Å; M225-I228 HydrophobicContact SD-CD1 4.5Å; M225-L229 WeakPolarHBondContact O-CB 3.48Å; M225-L229 VanDerWaalsContact O-CG 3.29Å; M225-L229 WeakPolarHBondContact O-CG 3.49Å; M225-L229 PolarHBondContact O-N 2.78Å
226A91.3Very high86.7Confident55 Ų5591.2 Ų91.246%0.45554%0.544SS..Hα-helixtrans-63.1-41.4175.700000112.2V222 L223 L224 L229 A230V222-A226 PolarHBondContact O-N 3.32Å; L223-A226 PolarHBondContact O-N 3.43Å; L224-A226 VanDerWaalsContact C-N 3.33Å; L224-A226 PolarHBondContact O-N 2.94Å; A226-L229 PolarHBondContact O-N 2.72Å; A226-A230 WeakPolarHBondContact O-CB 3.3Å; A226-A230 PolarHBondContact O-N 3.46Å
227V92.2Very high85.3Confident83 Ų8395.4 Ų95.450%0.50357%0.569SS.*Hα-helixtrans-65.7-43.4176.6172.80000111.2L223 L224 L229 A230 L231L223-V227 WeakPolarHBondContact O-CG2 3.4Å; L223-V227 PolarHBondContact O-N 3.39Å; L224-V227 PolarHBondContact O-N 3.12Å; V227-L229 PolarHBondContact O-N 2.94Å; V227-A230 PolarHBondContact O-N 3.4Å; V227-L231 HydrophobicContact CG1-CD1 4.1Å; V227-L231 HydrophobicContact CG1-CG 4.47Å; V227-L231 WeakPolarHBondContact O-CG 3.14Å; V227-L231 PolarHBondContact O-N 2.85Å
228I91.4Very high85.3Confident87 Ų8795.8 Ų95.845%0.44657%0.57SS.*Hα-helixtrans-61.2-46.1176.5-67.6164.8000110.3L224 M225 A230 L231 C232L224-I228 VanDerWaalsContact O-CG1 3.29Å; L224-I228 WeakPolarHBondContact O-CG1 2.94Å; L224-I228 PolarHBondContact O-N 2.85Å; M225-I228 PolarHBondContact O-N 2.96Å; M225-I228 HydrophobicContact SD-CD1 4.5Å; I228-A230 VanDerWaalsContact C-N 3.34Å; I228-A230 PolarHBondContact O-N 2.87Å; I228-L231 PolarHBondContact O-N 3.32Å; I228-C232 PolarHBondContact O-N 3.4Å; I228-C232 PolarHBondContact O-SG 2.92Å
229L88.9Confident85Confident111 Ų11196.3 Ų96.358%0.58157%0.573SS**Hα-helixtrans-61.2-41.9176.9-72.5170.8000111.9M225 A226 V227 L231 C232 V233M225-L229 WeakPolarHBondContact O-CB 3.48Å; M225-L229 VanDerWaalsContact O-CG 3.29Å; M225-L229 WeakPolarHBondContact O-CG 3.49Å; M225-L229 PolarHBondContact O-N 2.78Å; A226-L229 PolarHBondContact O-N 2.72Å; V227-L229 PolarHBondContact O-N 2.94Å; L229-L231 VanDerWaalsContact C-N 3.34Å; L229-L231 PolarHBondContact O-N 3.02Å; L229-C232 PolarHBondContact O-N 3.26Å; L229-V233 VanDerWaalsContact O-CG2 3.31Å; L229-V233 WeakPolarHBondContact O-CG2 3.45Å; L229-V233 PolarHBondContact O-N 3.35Å
230A87.9Confident84.9Confident61 Ų6193.6 Ų93.650%0.50457%0.569SS.*Hα-helixtrans-62.3-41.1175.900000112A226 V227 I228 V233 A234A226-A230 WeakPolarHBondContact O-CB 3.3Å; A226-A230 PolarHBondContact O-N 3.46Å; V227-A230 PolarHBondContact O-N 3.4Å; I228-A230 VanDerWaalsContact C-N 3.34Å; I228-A230 PolarHBondContact O-N 2.87Å; A230-V233 PolarHBondContact O-N 3.39Å; A230-A234 WeakPolarHBondContact O-CB 3.12Å; A230-A234 PolarHBondContact O-N 2.91Å
231L88.1Confident84.5Confident98 Ų9897.2 Ų97.251%0.51358%0.584SS.*Hα-helixtrans-68.3-37.5175.5-70.1173.3000112.2V227 I228 L229 A234 N235V227-L231 HydrophobicContact CG1-CD1 4.1Å; V227-L231 HydrophobicContact CG1-CG 4.47Å; V227-L231 WeakPolarHBondContact O-CG 3.14Å; V227-L231 PolarHBondContact O-N 2.85Å; I228-L231 PolarHBondContact O-N 3.32Å; L229-L231 VanDerWaalsContact C-N 3.34Å; L229-L231 PolarHBondContact O-N 3.02Å; L231-A234 PolarHBondContact O-N 2.84Å; L231-N235 WeakPolarHBondContact O-CB 3.49Å; L231-N235 PolarHBondContact O-N 3.21Å; L231-N235 PolarHBondContact O-ND2 2.83Å
232C85.2Confident84.1Confident60 Ų60100 Ų10041%0.40559%0.593SS.*Hα-helixtrans-64.5-43.1174.2-70.20000111.3I228 L229 N235 L236I228-C232 PolarHBondContact O-N 3.4Å; I228-C232 PolarHBondContact O-SG 2.92Å; L229-C232 PolarHBondContact O-N 3.26Å; C232-N235 PolarHBondContact O-N 3.33Å; C232-L236 VanDerWaalsContact O-CB 3.29Å; C232-L236 WeakPolarHBondContact O-CB 3.27Å; C232-L236 WeakPolarHBondContact O-CD1 3.36Å; C232-L236 WeakPolarHBondContact O-CG 3.49Å; C232-L236 PolarHBondContact O-N 2.76Å
233V83.4Confident83.4Confident102 Ų102100.7 Ų100.762%0.61860%0.596SS**Hα-helixtrans-64.7-40.3176172.20000111.2L229 A230 N235 L236 S237L229-V233 VanDerWaalsContact O-CG2 3.31Å; L229-V233 WeakPolarHBondContact O-CG2 3.45Å; L229-V233 PolarHBondContact O-N 3.35Å; A230-V233 PolarHBondContact O-N 3.39Å; V233-N235 VanDerWaalsContact C-N 3.33Å; V233-N235 PolarHBondContact O-N 2.88Å; V233-L236 PolarHBondContact O-N 3.15Å; V233-S237 PolarHBondContact O-N 2.93Å; V233-S237 VanDerWaalsContact O-N 3.15Å
234A78.3Confident82.8Confident66 Ų6699.5 Ų99.555%0.54560%0.595SS.*Hα-helixtrans-70-25.8177.600000114A230 L231A230-A234 WeakPolarHBondContact O-CB 3.12Å; A230-A234 PolarHBondContact O-N 2.91Å; L231-A234 PolarHBondContact O-N 2.84Å
235N71.4Confident82Confident133 Ų13398.4 Ų98.471%0.71160%0.595SS**Hα-helixtrans-93.2-10.1176.3-76.5-73.5000113.6L231 C232 V233L231-N235 WeakPolarHBondContact O-CB 3.49Å; L231-N235 PolarHBondContact O-N 3.21Å; L231-N235 PolarHBondContact O-ND2 2.83Å; C232-N235 PolarHBondContact O-N 3.33Å; V233-N235 VanDerWaalsContact C-N 3.33Å; V233-N235 PolarHBondContact O-N 2.88Å
236L62.6Low81.2Confident158 Ų15897.3 Ų97.383%0.82760%0.599SS**Hα-helixtrans-103.5-5175.9-75162.9000113.1C232 V233C232-L236 VanDerWaalsContact O-CB 3.29Å; C232-L236 WeakPolarHBondContact O-CB 3.27Å; C232-L236 WeakPolarHBondContact O-CD1 3.36Å; C232-L236 WeakPolarHBondContact O-CG 3.49Å; C232-L236 PolarHBondContact O-N 2.76Å; V233-L236 PolarHBondContact O-N 3.15Å
237S53.3Low80.2Confident154 Ų154101.2 Ų101.2100%1.07761%0.612SS**  trans-97.80169.3-175.70000111.3V233V233-S237 PolarHBondContact O-N 2.93Å; V233-S237 VanDerWaalsContact O-N 3.15Å

Retrieved 237 of 237 residues in 105.9 ms (Link to these results)

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