A0A087WZH1_HUMAN Loading...

Olfactory receptor family 8 subfamily H member 2

AlphaFold DB , UniProt , Accession A0A087WZH1, Species HUMAN (Homo sapiens, Human), Gene OR8H2, Length 311 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
1M36.2Very low45.4Very low253 Ų253144.9 Ų144.9100%1.24677%0.765SS**  090.70-76.4172.2173.300108.3
2G34Very low48.4Very low79 Ų79133.5 Ų133.581%0.81470%0.704SS**  trans-84.9121.3176.500000109.6R4G2-R4 PolarHBondContact O-N 3.37Å; G2-R4 VanDerWaalsContact O-N 3.15Å
3R33.5Very low50.9Low229 Ų229126.2 Ų126.286%0.86467%0.665SS**  trans-56.2110.1-179.1-166.8173176.8174.9-1.7109.9N5R3-N5 VanDerWaalsContact C-N 3.35Å; R3-N5 PolarHBondContact O-N 3.26Å
4R37Very low53Low238 Ų238117.2 Ų117.290%0.89862%0.618SS**  trans-67.493.2170.2-153.6177.7-166.9176.32.8106.7G2 N6G2-R4 PolarHBondContact O-N 3.37Å; G2-R4 VanDerWaalsContact O-N 3.15Å; R4-N6 PolarHBondContact O-N 3.02Å
5N34.7Very low54.3Low123 Ų123113.9 Ų113.966%0.65860%0.599SS**  trans-67.1117.9167.7-94.3-4.9000106.9R3 T7R3-N5 VanDerWaalsContact C-N 3.35Å; R3-N5 PolarHBondContact O-N 3.26Å; N5-T7 PolarHBondContact O-N 2.92Å
6N42.9Very low55.2Low156 Ų156108.1 Ų108.183%0.83458%0.575SS**  trans-54.7103.4164.3-86.1-8.5000107.5R4 N8R4-N6 PolarHBondContact O-N 3.02Å; N6-N8 PolarHBondContact O-N 3.36Å
7T41Very low55.9Low123 Ų123103.8 Ų103.876%0.75555%0.552SS**  trans-67.6113.4171.538.20000107.4N5 V9N5-T7 PolarHBondContact O-N 2.92Å; T7-V9 PolarHBondContact O-N 3Å; T7-V9 VanDerWaalsContact O-N 3.1Å
8N45.5Very low56.8Low160 Ų16099.9 Ų99.986%0.85653%0.533SS*.PPolyproline II helixtrans-47.8118.4156-79.4-24.1000106.3N6 A10N6-N8 PolarHBondContact O-N 3.36Å; N8-A10 PolarHBondContact O-N 3.41Å; N8-A10 VanDerWaalsContact O-N 3.1Å
9V54.3Low57.5Low89 Ų89102.8 Ų102.854%0.53955%0.547SS..PPolyproline II helixtrans-57.8120.4-178.3-171.80000107.7T7 D11 F93T7-V9 PolarHBondContact O-N 3Å; T7-V9 VanDerWaalsContact O-N 3.1Å; V9-D11 PolarHBondContact O-N 3.04Å; V9-F93 HydrophobicContact CB-CB 4.09Å; V9-F93 HydrophobicContact CB-CG 4.32Å; V9-F93 HydrophobicContact CG1-CB 3.5Å; V9-F93 HydrophobicContact CG1-CD1 4.29Å; V9-F93 HydrophobicContact CG1-CD2 3.43Å; V9-F93 VanDerWaalsContact CG1-CD2 3.43Å; V9-F93 HydrophobicContact CG1-CE2 4.17Å; V9-F93 HydrophobicContact CG1-CG 3.49Å; V9-F93 VanDerWaalsContact CG1-CG 3.49Å
10A62.3Low58.5Low62 Ų62100 Ų10051%0.51254%0.536SS..PPolyproline II helixtrans-60134.4-176.300000110.1N8N8-A10 PolarHBondContact O-N 3.41Å; N8-A10 VanDerWaalsContact O-N 3.1Å
11D77.6Confident59.4Low82 Ų82102.8 Ų102.844%0.43955%0.546SS..PPolyproline II helixtrans-59140.1171.6-69.1-33.3000109.7V9 Y90 S92 N171V9-D11 PolarHBondContact O-N 3.04Å; D11-Y90 HydrophobicContact CB-CD1 4.32Å; D11-S92 VanDerWaalsContact OD1-CA 3.29Å; D11-S92 WeakPolarHBondContact OD1-CA 3.38Å; D11-N171 WeakPolarHBondContact O-CB 3.42Å; D11-N171 PolarHBondContact O-ND2 2.78Å
12F81.8Confident61.5Low8 Ų898.7 Ų98.74%0.03552%0.524CS..EExtended strand (participates in β ladder)trans-81.5147.4175.1-66.7-69.2000111.1Y90 I91 F93 C96 N171 I173 I183F12-Y90 CarbonylContact O-C 3.16Å; F12-Y90 VanDerWaalsContact O-CA 3.29Å; F12-Y90 WeakPolarHBondContact O-CA 3.45Å; F12-I91 HydrophobicContact CB-CG2 3.82Å; F12-I91 PolarHBondContact N-O 3.48Å; F12-I91 PolarHBondContact O-N 3.28Å; F12-F93 HydrophobicContact CE2-CB 4.22Å; F12-F93 AromaticContact CE2-CD2 3.53Å; F12-F93 HydrophobicContact CE2-CD2 3.53Å; F12-F93 HydrophobicContact CE2-CE2 4.35Å; F12-F93 HydrophobicContact CE2-CG 4.25Å; F12-F93 AromaticContact CZ-CD2 3.82Å; F12-F93 HydrophobicContact CZ-CD2 3.82Å; F12-F93 HydrophobicContact CZ-CE2 4.36Å; F12-C96 HydrophobicContact CD2-CB 3.92Å; F12-C96 HydrophobicContact CE2-CB 4.25Å; F12-N171 CarbonylContact C-O 3.59Å; F12-N171 VanDerWaalsContact CA-O 3.3Å; F12-N171 WeakPolarHBondContact CA-O 3.29Å; F12-N171 HydrophobicContact CD1-CB 4.5Å; F12-I173 HydrophobicContact CB-CD1 3.59Å; F12-I173 HydrophobicContact CB-CG1 4.24Å; F12-I173 HydrophobicContact CD1-CD1 3.93Å; F12-I173 HydrophobicContact CD1-CG1 4.13Å; F12-I173 HydrophobicContact CD2-CD1 4.27Å; F12-I173 HydrophobicContact CG-CD1 3.7Å; F12-I173 HydrophobicContact CG-CG1 4.35Å; F12-I183 HydrophobicContact CZ-CD1 4.46Å
13I81.1Confident63.7Low39 Ų3999 Ų9920%0.251%0.506CS..EExtended strand (participates in β ladder)trans-107.5113.4176-55.9174.2000108N89 Y90 N171 V172 I173I13-N89 HydrophobicContact CG2-CB 4.38Å; I13-Y90 HydrophobicContact CD1-CE1 3.77Å; I13-Y90 HydrophobicContact CG1-CD1 3.76Å; I13-Y90 HydrophobicContact CG1-CE1 3.49Å; I13-Y90 VanDerWaalsContact CG1-CE1 3.49Å; I13-N171 PolarHBondContact N-O 3.43Å; I13-V172 HydrophobicContact CB-CG2 4.4Å; I13-V172 HydrophobicContact CD1-CG2 4.37Å; I13-I173 PolarHBondContact O-N 3.09Å
14L79.9Confident66Low0 Ų090.3 Ų90.30%048%0.475CS..EExtended strand (participates in β ladder)trans-83.9113.1175.8-65.5168.7000109.6G16 N84 N89 I91 I173 H175L14-G16 PolarHBondContact O-N 3.34Å; L14-N84 VanDerWaalsContact CD1-ND2 3.26Å; L14-N84 WeakPolarHBondContact CD1-ND2 3.41Å; L14-N89 PolarHBondContact N-O 3.26Å; L14-N89 WeakPolarHBondContact O-CB 3.5Å; L14-I91 HydrophobicContact CD1-CB 4.07Å; L14-I91 HydrophobicContact CD1-CD1 4.44Å; L14-I91 HydrophobicContact CD1-CG2 3.79Å; L14-I91 HydrophobicContact CD2-CG2 4.28Å; L14-I91 HydrophobicContact CG-CG2 3.84Å; L14-I173 HydrophobicContact CD2-CB 4.03Å; L14-I173 HydrophobicContact CD2-CD1 3.95Å; L14-I173 HydrophobicContact CD2-CG2 3.99Å; L14-H175 WeakPolarHBondContact CB-O 3.19Å; L14-H175 WeakPolarHBondContact CD2-O 3.47Å
15M72.1Confident68.2Low68 Ų6884.1 Ų84.134%0.33546%0.458SS..  trans-68.1108.1168-75.5-86.1-77.600108.2V172 I173 H175 F176M15-V172 HydrophobicContact CG-CG1 3.74Å; M15-I173 PolarHBondContact N-O 2.96Å; M15-H175 CarbonylContact O-C 3.54Å; M15-F176 PolarHBondContact O-N 3.42Å
16G68.8Low70.5Confident21 Ų2181.1 Ų81.122%0.21645%0.45CS..  trans-59.1179.7174.900000113.2L14 T18L14-G16 PolarHBondContact O-N 3.34Å; G16-T18 VanDerWaalsContact C-N 3.31Å; G16-T18 PolarHBondContact O-N 2.93Å
17L68.5Low72.4Confident35 Ų3575.3 Ų75.318%0.18342%0.419CS..SBendtrans-71.3-21-173.4-68.8172.3000114.6L27 F31 F176 Q271 V275L17-L27 HydrophobicContact CB-CD1 3.87Å; L17-L27 HydrophobicContact CD1-CD1 4.09Å; L17-F31 HydrophobicContact CD1-CE2 3.36Å; L17-F31 HydrophobicContact CD1-CZ 3.41Å; L17-F31 VanDerWaalsContact CD1-CZ 3.41Å; L17-F176 HydrophobicContact CD2-CB 4.3Å; L17-F176 HydrophobicContact CD2-CD1 3.42Å; L17-F176 VanDerWaalsContact CD2-CD1 3.42Å; L17-F176 HydrophobicContact CD2-CE1 3.91Å; L17-F176 HydrophobicContact CD2-CG 4.08Å; L17-F176 HydrophobicContact CG-CB 4.15Å; L17-F176 HydrophobicContact CG-CD1 4.07Å; L17-F176 HydrophobicContact CG-CG 4.24Å; L17-Q271 HydrophobicContact CD2-CB 3.78Å; L17-V275 HydrophobicContact CD1-CG2 3.9Å; L17-V275 HydrophobicContact CD2-CG2 4.11Å
18T70.4Confident74.6Confident33 Ų3371.1 Ų71.120%0.20239%0.39CS..  trans-161.1153.2-176.2-176.30000110.9G16 S20 I23 Q24 L27G16-T18 VanDerWaalsContact C-N 3.31Å; G16-T18 PolarHBondContact O-N 2.93Å; T18-S20 PolarHBondContact OG1-N 2.82Å; T18-I23 HydrophobicContact CG2-CB 3.81Å; T18-I23 HydrophobicContact CG2-CG2 3.72Å; T18-Q24 HydrophobicContact CG2-CG 3.61Å; T18-Q24 PolarHBondContact O-NE2 3.02Å; T18-L27 HydrophobicContact CG2-CD1 3.88Å
19L70Confident76.6Confident155 Ų15569 Ų6981%0.81238%0.377SS*.SBendtrans-94.8-8.2174.6-65169.9000112.7
20S78.1Confident78Confident47 Ų4768.9 Ų68.933%0.32937%0.373SS..  trans-85.4120179.2170.30000110.9T18 E22 I23 Q24T18-S20 PolarHBondContact OG1-N 2.82Å; S20-E22 VanDerWaalsContact C-N 3.32Å; S20-E22 PolarHBondContact O-N 3.24Å; S20-I23 PolarHBondContact O-N 2.93Å; S20-I23 VanDerWaalsContact O-N 3.16Å; S20-Q24 WeakPolarHBondContact O-CG 3.47Å; S20-Q24 PolarHBondContact O-N 2.81Å
21E78.6Confident79.1Confident158 Ų15866.1 Ų66.174%0.73835%0.349SS*.Hα-helixtrans-57.8-41.2-179.5-65.8-176.1172.900112.7I23 Q24 M25E21-I23 VanDerWaalsContact C-N 3.33Å; E21-I23 PolarHBondContact O-N 3.12Å; E21-Q24 PolarHBondContact O-N 3.2Å; E21-M25 PolarHBondContact O-N 3.18Å
22E80.1Confident79.7Confident167 Ų16764.8 Ų64.878%0.7834%0.342SS*.Hα-helixtrans-61.4-42177.5-64.8-177.317800111.7S20 A26S20-E22 VanDerWaalsContact C-N 3.32Å; S20-E22 PolarHBondContact O-N 3.24Å; E22-A26 PolarHBondContact O-N 3.13Å
23I79.5Confident79.9Confident87 Ų8769.2 Ų69.245%0.44637%0.365SS..Hα-helixtrans-72.3-35.4178.2-55.7178.2000110.5T18 S20 E21 M25 A26 L27T18-I23 HydrophobicContact CG2-CB 3.81Å; T18-I23 HydrophobicContact CG2-CG2 3.72Å; S20-I23 PolarHBondContact O-N 2.93Å; S20-I23 VanDerWaalsContact O-N 3.16Å; E21-I23 VanDerWaalsContact C-N 3.33Å; E21-I23 PolarHBondContact O-N 3.12Å; I23-M25 PolarHBondContact O-N 3.49Å; I23-A26 PolarHBondContact O-N 3.24Å; I23-L27 HydrophobicContact CG2-CD1 3.99Å; I23-L27 HydrophobicContact CG2-CG 4.22Å; I23-L27 WeakPolarHBondContact O-CB 3.34Å; I23-L27 VanDerWaalsContact O-CG 3.28Å; I23-L27 WeakPolarHBondContact O-CG 3.43Å; I23-L27 PolarHBondContact O-N 3.22Å
24Q81.3Confident80.1Confident45 Ų4568.8 Ų68.821%0.2136%0.363CS..Hα-helixtrans-60.5-44.5175.5-72.9179.5-12.200111.7T18 S20 E21 L27 F28 L85T18-Q24 HydrophobicContact CG2-CG 3.61Å; T18-Q24 PolarHBondContact O-NE2 3.02Å; S20-Q24 WeakPolarHBondContact O-CG 3.47Å; S20-Q24 PolarHBondContact O-N 2.81Å; E21-Q24 PolarHBondContact O-N 3.2Å; Q24-L27 PolarHBondContact O-N 3.46Å; Q24-F28 WeakPolarHBondContact O-CB 3.48Å; Q24-F28 PolarHBondContact O-N 3.11Å; Q24-L85 HydrophobicContact CB-CD2 4.26Å; Q24-L85 HydrophobicContact CG-CD2 4.16Å
25M82.9Confident80.5Confident108 Ų10871 Ų7153%0.53237%0.372SS..Hα-helixtrans-63.5-41.9177-72.7-63.7-71.500112.1E21 I23 F28 M29 L86E21-M25 PolarHBondContact O-N 3.18Å; I23-M25 PolarHBondContact O-N 3.49Å; M25-F28 PolarHBondContact O-N 3.16Å; M25-M29 WeakPolarHBondContact O-CG 3.11Å; M25-M29 PolarHBondContact O-N 2.85Å; M25-M29 VanDerWaalsContact O-N 3.08Å; M25-L86 HydrophobicContact SD-CD2 4.31Å
26A83.7Confident81.3Confident61 Ų6172.4 Ų72.450%0.50438%0.38SS..Hα-helixtrans-62.7-44.6175.200000112.2E22 I23 M29 L30E22-A26 PolarHBondContact O-N 3.13Å; I23-A26 PolarHBondContact O-N 3.24Å; A26-M29 PolarHBondContact O-N 3.09Å; A26-L30 WeakPolarHBondContact O-CB 3.48Å; A26-L30 PolarHBondContact O-N 2.99Å
27L83Confident82.2Confident34 Ų3475.2 Ų75.218%0.17839%0.389CS..Hα-helixtrans-64.9-38.5176.7-72.3173.2000112.1L17 T18 I23 Q24 L30 F31 L85L17-L27 HydrophobicContact CB-CD1 3.87Å; L17-L27 HydrophobicContact CD1-CD1 4.09Å; T18-L27 HydrophobicContact CG2-CD1 3.88Å; I23-L27 HydrophobicContact CG2-CD1 3.99Å; I23-L27 HydrophobicContact CG2-CG 4.22Å; I23-L27 WeakPolarHBondContact O-CB 3.34Å; I23-L27 VanDerWaalsContact O-CG 3.28Å; I23-L27 WeakPolarHBondContact O-CG 3.43Å; I23-L27 PolarHBondContact O-N 3.22Å; Q24-L27 PolarHBondContact O-N 3.46Å; L27-L30 PolarHBondContact O-N 3.11Å; L27-F31 HydrophobicContact CD2-CZ 4.26Å; L27-F31 WeakPolarHBondContact O-CB 3.46Å; L27-F31 VanDerWaalsContact O-CG 3.3Å; L27-F31 WeakPolarHBondContact O-CG 3.4Å; L27-F31 PolarHBondContact O-N 2.8Å; L27-L85 HydrophobicContact CB-CD1 4.15Å; L27-L85 HydrophobicContact CB-CD2 4.49Å
28F86.6Confident83Confident34 Ų3473.6 Ų73.615%0.14938%0.381CS..Hα-helixtrans-59.5-51.5176173.5-93.3000110.7Q24 M25 L30 F31 L32 L82 L85 L86Q24-F28 WeakPolarHBondContact O-CB 3.48Å; Q24-F28 PolarHBondContact O-N 3.11Å; M25-F28 PolarHBondContact O-N 3.16Å; F28-L30 VanDerWaalsContact C-N 3.32Å; F28-L30 PolarHBondContact O-N 3.25Å; F28-F31 PolarHBondContact O-N 3.32Å; F28-L32 HydrophobicContact CE1-CD2 3.97Å; F28-L32 HydrophobicContact CZ-CD2 4.16Å; F28-L32 WeakPolarHBondContact O-CB 3.5Å; F28-L32 PolarHBondContact O-N 2.87Å; F28-L82 HydrophobicContact CD2-CB 4.21Å; F28-L82 HydrophobicContact CD2-CD2 3.58Å; F28-L82 HydrophobicContact CE2-CB 3.98Å; F28-L82 HydrophobicContact CE2-CD2 3.79Å; F28-L82 HydrophobicContact CE2-CG 4.41Å; F28-L82 HydrophobicContact CG-CD2 4.28Å; F28-L82 WeakPolarHBondContact O-CD2 3.3Å; F28-L85 HydrophobicContact CB-CB 4.3Å; F28-L85 HydrophobicContact CB-CD1 4.15Å; F28-L85 HydrophobicContact CD2-CB 4.45Å; F28-L86 HydrophobicContact CD1-CD2 4.41Å; F28-L86 HydrophobicContact CD2-CD1 3.87Å; F28-L86 HydrophobicContact CD2-CD2 3.92Å; F28-L86 HydrophobicContact CD2-CG 3.66Å; F28-L86 HydrophobicContact CE1-CD1 4.46Å; F28-L86 HydrophobicContact CE2-CD1 3.27Å; F28-L86 HydrophobicContact CE2-CD2 4.13Å; F28-L86 HydrophobicContact CE2-CG 3.64Å; F28-L86 HydrophobicContact CG-CD2 4.08Å; F28-L86 HydrophobicContact CG-CG 4.33Å; F28-L86 HydrophobicContact CZ-CD1 3.63Å; F28-L86 HydrophobicContact CZ-CD2 4.46Å; F28-L86 HydrophobicContact CZ-CG 4.29Å
29M87.3Confident83.9Confident117 Ų11774.3 Ų74.358%0.57638%0.383SS*.Hα-helixtrans-61.9-41.5179.1-67.3-58.6-70.800111.8M25 A26 L33M25-M29 WeakPolarHBondContact O-CG 3.11Å; M25-M29 PolarHBondContact O-N 2.85Å; M25-M29 VanDerWaalsContact O-N 3.08Å; A26-M29 PolarHBondContact O-N 3.09Å; M29-L33 WeakPolarHBondContact O-CB 3.46Å; M29-L33 PolarHBondContact O-N 3.06Å
30L85.6Confident84.8Confident86 Ų8673.3 Ų73.345%0.4538%0.377SS..Hα-helixtrans-62.1-50.6177.1178.262.8000111.9A26 L27 F28 L33 I34A26-L30 WeakPolarHBondContact O-CB 3.48Å; A26-L30 PolarHBondContact O-N 2.99Å; L27-L30 PolarHBondContact O-N 3.11Å; F28-L30 VanDerWaalsContact C-N 3.32Å; F28-L30 PolarHBondContact O-N 3.25Å; L30-L33 PolarHBondContact O-N 2.93Å; L30-I34 HydrophobicContact CD1-CD1 4.02Å; L30-I34 HydrophobicContact CD1-CG1 4.5Å; L30-I34 HydrophobicContact CG-CD1 3.99Å; L30-I34 VanDerWaalsContact O-CG1 3.3Å; L30-I34 WeakPolarHBondContact O-CG1 3.37Å; L30-I34 PolarHBondContact O-N 3.37Å
31F84.7Confident85.3Confident3 Ų372.4 Ų72.41%0.01338%0.375CS..Hα-helixtrans-68.9-33.9-179.2-68.5-14000112.7L17 L27 F28 I34 Y35 T81 L82 L85 V275 I279L17-F31 HydrophobicContact CD1-CE2 3.36Å; L17-F31 HydrophobicContact CD1-CZ 3.41Å; L17-F31 VanDerWaalsContact CD1-CZ 3.41Å; L27-F31 HydrophobicContact CD2-CZ 4.26Å; L27-F31 WeakPolarHBondContact O-CB 3.46Å; L27-F31 VanDerWaalsContact O-CG 3.3Å; L27-F31 WeakPolarHBondContact O-CG 3.4Å; L27-F31 PolarHBondContact O-N 2.8Å; F28-F31 PolarHBondContact O-N 3.32Å; F31-I34 HydrophobicContact CD1-CD1 4.41Å; F31-I34 PolarHBondContact O-N 3.45Å; F31-Y35 VanDerWaalsContact O-CB 3.27Å; F31-Y35 WeakPolarHBondContact O-CB 3.23Å; F31-Y35 PolarHBondContact O-N 2.84Å; F31-T81 HydrophobicContact CD2-CG2 3.93Å; F31-T81 HydrophobicContact CE2-CG2 3.93Å; F31-L82 HydrophobicContact CB-CD2 3.71Å; F31-L85 HydrophobicContact CD2-CD1 3.88Å; F31-L85 HydrophobicContact CE2-CD1 4.28Å; F31-V275 HydrophobicContact CE1-CG1 3.59Å; F31-V275 HydrophobicContact CE1-CG2 4.32Å; F31-V275 HydrophobicContact CZ-CB 4.46Å; F31-V275 HydrophobicContact CZ-CG1 3.85Å; F31-V275 HydrophobicContact CZ-CG2 3.69Å; F31-I279 HydrophobicContact CD1-CD1 3.99Å; F31-I279 HydrophobicContact CD1-CG2 4.22Å; F31-I279 HydrophobicContact CD2-CD1 4.14Å; F31-I279 HydrophobicContact CE1-CD1 3.91Å; F31-I279 HydrophobicContact CE2-CD1 4.03Å; F31-I279 HydrophobicContact CG-CD1 4.12Å; F31-I279 HydrophobicContact CZ-CD1 3.92Å
32L88.9Confident85.8Confident55 Ų5564.9 Ų64.929%0.28834%0.34SS..Hα-helixtrans-64.4-46.4174179.163.3000110.5F28 I34 Y35 L36 L82F28-L32 HydrophobicContact CE1-CD2 3.97Å; F28-L32 HydrophobicContact CZ-CD2 4.16Å; F28-L32 WeakPolarHBondContact O-CB 3.5Å; F28-L32 PolarHBondContact O-N 2.87Å; L32-I34 VanDerWaalsContact C-N 3.35Å; L32-I34 PolarHBondContact O-N 3.37Å; L32-Y35 PolarHBondContact O-N 3.41Å; L32-L36 HydrophobicContact CD1-CD1 4.33Å; L32-L36 HydrophobicContact CD1-CG 4.35Å; L32-L36 HydrophobicContact CG-CD1 4.2Å; L32-L36 VanDerWaalsContact O-CG 3.3Å; L32-L36 WeakPolarHBondContact O-CG 3.29Å; L32-L36 PolarHBondContact O-N 3.43Å; L32-L82 HydrophobicContact CB-CD1 4.47Å; L32-L82 HydrophobicContact CB-CD2 4.15Å; L32-L82 HydrophobicContact CD1-CD1 4.16Å
33L87.9Confident86.4Confident101 Ų10160.5 Ų60.553%0.52933%0.325SS..Hα-helixtrans-59.4-47.8176.4177.562.8000111M29 L30 Y35 L36 I37M29-L33 WeakPolarHBondContact O-CB 3.46Å; M29-L33 PolarHBondContact O-N 3.06Å; L30-L33 PolarHBondContact O-N 2.93Å; L33-Y35 VanDerWaalsContact C-N 3.35Å; L33-Y35 PolarHBondContact O-N 3.09Å; L33-L36 PolarHBondContact O-N 2.62Å; L33-I37 HydrophobicContact CD1-CD1 3.89Å; L33-I37 HydrophobicContact CD1-CG1 4.29Å; L33-I37 HydrophobicContact CG-CD1 3.86Å; L33-I37 VanDerWaalsContact O-CG1 3.28Å; L33-I37 WeakPolarHBondContact O-CG1 3.48Å; L33-I37 PolarHBondContact O-N 2.91Å
34I84.4Confident86.9Confident30 Ų3057.4 Ų57.415%0.15431%0.314CS..Hα-helixtrans-57.7-49.2177-73167.7000110.6L30 F31 L32 L36 I37 T38 I279 V283L30-I34 HydrophobicContact CD1-CD1 4.02Å; L30-I34 HydrophobicContact CD1-CG1 4.5Å; L30-I34 HydrophobicContact CG-CD1 3.99Å; L30-I34 VanDerWaalsContact O-CG1 3.3Å; L30-I34 WeakPolarHBondContact O-CG1 3.37Å; L30-I34 PolarHBondContact O-N 3.37Å; F31-I34 HydrophobicContact CD1-CD1 4.41Å; F31-I34 PolarHBondContact O-N 3.45Å; L32-I34 VanDerWaalsContact C-N 3.35Å; L32-I34 PolarHBondContact O-N 3.37Å; I34-L36 PolarHBondContact O-N 3Å; I34-I37 PolarHBondContact O-N 3.22Å; I34-T38 PolarHBondContact O-N 3.39Å; I34-T38 PolarHBondContact O-OG1 2.91Å; I34-T38 VanDerWaalsContact O-OG1 3.06Å; I34-I279 HydrophobicContact CB-CG2 4.14Å; I34-I279 HydrophobicContact CD1-CG2 3.97Å; I34-I279 HydrophobicContact CG2-CG2 3.4Å; I34-V283 HydrophobicContact CG2-CG2 3.35Å
35Y87.7Confident87.3Confident46 Ų4655.4 Ų55.418%0.1831%0.305CS..Hα-helixtrans-56-49.5178.5178.2-110.1000111.9F31 L32 L33 I37 T38 M39 T78 P79F31-Y35 VanDerWaalsContact O-CB 3.27Å; F31-Y35 WeakPolarHBondContact O-CB 3.23Å; F31-Y35 PolarHBondContact O-N 2.84Å; L32-Y35 PolarHBondContact O-N 3.41Å; L33-Y35 VanDerWaalsContact C-N 3.35Å; L33-Y35 PolarHBondContact O-N 3.09Å; Y35-I37 VanDerWaalsContact C-N 3.33Å; Y35-I37 PolarHBondContact O-N 3.29Å; Y35-T38 PolarHBondContact O-N 3.13Å; Y35-M39 HydrophobicContact CD1-CG 4.29Å; Y35-M39 HydrophobicContact CD2-CG 4.06Å; Y35-M39 HydrophobicContact CE1-CG 3.95Å; Y35-M39 HydrophobicContact CE2-CG 3.7Å; Y35-M39 HydrophobicContact CE2-SD 3.81Å; Y35-M39 HydrophobicContact CG-CG 4.34Å; Y35-M39 WeakPolarHBondContact O-CB 3.47Å; Y35-M39 WeakPolarHBondContact O-CG 3.49Å; Y35-M39 PolarHBondContact O-N 3.44Å; Y35-T78 HydrophobicContact CD2-CG2 4.01Å; Y35-T78 HydrophobicContact CG-CG2 4.13Å; Y35-P79 HydrophobicContact CE2-CG 4.39Å
36L89.8Confident87.7Confident98 Ų9852.1 Ų52.151%0.51329%0.289SS..Hα-helixtrans-61.9-40.9179.7-68.2173.8000112L32 L33 I34 M39 L40L32-L36 HydrophobicContact CD1-CD1 4.33Å; L32-L36 HydrophobicContact CD1-CG 4.35Å; L32-L36 HydrophobicContact CG-CD1 4.2Å; L32-L36 VanDerWaalsContact O-CG 3.3Å; L32-L36 WeakPolarHBondContact O-CG 3.29Å; L32-L36 PolarHBondContact O-N 3.43Å; L33-L36 PolarHBondContact O-N 2.62Å; I34-L36 PolarHBondContact O-N 3Å; L36-M39 PolarHBondContact O-N 3.34Å; L36-L40 VanDerWaalsContact O-CB 3.25Å; L36-L40 WeakPolarHBondContact O-CB 3.49Å; L36-L40 PolarHBondContact O-N 3.46Å
37I86.3Confident88Confident80 Ų8053.8 Ų53.841%0.4129%0.289SS..Hα-helixtrans-63.2-46.2175.7-68.9168.5000110.6L33 I34 Y35 L40 G41 V283L33-I37 HydrophobicContact CD1-CD1 3.89Å; L33-I37 HydrophobicContact CD1-CG1 4.29Å; L33-I37 HydrophobicContact CG-CD1 3.86Å; L33-I37 VanDerWaalsContact O-CG1 3.28Å; L33-I37 WeakPolarHBondContact O-CG1 3.48Å; L33-I37 PolarHBondContact O-N 2.91Å; I34-I37 PolarHBondContact O-N 3.22Å; Y35-I37 VanDerWaalsContact C-N 3.33Å; Y35-I37 PolarHBondContact O-N 3.29Å; I37-L40 PolarHBondContact O-N 3.23Å; I37-G41 PolarHBondContact O-N 3.42Å; I37-V283 HydrophobicContact CG2-CG1 4.34Å
38T85.7Confident88.3Confident1 Ų153.8 Ų53.81%0.00629%0.289CS..Hα-helixtrans-61.2-46178-580000111.8I34 Y35 G41 N42 S74 P282 V283I34-T38 PolarHBondContact O-N 3.39Å; I34-T38 PolarHBondContact O-OG1 2.91Å; I34-T38 VanDerWaalsContact O-OG1 3.06Å; Y35-T38 PolarHBondContact O-N 3.13Å; T38-G41 PolarHBondContact O-N 2.91Å; T38-N42 WeakPolarHBondContact CG2-ND2 3.4Å; T38-N42 WeakPolarHBondContact O-CB 3.46Å; T38-N42 PolarHBondContact O-N 3.27Å; T38-N42 PolarHBondContact O-ND2 2.97Å; T38-N42 VanDerWaalsContact O-ND2 3.07Å; T38-S74 WeakPolarHBondContact CG2-OG 3.38Å; T38-P282 HydrophobicContact CG2-CB 3.82Å; T38-V283 WeakPolarHBondContact OG1-CG2 3.42Å
39M89.8Confident88.5Confident48 Ų4852.5 Ų52.524%0.23628%0.283CS..Hα-helixtrans-62.2-49179.4-68-60-73.300110.7Y35 L36 V43 L71Y35-M39 HydrophobicContact CD1-CG 4.29Å; Y35-M39 HydrophobicContact CD2-CG 4.06Å; Y35-M39 HydrophobicContact CE1-CG 3.95Å; Y35-M39 HydrophobicContact CE2-CG 3.7Å; Y35-M39 HydrophobicContact CE2-SD 3.81Å; Y35-M39 HydrophobicContact CG-CG 4.34Å; Y35-M39 WeakPolarHBondContact O-CB 3.47Å; Y35-M39 WeakPolarHBondContact O-CG 3.49Å; Y35-M39 PolarHBondContact O-N 3.44Å; L36-M39 PolarHBondContact O-N 3.34Å; M39-V43 VanDerWaalsContact O-CB 3.29Å; M39-V43 WeakPolarHBondContact O-CB 3.38Å; M39-V43 VanDerWaalsContact O-CG2 3.24Å; M39-V43 WeakPolarHBondContact O-CG2 3.4Å; M39-V43 PolarHBondContact O-N 3.07Å; M39-L71 HydrophobicContact CB-CD2 4.37Å; M39-L71 HydrophobicContact CE-CD2 3.86Å; M39-L71 HydrophobicContact CG-CD2 4.49Å; M39-L71 HydrophobicContact SD-CD2 3.42Å; M39-L71 WeakPolarHBondContact SD-CD2 3.37Å
40L89.9Confident88.6Confident134 Ų13455.2 Ų55.270%0.70229%0.287SS*.Hα-helixtrans-63.3-44.3179.1-177.562.4000112L36 I37 G44L36-L40 VanDerWaalsContact O-CB 3.25Å; L36-L40 WeakPolarHBondContact O-CB 3.49Å; L36-L40 PolarHBondContact O-N 3.46Å; I37-L40 PolarHBondContact O-N 3.23Å; L40-G44 WeakPolarHBondContact O-CA 3.03Å; L40-G44 PolarHBondContact O-N 2.96Å
41G87.4Confident88.7Confident28 Ų2855.1 Ų55.129%0.28929%0.287SS..Hα-helixtrans-61.4-48.7-179.300000112.4I37 T38 M45I37-G41 PolarHBondContact O-N 3.42Å; T38-G41 PolarHBondContact O-N 2.91Å; G41-M45 WeakPolarHBondContact O-CB 3.18Å; G41-M45 PolarHBondContact O-N 3.3Å
42N89.8Confident88.9Confident0 Ų055 Ų550%029%0.286CS..Hα-helixtrans-74.7-40.4-178.3-77.8-62.7000113.3T38 G44 M45 I46 S67 D70 L71 P286T38-N42 WeakPolarHBondContact CG2-ND2 3.4Å; T38-N42 WeakPolarHBondContact O-CB 3.46Å; T38-N42 PolarHBondContact O-N 3.27Å; T38-N42 PolarHBondContact O-ND2 2.97Å; T38-N42 VanDerWaalsContact O-ND2 3.07Å; N42-G44 VanDerWaalsContact C-N 3.32Å; N42-G44 PolarHBondContact O-N 2.82Å; N42-M45 PolarHBondContact O-N 3.3Å; N42-I46 WeakPolarHBondContact O-CG1 3.16Å; N42-I46 PolarHBondContact O-N 3.36Å; N42-S67 WeakPolarHBondContact OD1-CA 3.2Å; N42-S67 VanDerWaalsContact OD1-CB 3.28Å; N42-S67 WeakPolarHBondContact OD1-CB 3.32Å; N42-S67 PolarHBondContact OD1-OG 3.17Å; N42-D70 WeakPolarHBondContact ND2-CB 3.47Å; N42-D70 PolarHBondContact OD1-OD2 2.92Å; N42-L71 HydrophobicContact CB-CD1 4.05Å; N42-L71 HydrophobicContact CB-CD2 3.62Å; N42-L71 HydrophobicContact CB-CG 3.52Å; N42-P286 VanDerWaalsContact CG-CG 3.48Å; N42-P286 VanDerWaalsContact ND2-CG 3.25Å; N42-P286 WeakPolarHBondContact ND2-CG 3.22Å; N42-P286 WeakPolarHBondContact OD1-CG 3.36Å
43V91.7Very high88.6Confident75 Ų7558.3 Ų58.346%0.45530%0.304SS..Hα-helixtrans-62.1-44.1172.7171.10000110.3M39 M45 I46 L47 L71M39-V43 VanDerWaalsContact O-CB 3.29Å; M39-V43 WeakPolarHBondContact O-CB 3.38Å; M39-V43 VanDerWaalsContact O-CG2 3.24Å; M39-V43 WeakPolarHBondContact O-CG2 3.4Å; M39-V43 PolarHBondContact O-N 3.07Å; V43-M45 VanDerWaalsContact C-N 3.32Å; V43-M45 PolarHBondContact O-N 3.4Å; V43-I46 PolarHBondContact O-N 2.94Å; V43-L47 WeakPolarHBondContact O-CB 3.47Å; V43-L47 PolarHBondContact O-N 3.17Å; V43-L71 HydrophobicContact CG2-CD1 3.91Å; V43-L71 HydrophobicContact CG2-CD2 3.97Å
44G90.3Very high88.5Confident22 Ų2259.4 Ų59.423%0.22731%0.306CS..Hα-helixtrans-58.4-44175.600000111.9L40 N42 L47 I48L40-G44 WeakPolarHBondContact O-CA 3.03Å; L40-G44 PolarHBondContact O-N 2.96Å; N42-G44 VanDerWaalsContact C-N 3.32Å; N42-G44 PolarHBondContact O-N 2.82Å; G44-L47 PolarHBondContact O-N 3.43Å; G44-I48 WeakPolarHBondContact O-CB 3.47Å; G44-I48 WeakPolarHBondContact O-CD1 3.32Å; G44-I48 WeakPolarHBondContact O-CG1 3.38Å; G44-I48 PolarHBondContact O-N 3.36Å
45M89.3Confident88.5Confident3 Ų358 Ų582%0.01530%0.299CS..Hα-helixtrans-60.8-48.6177.6-168.266.4-161.800112.2G41 N42 V43 L47 I48 I49 Y60 L63 V296G41-M45 WeakPolarHBondContact O-CB 3.18Å; G41-M45 PolarHBondContact O-N 3.3Å; N42-M45 PolarHBondContact O-N 3.3Å; V43-M45 VanDerWaalsContact C-N 3.32Å; V43-M45 PolarHBondContact O-N 3.4Å; M45-L47 VanDerWaalsContact C-N 3.31Å; M45-L47 PolarHBondContact O-N 3.09Å; M45-I48 PolarHBondContact O-N 3.33Å; M45-I49 HydrophobicContact CE-CD1 3.68Å; M45-I49 HydrophobicContact CE-CG1 3.98Å; M45-I49 HydrophobicContact CG-CD1 4.11Å; M45-I49 WeakPolarHBondContact O-CG1 3.43Å; M45-I49 PolarHBondContact O-N 2.94Å; M45-Y60 HydrophobicContact CE-CD1 4.25Å; M45-Y60 HydrophobicContact CE-CE1 4.3Å; M45-L63 HydrophobicContact CE-CD2 3.2Å; M45-L63 HydrophobicContact CE-CG 3.97Å; M45-V296 HydrophobicContact CE-CG1 4.22Å; M45-V296 HydrophobicContact CE-CG2 3.59Å; M45-V296 HydrophobicContact SD-CG1 3.96Å; M45-V296 HydrophobicContact SD-CG2 4.35Å
46I91.6Very high88.5Confident38 Ų3860.9 Ų60.920%0.19531%0.314CS..Hα-helixtrans-57.7-47.3176-66.9168.1000109.9N42 V43 I49 R50 T64 L71N42-I46 WeakPolarHBondContact O-CG1 3.16Å; N42-I46 PolarHBondContact O-N 3.36Å; V43-I46 PolarHBondContact O-N 2.94Å; I46-I49 PolarHBondContact O-N 3.32Å; I46-R50 HydrophobicContact CG2-CG 4.39Å; I46-R50 WeakPolarHBondContact O-CG 3.2Å; I46-R50 PolarHBondContact O-N 3.06Å; I46-T64 HydrophobicContact CG1-CG2 4.17Å; I46-T64 HydrophobicContact CG2-CG2 4.2Å; I46-L71 HydrophobicContact CD1-CD1 3.8Å
47L90.9Very high88.5Confident97 Ų9758.8 Ų58.851%0.50831%0.305SS..Hα-helixtrans-62.6-46.2-179.1-176.264.9000112V43 G44 M45 I49 R50 L51V43-L47 WeakPolarHBondContact O-CB 3.47Å; V43-L47 PolarHBondContact O-N 3.17Å; G44-L47 PolarHBondContact O-N 3.43Å; M45-L47 VanDerWaalsContact C-N 3.31Å; M45-L47 PolarHBondContact O-N 3.09Å; L47-I49 VanDerWaalsContact C-N 3.34Å; L47-I49 PolarHBondContact O-N 3.43Å; L47-R50 PolarHBondContact O-N 3.17Å; L47-L51 HydrophobicContact CD1-CD1 3.77Å; L47-L51 HydrophobicContact CD1-CG 3.99Å; L47-L51 HydrophobicContact CD2-CD1 4.3Å; L47-L51 HydrophobicContact CG-CD1 3.68Å; L47-L51 HydrophobicContact CG-CG 4.24Å; L47-L51 WeakPolarHBondContact O-CB 3.4Å; L47-L51 VanDerWaalsContact O-CG 3.25Å; L47-L51 WeakPolarHBondContact O-CG 3.48Å; L47-L51 PolarHBondContact O-N 3.04Å
48I89.4Confident88.7Confident33 Ų3356.2 Ų56.217%0.16929%0.294CS..Hα-helixtrans-60-45.1179.2-70.6158.7000110.7G44 M45 R50 L51 D52 L55 V296 A299 V300G44-I48 WeakPolarHBondContact O-CB 3.47Å; G44-I48 WeakPolarHBondContact O-CD1 3.32Å; G44-I48 WeakPolarHBondContact O-CG1 3.38Å; G44-I48 PolarHBondContact O-N 3.36Å; M45-I48 PolarHBondContact O-N 3.33Å; I48-R50 VanDerWaalsContact C-N 3.3Å; I48-R50 PolarHBondContact O-N 2.77Å; I48-L51 PolarHBondContact O-N 2.92Å; I48-D52 PolarHBondContact O-N 2.67Å; I48-L55 HydrophobicContact CG2-CD1 3.74Å; I48-V296 HydrophobicContact CG2-CG1 4.45Å; I48-A299 HydrophobicContact CG2-CB 3.73Å; I48-V300 HydrophobicContact CD1-CG2 3.43Å; I48-V300 VanDerWaalsContact CD1-CG2 3.43Å; I48-V300 HydrophobicContact CG1-CG2 4.05Å
49I89.2Confident89Confident7 Ų756.5 Ų56.54%0.03630%0.295CS..Hα-helixtrans-61.8-41.3177.9-66.4164.7000110.7M45 I46 L47 L55 H56 Y60 L63 T64M45-I49 HydrophobicContact CE-CD1 3.68Å; M45-I49 HydrophobicContact CE-CG1 3.98Å; M45-I49 HydrophobicContact CG-CD1 4.11Å; M45-I49 WeakPolarHBondContact O-CG1 3.43Å; M45-I49 PolarHBondContact O-N 2.94Å; I46-I49 PolarHBondContact O-N 3.32Å; L47-I49 VanDerWaalsContact C-N 3.34Å; L47-I49 PolarHBondContact O-N 3.43Å; I49-L55 HydrophobicContact CG1-CD1 4.22Å; I49-H56 PolarHBondContact O-CD2 2.85Å; I49-H56 VanDerWaalsContact O-CD2 3.24Å; I49-H56 PolarHBondContact O-NE2 3.34Å; I49-H56 VanDerWaalsContact O-NE2 3.13Å; I49-Y60 HydrophobicContact CD1-CD1 4.17Å; I49-Y60 HydrophobicContact CG1-CD1 4.12Å; I49-L63 HydrophobicContact CD1-CB 4.36Å; I49-L63 HydrophobicContact CD1-CG 4.5Å; I49-T64 WeakPolarHBondContact CD1-OG1 3.28Å
50R89.9Confident89.1Confident174 Ų17454.2 Ų54.266%0.65728%0.284SS*.Hα-helixtrans-69-33179.9-68.2-72.4-172.9159.93.5113.4I46 L47 I48I46-R50 HydrophobicContact CG2-CG 4.39Å; I46-R50 WeakPolarHBondContact O-CG 3.2Å; I46-R50 PolarHBondContact O-N 3.06Å; L47-R50 PolarHBondContact O-N 3.17Å; I48-R50 VanDerWaalsContact C-N 3.3Å; I48-R50 PolarHBondContact O-N 2.77Å
51L88.6Confident89.2Confident84 Ų8451.2 Ų51.244%0.4427%0.265SS..Hα-helixtrans-86.5-21.4-176.4-68178.1000113.3L47 I48 V303L47-L51 HydrophobicContact CD1-CD1 3.77Å; L47-L51 HydrophobicContact CD1-CG 3.99Å; L47-L51 HydrophobicContact CD2-CD1 4.3Å; L47-L51 HydrophobicContact CG-CD1 3.68Å; L47-L51 HydrophobicContact CG-CG 4.24Å; L47-L51 WeakPolarHBondContact O-CB 3.4Å; L47-L51 VanDerWaalsContact O-CG 3.25Å; L47-L51 WeakPolarHBondContact O-CG 3.48Å; L47-L51 PolarHBondContact O-N 3.04Å; I48-L51 PolarHBondContact O-N 2.92Å; L51-V303 HydrophobicContact CB-CG1 4.41Å; L51-V303 HydrophobicContact CB-CG2 3.9Å; L51-V303 HydrophobicContact CD1-CG1 3.83Å
52D87.6Confident89.5Confident1 Ų149.9 Ų49.91%0.00525%0.251CS..  trans-111.2104.6179.8-164.4-24.5000112.6I48 Q54 L55 A299 R302 V303I48-D52 PolarHBondContact O-N 2.67Å; D52-Q54 PolarHBondContact O-N 3.05Å; D52-Q54 VanDerWaalsContact O-N 3.09Å; D52-Q54 VanDerWaalsContact OD1-CB 3.26Å; D52-Q54 WeakPolarHBondContact OD1-CB 3.45Å; D52-Q54 WeakPolarHBondContact OD1-CG 3.48Å; D52-Q54 PolarHBondContact OD1-N 3.49Å; D52-L55 HydrophobicContact CB-CD1 4.18Å; D52-L55 HydrophobicContact CB-CG 4.15Å; D52-L55 WeakPolarHBondContact O-CB 3.4Å; D52-L55 PolarHBondContact O-N 3.43Å; D52-A299 HydrophobicContact CB-CB 3.96Å; D52-A299 WeakPolarHBondContact OD2-CA 3.06Å; D52-A299 WeakPolarHBondContact OD2-CB 3.46Å; D52-R302 IonicContact OD1-NE 3.95Å; D52-R302 IonicContact OD1-NH2 3.86Å; D52-R302 IonicContact OD2-CZ 3.14Å; D52-R302 IonicContact OD2-NE 2.79Å; D52-R302 PolarHBondContact OD2-NE 3.38Å; D52-R302 IonicContact OD2-NH2 2.67Å; D52-R302 PolarHBondContact OD2-NH2 2.9Å; D52-V303 HydrophobicContact CB-CG2 4.44Å
53L84.3Confident89.6Confident125 Ų12550 Ų5065%0.65425%0.252SS*.G310 helixtrans-56.3-25.9176.4-61.8177.7000113.6L55 H56L53-L55 PolarHBondContact O-N 2.79Å; L53-H56 VanDerWaalsContact CD2-CE1 3.46Å; L53-H56 WeakPolarHBondContact CD2-CE1 3.49Å; L53-H56 WeakPolarHBondContact O-CB 3.16Å; L53-H56 PolarHBondContact O-N 3.06Å; L53-H56 VanDerWaalsContact O-N 3.11Å
54Q84.6Confident89.6Confident123 Ų12347.2 Ų47.258%0.57524%0.235SC*.G310 helixtrans-69.3-19.2177.3-59.7-173.67.600112.3D52D52-Q54 PolarHBondContact O-N 3.05Å; D52-Q54 VanDerWaalsContact O-N 3.09Å; D52-Q54 VanDerWaalsContact OD1-CB 3.26Å; D52-Q54 WeakPolarHBondContact OD1-CB 3.45Å; D52-Q54 WeakPolarHBondContact OD1-CG 3.48Å; D52-Q54 PolarHBondContact OD1-N 3.49Å
55L84.5Confident89.8Confident1 Ų148.3 Ų48.31%0.00523%0.234CC..G310 helixtrans-89.41.6173.9-59.9-178.6000112.4I48 I49 D52 L53 T57 Y60 E295 A299I48-L55 HydrophobicContact CG2-CD1 3.74Å; I49-L55 HydrophobicContact CG1-CD1 4.22Å; D52-L55 HydrophobicContact CB-CD1 4.18Å; D52-L55 HydrophobicContact CB-CG 4.15Å; D52-L55 WeakPolarHBondContact O-CB 3.4Å; D52-L55 PolarHBondContact O-N 3.43Å; L53-L55 PolarHBondContact O-N 2.79Å; L55-T57 PolarHBondContact O-N 3.35Å; L55-Y60 HydrophobicContact CB-CD1 4.48Å; L55-Y60 HydrophobicContact CB-CD2 3.98Å; L55-Y60 HydrophobicContact CB-CE2 4.43Å; L55-Y60 HydrophobicContact CB-CG 4.06Å; L55-Y60 HydrophobicContact CD2-CD1 4.36Å; L55-Y60 HydrophobicContact CD2-CD2 4.01Å; L55-Y60 HydrophobicContact CD2-CE1 3.97Å; L55-Y60 HydrophobicContact CD2-CE2 3.58Å; L55-Y60 HydrophobicContact CD2-CG 4.42Å; L55-Y60 WeakPolarHBondContact O-CB 3.45Å; L55-Y60 WeakPolarHBondContact O-CD2 3.44Å; L55-Y60 VanDerWaalsContact O-CG 3.31Å; L55-E295 HydrophobicContact CD2-CB 4.12Å; L55-A299 HydrophobicContact CD1-CB 3.52Å; L55-A299 HydrophobicContact CD2-CB 4.41Å; L55-A299 HydrophobicContact CG-CB 4.03Å
56H87.3Confident89.9Confident106 Ų10648.2 Ų48.249%0.49123%0.234SC..  trans-77.958.2-180-70.2-172.6000112.8I49 L53I49-H56 PolarHBondContact O-CD2 2.85Å; I49-H56 VanDerWaalsContact O-CD2 3.24Å; I49-H56 PolarHBondContact O-NE2 3.34Å; I49-H56 VanDerWaalsContact O-NE2 3.13Å; L53-H56 VanDerWaalsContact CD2-CE1 3.46Å; L53-H56 WeakPolarHBondContact CD2-CE1 3.49Å; L53-H56 WeakPolarHBondContact O-CB 3.16Å; L53-H56 PolarHBondContact O-N 3.06Å; L53-H56 VanDerWaalsContact O-N 3.11Å
57T89.8Confident89.9Confident55 Ų5546.6 Ų46.634%0.33723%0.226SC..SBendtrans-109.1160.6173.974.60000111.1L55 M59 Y60 F61L55-T57 PolarHBondContact O-N 3.35Å; T57-M59 VanDerWaalsContact C-N 3.29Å; T57-M59 PolarHBondContact O-N 2.92Å; T57-Y60 PolarHBondContact O-N 3.45Å; T57-Y60 VanDerWaalsContact O-N 3.11Å; T57-Y60 VanDerWaalsContact OG1-CD2 3.23Å; T57-Y60 WeakPolarHBondContact OG1-CD2 3.43Å; T57-F61 PolarHBondContact O-N 3.42Å
58P92Very high90Very high26 Ų2647.1 Ų47.117%0.16922%0.224CC..Hα-helixtrans-50.9-41.9176.8-31.237.1000114.4Y60 F61 F62 D120 Y131 M135P58-Y60 PolarHBondContact O-N 2.53Å; P58-F61 WeakPolarHBondContact O-CB 3.46Å; P58-F61 PolarHBondContact O-N 3.28Å; P58-F62 HydrophobicContact CB-CE2 4.25Å; P58-F62 WeakPolarHBondContact O-CD2 3.42Å; P58-F62 WeakPolarHBondContact O-CG 3.4Å; P58-F62 PolarHBondContact O-N 3.24Å; P58-D120 WeakPolarHBondContact CB-OD1 3.33Å; P58-Y131 WeakPolarHBondContact CD-OH 3.12Å; P58-Y131 WeakPolarHBondContact CG-OH 3.26Å; P58-M135 HydrophobicContact CB-CB 4.4Å; P58-M135 HydrophobicContact CB-CE 4.15Å; P58-M135 HydrophobicContact CG-CB 4.02Å
59M91.8Very high90.2Very high6 Ų645.6 Ų45.63%0.0322%0.216CC..Hα-helixtrans-54.9-52.4175-177.884.8172.200112.4T57 F61 F62 L63 M117 D120 R121 H243 Y289T57-M59 VanDerWaalsContact C-N 3.29Å; T57-M59 PolarHBondContact O-N 2.92Å; M59-F61 PolarHBondContact O-N 3.13Å; M59-F62 WeakPolarHBondContact O-CB 2.94Å; M59-F62 PolarHBondContact O-N 3.26Å; M59-F62 VanDerWaalsContact O-N 3.13Å; M59-L63 WeakPolarHBondContact O-CB 3.27Å; M59-L63 PolarHBondContact O-N 3.33Å; M59-M117 HydrophobicContact CE-CE 3.37Å; M59-M117 HydrophobicContact SD-CB 4.25Å; M59-M117 HydrophobicContact SD-CE 4.14Å; M59-M117 HydrophobicContact SD-CG 4.42Å; M59-D120 WeakPolarHBondContact CB-OD2 3.18Å; M59-R121 HydrophobicContact SD-CG 4.39Å; M59-R121 PolarHBondContact SD-NE 3.37Å; M59-R121 PolarHBondContact SD-NH2 3.42Å; M59-H243 HydrophobicContact CE-CB 4.47Å; M59-Y289 HydrophobicContact CE-CE1 4.28Å
60Y90.6Very high90.1Very high1 Ų145.3 Ų45.30%0.00422%0.215CC..Hα-helixtrans-71.3-25.7-175.9-72-67.2000111.8M45 I49 L55 T57 P58 L63 T64 N293 E295 V296M45-Y60 HydrophobicContact CE-CD1 4.25Å; M45-Y60 HydrophobicContact CE-CE1 4.3Å; I49-Y60 HydrophobicContact CD1-CD1 4.17Å; I49-Y60 HydrophobicContact CG1-CD1 4.12Å; L55-Y60 HydrophobicContact CB-CD1 4.48Å; L55-Y60 HydrophobicContact CB-CD2 3.98Å; L55-Y60 HydrophobicContact CB-CE2 4.43Å; L55-Y60 HydrophobicContact CB-CG 4.06Å; L55-Y60 HydrophobicContact CD2-CD1 4.36Å; L55-Y60 HydrophobicContact CD2-CD2 4.01Å; L55-Y60 HydrophobicContact CD2-CE1 3.97Å; L55-Y60 HydrophobicContact CD2-CE2 3.58Å; L55-Y60 HydrophobicContact CD2-CG 4.42Å; L55-Y60 WeakPolarHBondContact O-CB 3.45Å; L55-Y60 WeakPolarHBondContact O-CD2 3.44Å; L55-Y60 VanDerWaalsContact O-CG 3.31Å; T57-Y60 PolarHBondContact O-N 3.45Å; T57-Y60 VanDerWaalsContact O-N 3.11Å; T57-Y60 VanDerWaalsContact OG1-CD2 3.23Å; T57-Y60 WeakPolarHBondContact OG1-CD2 3.43Å; P58-Y60 PolarHBondContact O-N 2.53Å; Y60-L63 HydrophobicContact CD1-CD2 3.89Å; Y60-L63 HydrophobicContact CE1-CD2 4.11Å; Y60-L63 PolarHBondContact O-N 2.93Å; Y60-T64 PolarHBondContact O-N 2.9Å; Y60-T64 PolarHBondContact O-OG1 2.89Å; Y60-N293 PolarHBondContact OH-ND2 3.17Å; Y60-E295 VanDerWaalsContact CE2-OE2 3.27Å; Y60-E295 WeakPolarHBondContact CE2-OE2 3.45Å; Y60-E295 VanDerWaalsContact CZ-OE2 3.31Å; Y60-E295 VanDerWaalsContact OH-CB 3.27Å; Y60-E295 WeakPolarHBondContact OH-CB 3.46Å; Y60-E295 PolarHBondContact OH-OE2 3.06Å; Y60-V296 HydrophobicContact CE1-CG2 3.84Å
61F92.4Very high90.2Very high70 Ų7038 Ų3831%0.30719%0.189SC..Hα-helixtrans-61.2-48166.7179.9-118.2000111.3T57 P58 M59 L63 T64 H65 C140 L141 I144T57-F61 PolarHBondContact O-N 3.42Å; P58-F61 WeakPolarHBondContact O-CB 3.46Å; P58-F61 PolarHBondContact O-N 3.28Å; M59-F61 PolarHBondContact O-N 3.13Å; F61-L63 VanDerWaalsContact C-N 3.33Å; F61-L63 PolarHBondContact O-N 2.85Å; F61-T64 WeakPolarHBondContact O-CB 3.18Å; F61-T64 PolarHBondContact O-N 3.27Å; F61-H65 AromaticContact CE2-NE2 3.81Å; F61-H65 AromaticContact CZ-NE2 3.83Å; F61-H65 PolarHBondContact O-CD2 3.15Å; F61-H65 PolarHBondContact O-N 3.47Å; F61-C140 HydrophobicContact CD1-CB 4.25Å; F61-C140 HydrophobicContact CE1-CB 4.36Å; F61-L141 HydrophobicContact CZ-CD2 4.2Å; F61-I144 HydrophobicContact CD1-CG1 4.08Å; F61-I144 HydrophobicContact CE1-CB 4.4Å; F61-I144 HydrophobicContact CE1-CD1 4.46Å; F61-I144 HydrophobicContact CE1-CG1 3.46Å; F61-I144 VanDerWaalsContact CE1-CG1 3.46Å; F61-I144 HydrophobicContact CZ-CG1 4Å
62F93.6Very high90.3Very high0 Ų035.4 Ų35.40%018%0.177CC..Hα-helixtrans-60.7-41.8172.2-60.4-54.3000112.3P58 M59 T64 H65 L66 L113 M117 D120 M135 C140 L143 I144P58-F62 HydrophobicContact CB-CE2 4.25Å; P58-F62 WeakPolarHBondContact O-CD2 3.42Å; P58-F62 WeakPolarHBondContact O-CG 3.4Å; P58-F62 PolarHBondContact O-N 3.24Å; M59-F62 WeakPolarHBondContact O-CB 2.94Å; M59-F62 PolarHBondContact O-N 3.26Å; M59-F62 VanDerWaalsContact O-N 3.13Å; F62-T64 VanDerWaalsContact C-N 3.29Å; F62-T64 PolarHBondContact O-N 3.38Å; F62-H65 WeakPolarHBondContact O-CB 3.29Å; F62-H65 PolarHBondContact O-N 2.91Å; F62-L66 PolarHBondContact O-N 3.07Å; F62-L113 HydrophobicContact CB-CD1 4.04Å; F62-L113 HydrophobicContact CD1-CD1 3.79Å; F62-L113 HydrophobicContact CG-CD1 4.3Å; F62-M117 HydrophobicContact CB-CG 3.5Å; F62-M117 VanDerWaalsContact CB-CG 3.5Å; F62-M117 HydrophobicContact CB-SD 4.21Å; F62-M117 HydrophobicContact CD2-CG 4.23Å; F62-M117 HydrophobicContact CG-CG 4.08Å; F62-D120 HydrophobicContact CD2-CB 4.34Å; F62-D120 HydrophobicContact CE2-CB 4.03Å; F62-M135 HydrophobicContact CE2-CE 3.66Å; F62-M135 HydrophobicContact CZ-CE 4.01Å; F62-C140 HydrophobicContact CZ-CB 4.37Å; F62-L143 HydrophobicContact CE1-CB 3.72Å; F62-L143 HydrophobicContact CZ-CB 3.91Å; F62-L143 HydrophobicContact CZ-CD1 3.94Å; F62-I144 HydrophobicContact CD1-CD1 3.46Å; F62-I144 VanDerWaalsContact CD1-CD1 3.46Å; F62-I144 HydrophobicContact CD1-CG1 3.91Å; F62-I144 HydrophobicContact CE1-CD1 4Å; F62-I144 HydrophobicContact CE1-CG1 3.95Å
63L91.3Very high90.2Very high3 Ų335.9 Ų35.92%0.01618%0.179CC..Hα-helixtrans-65.3-31.9-179.2-166.358.7000112.9M45 I49 M59 Y60 F61 H65 L66 S67 M117 Y289M45-L63 HydrophobicContact CE-CD2 3.2Å; M45-L63 HydrophobicContact CE-CG 3.97Å; I49-L63 HydrophobicContact CD1-CB 4.36Å; I49-L63 HydrophobicContact CD1-CG 4.5Å; M59-L63 WeakPolarHBondContact O-CB 3.27Å; M59-L63 PolarHBondContact O-N 3.33Å; Y60-L63 HydrophobicContact CD1-CD2 3.89Å; Y60-L63 HydrophobicContact CE1-CD2 4.11Å; Y60-L63 PolarHBondContact O-N 2.93Å; F61-L63 VanDerWaalsContact C-N 3.33Å; F61-L63 PolarHBondContact O-N 2.85Å; L63-H65 VanDerWaalsContact C-N 3.32Å; L63-L66 HydrophobicContact CD1-CB 4.49Å; L63-L66 HydrophobicContact CD1-CD2 4.04Å; L63-L66 PolarHBondContact O-N 3.25Å; L63-S67 PolarHBondContact O-N 2.95Å; L63-S67 PolarHBondContact O-OG 2.91Å; L63-M117 HydrophobicContact CD1-CE 4.05Å; L63-Y289 HydrophobicContact CD1-CD1 3.96Å; L63-Y289 HydrophobicContact CD1-CD2 3.67Å; L63-Y289 HydrophobicContact CD1-CE1 4.49Å; L63-Y289 HydrophobicContact CD1-CE2 4.27Å; L63-Y289 HydrophobicContact CD1-CG 3.53Å; L63-Y289 HydrophobicContact CD2-CG 4.42Å
64T92.9Very high90.2Very high16 Ų1630 Ų3010%0.09815%0.148CC..Hα-helixtrans-61.8-42.3171.8-590000111I46 I49 Y60 F61 F62 F68I46-T64 HydrophobicContact CG1-CG2 4.17Å; I46-T64 HydrophobicContact CG2-CG2 4.2Å; I49-T64 WeakPolarHBondContact CD1-OG1 3.28Å; Y60-T64 PolarHBondContact O-N 2.9Å; Y60-T64 PolarHBondContact O-OG1 2.89Å; F61-T64 WeakPolarHBondContact O-CB 3.18Å; F61-T64 PolarHBondContact O-N 3.27Å; F62-T64 VanDerWaalsContact C-N 3.29Å; F62-T64 PolarHBondContact O-N 3.38Å; T64-F68 PolarHBondContact O-N 3.32Å
65H94.5Very high90.5Very high46 Ų4627.1 Ų27.121%0.21314%0.14CC..Hα-helixtrans-70.7-36.3176.5-82.1-81.4000112.5F61 F62 L63 F68 I69 L113 I144 Y148F61-H65 AromaticContact CE2-NE2 3.81Å; F61-H65 AromaticContact CZ-NE2 3.83Å; F61-H65 PolarHBondContact O-CD2 3.15Å; F61-H65 PolarHBondContact O-N 3.47Å; F62-H65 WeakPolarHBondContact O-CB 3.29Å; F62-H65 PolarHBondContact O-N 2.91Å; L63-H65 VanDerWaalsContact C-N 3.32Å; H65-F68 PolarHBondContact O-N 2.97Å; H65-I69 WeakPolarHBondContact O-CG1 3.17Å; H65-I69 PolarHBondContact O-N 2.91Å; H65-L113 HydrophobicContact CB-CD2 3.88Å; H65-I144 HydrophobicContact CB-CD1 3.72Å; H65-I144 VanDerWaalsContact CD2-CD1 3.44Å; H65-I144 WeakPolarHBondContact CD2-CD1 3.33Å; H65-Y148 AromaticContact ND1-CE2 3.45Å; H65-Y148 WeakPolarHBondContact ND1-CE2 3.43Å; H65-Y148 AromaticContact ND1-CZ 3.7Å; H65-Y148 PolarHBondContact ND1-OH 2.93Å
66L91.7Very high90.6Very high1 Ų128.5 Ų28.51%0.00515%0.148CC..Hα-helixtrans-61.9-47173.6-174.463.6000110.3F62 L63 F68 I69 D70 E110 L113 L114 M117 Y289F62-L66 PolarHBondContact O-N 3.07Å; L63-L66 HydrophobicContact CD1-CB 4.49Å; L63-L66 HydrophobicContact CD1-CD2 4.04Å; L63-L66 PolarHBondContact O-N 3.25Å; L66-F68 VanDerWaalsContact C-N 3.29Å; L66-F68 PolarHBondContact O-N 2.94Å; L66-I69 WeakPolarHBondContact O-CB 3.46Å; L66-I69 PolarHBondContact O-N 3.49Å; L66-I69 VanDerWaalsContact O-N 3.09Å; L66-D70 PolarHBondContact O-N 3.36Å; L66-E110 HydrophobicContact CD1-CG 3.71Å; L66-L113 HydrophobicContact CB-CD2 3.87Å; L66-L113 HydrophobicContact CD1-CD2 4.33Å; L66-L114 HydrophobicContact CD2-CD2 4.3Å; L66-M117 HydrophobicContact CD2-CE 4.26Å; L66-M117 HydrophobicContact CD2-SD 4.14Å; L66-Y289 HydrophobicContact CD2-CD2 4.09Å; L66-Y289 HydrophobicContact CD2-CE2 3.55Å
67S91.8Very high90.4Very high3 Ų323.4 Ų23.42%0.02112%0.124CC..Hα-helixtrans-61.7-35.5175.2-72.40000113.3N42 L63 L71N42-S67 WeakPolarHBondContact OD1-CA 3.2Å; N42-S67 VanDerWaalsContact OD1-CB 3.28Å; N42-S67 WeakPolarHBondContact OD1-CB 3.32Å; N42-S67 PolarHBondContact OD1-OG 3.17Å; L63-S67 PolarHBondContact O-N 2.95Å; L63-S67 PolarHBondContact O-OG 2.91Å; S67-L71 VanDerWaalsContact O-CG 3.24Å; S67-L71 WeakPolarHBondContact O-CG 3.45Å; S67-L71 PolarHBondContact O-N 3.33Å
68F93.2Very high90.1Very high109 Ų10920.9 Ų20.948%0.47811%0.109SC..Hα-helixtrans-66.4-40.5173.1175.6-98.6000112.4T64 H65 L66 S72T64-F68 PolarHBondContact O-N 3.32Å; H65-F68 PolarHBondContact O-N 2.97Å; L66-F68 VanDerWaalsContact C-N 3.29Å; L66-F68 PolarHBondContact O-N 2.94Å; F68-S72 WeakPolarHBondContact O-CB 3.47Å; F68-S72 PolarHBondContact O-N 3.4Å; F68-S72 PolarHBondContact O-OG 3.44Å
69I91.8Very high89.9Confident1 Ų122.1 Ų22.11%0.00512%0.117CC..Hα-helixtrans-61.7-48.1174.2-72.5170.5000109.9H65 L66 L71 S72 Y73 L106 A109 E110 L113 Y148H65-I69 WeakPolarHBondContact O-CG1 3.17Å; H65-I69 PolarHBondContact O-N 2.91Å; L66-I69 WeakPolarHBondContact O-CB 3.46Å; L66-I69 PolarHBondContact O-N 3.49Å; L66-I69 VanDerWaalsContact O-N 3.09Å; I69-L71 PolarHBondContact O-N 2.97Å; I69-S72 CarbonylContact O-C 3.51Å; I69-S72 WeakPolarHBondContact O-CB 3.35Å; I69-S72 PolarHBondContact O-N 3.23Å; I69-S72 VanDerWaalsContact O-N 3.1Å; I69-Y73 WeakPolarHBondContact O-CB 3.31Å; I69-Y73 PolarHBondContact O-N 2.78Å; I69-L106 HydrophobicContact CB-CD2 4.49Å; I69-L106 HydrophobicContact CG1-CD2 4.23Å; I69-L106 HydrophobicContact CG2-CB 4.12Å; I69-L106 HydrophobicContact CG2-CD2 4.24Å; I69-A109 HydrophobicContact CD1-CB 3.86Å; I69-E110 HydrophobicContact CG2-CB 4.16Å; I69-L113 HydrophobicContact CD1-CD2 3.86Å; I69-Y148 HydrophobicContact CD1-CE1 3.91Å; I69-Y148 HydrophobicContact CG1-CE1 3.89Å
70D88.6Confident89.6Confident1 Ų124.2 Ų24.21%0.00513%0.126CC..Hα-helixtrans-58.7-43.1179.2-71.9-32.6000112.7N42 L66 Y73 S74 P282 N285N42-D70 WeakPolarHBondContact ND2-CB 3.47Å; N42-D70 PolarHBondContact OD1-OD2 2.92Å; L66-D70 PolarHBondContact O-N 3.36Å; D70-Y73 PolarHBondContact O-N 3.23Å; D70-S74 WeakPolarHBondContact O-CB 3.19Å; D70-S74 PolarHBondContact O-N 3.08Å; D70-S74 PolarHBondContact O-OG 3.24Å; D70-P282 HydrophobicContact CB-CB 4.35Å; D70-N285 PolarHBondContact OD1-ND2 2.86Å; D70-N285 WeakPolarHBondContact OD2-CB 3.43Å; D70-N285 PolarHBondContact OD2-ND2 2.98Å
71L90.6Very high89.3Confident20 Ų2024.3 Ų24.311%0.10513%0.126CC..Hα-helixtrans-59.5-47.9174-72.6170000111.3M39 N42 V43 I46 S67 I69 Y73 T75M39-L71 HydrophobicContact CB-CD2 4.37Å; M39-L71 HydrophobicContact CE-CD2 3.86Å; M39-L71 HydrophobicContact CG-CD2 4.49Å; M39-L71 HydrophobicContact SD-CD2 3.42Å; M39-L71 WeakPolarHBondContact SD-CD2 3.37Å; N42-L71 HydrophobicContact CB-CD1 4.05Å; N42-L71 HydrophobicContact CB-CD2 3.62Å; N42-L71 HydrophobicContact CB-CG 3.52Å; V43-L71 HydrophobicContact CG2-CD1 3.91Å; V43-L71 HydrophobicContact CG2-CD2 3.97Å; I46-L71 HydrophobicContact CD1-CD1 3.8Å; S67-L71 VanDerWaalsContact O-CG 3.24Å; S67-L71 WeakPolarHBondContact O-CG 3.45Å; S67-L71 PolarHBondContact O-N 3.33Å; I69-L71 PolarHBondContact O-N 2.97Å; L71-Y73 VanDerWaalsContact C-N 3.35Å; L71-T75 WeakPolarHBondContact O-CB 3.48Å; L71-T75 PolarHBondContact O-N 3.39Å; L71-T75 PolarHBondContact O-OG1 2.93Å
72S91.3Very high89Confident29 Ų2921.7 Ų21.720%0.20312%0.115CC..Hα-helixtrans-64.5-43.2-179.2-56.50000110.5F68 I69 S74 T75 V76F68-S72 WeakPolarHBondContact O-CB 3.47Å; F68-S72 PolarHBondContact O-N 3.4Å; F68-S72 PolarHBondContact O-OG 3.44Å; I69-S72 CarbonylContact O-C 3.51Å; I69-S72 WeakPolarHBondContact O-CB 3.35Å; I69-S72 PolarHBondContact O-N 3.23Å; I69-S72 VanDerWaalsContact O-N 3.1Å; S72-S74 PolarHBondContact O-N 3.13Å; S72-T75 PolarHBondContact O-N 3.3Å; S72-V76 WeakPolarHBondContact O-CG2 3.44Å; S72-V76 PolarHBondContact O-N 3.28Å
73Y84.8Confident88.7Confident11 Ų1123.3 Ų23.34%0.04313%0.129CC..Hα-helixtrans-62.5-46.9-178.3-156.9-100000111.4I69 D70 L71 T75 V76 F103 L106 P282I69-Y73 WeakPolarHBondContact O-CB 3.31Å; I69-Y73 PolarHBondContact O-N 2.78Å; D70-Y73 PolarHBondContact O-N 3.23Å; L71-Y73 VanDerWaalsContact C-N 3.35Å; Y73-T75 VanDerWaalsContact C-N 3.32Å; Y73-T75 PolarHBondContact O-N 3.02Å; Y73-V76 PolarHBondContact O-N 2.91Å; Y73-F103 HydrophobicContact CD1-CE2 4.47Å; Y73-F103 HydrophobicContact CD2-CD2 4.46Å; Y73-F103 HydrophobicContact CE1-CD2 4.17Å; Y73-F103 AromaticContact CE1-CE2 3.53Å; Y73-F103 HydrophobicContact CE1-CE2 3.53Å; Y73-F103 HydrophobicContact CE1-CZ 4.24Å; Y73-F103 AromaticContact CE2-CD2 3.77Å; Y73-F103 HydrophobicContact CE2-CD2 3.77Å; Y73-F103 AromaticContact CE2-CE2 3.76Å; Y73-F103 HydrophobicContact CE2-CE2 3.76Å; Y73-F103 HydrophobicContact CE2-CG 4.35Å; Y73-F103 HydrophobicContact CE2-CZ 4.3Å; Y73-F103 AromaticContact CZ-CD2 3.65Å; Y73-F103 AromaticContact CZ-CE2 3.12Å; Y73-F103 AromaticContact CZ-CZ 3.57Å; Y73-F103 WeakPolarHBondContact OH-CE2 3.27Å; Y73-F103 WeakPolarHBondContact OH-CZ 3.33Å; Y73-L106 HydrophobicContact CD2-CB 3.68Å; Y73-L106 HydrophobicContact CD2-CD1 4.23Å; Y73-L106 HydrophobicContact CE2-CB 4.31Å; Y73-P282 HydrophobicContact CD1-CG 3.84Å
74S85.8Confident88.3Confident1 Ų123.7 Ų23.71%0.00713%0.131CC..Hα-helixtrans-63.6-38.2175.8-67.90000111.9T38 D70 S72 V76 T78 P79 P282T38-S74 WeakPolarHBondContact CG2-OG 3.38Å; D70-S74 WeakPolarHBondContact O-CB 3.19Å; D70-S74 PolarHBondContact O-N 3.08Å; D70-S74 PolarHBondContact O-OG 3.24Å; S72-S74 PolarHBondContact O-N 3.13Å; S74-V76 VanDerWaalsContact C-N 3.34Å; S74-V76 PolarHBondContact O-N 3.25Å; S74-T78 WeakPolarHBondContact O-CB 3.36Å; S74-T78 PolarHBondContact O-N 3.06Å; S74-T78 PolarHBondContact O-OG1 3.49Å; S74-T78 VanDerWaalsContact O-OG1 3.07Å; S74-P79 WeakPolarHBondContact O-CD 3.33Å; S74-P282 WeakPolarHBondContact OG-CB 3.49Å
75T89.4Confident87.7Confident64 Ų6423.5 Ų23.539%0.39313%0.129SC..Hα-helixtrans-70.8-28.4179.2-55.30000112.8L71 S72 Y73 P79L71-T75 WeakPolarHBondContact O-CB 3.48Å; L71-T75 PolarHBondContact O-N 3.39Å; L71-T75 PolarHBondContact O-OG1 2.93Å; S72-T75 PolarHBondContact O-N 3.3Å; Y73-T75 VanDerWaalsContact C-N 3.32Å; Y73-T75 PolarHBondContact O-N 3.02Å; T75-P79 HydrophobicContact CG2-CG 4.44Å; T75-P79 WeakPolarHBondContact O-CD 3.27Å; T75-P79 VanDerWaalsContact O-CG 3.32Å; T75-P79 WeakPolarHBondContact O-CG 3.39Å
76V87.9Confident87.1Confident29 Ų2925.7 Ų25.718%0.17614%0.142CC..Hα-helixtrans-69.1-39.5178.51680000111.7S72 Y73 S74 Q99 F102 F103 L106S72-V76 WeakPolarHBondContact O-CG2 3.44Å; S72-V76 PolarHBondContact O-N 3.28Å; Y73-V76 PolarHBondContact O-N 2.91Å; S74-V76 VanDerWaalsContact C-N 3.34Å; S74-V76 PolarHBondContact O-N 3.25Å; V76-Q99 HydrophobicContact CG1-CB 4.44Å; V76-Q99 HydrophobicContact CG1-CG 3.57Å; V76-Q99 WeakPolarHBondContact CG1-O 3.1Å; V76-F102 HydrophobicContact CG1-CB 4.14Å; V76-F102 HydrophobicContact CG2-CB 3.56Å; V76-F102 HydrophobicContact CG2-CG 4.3Å; V76-F103 HydrophobicContact CG1-CB 4.47Å; V76-L106 HydrophobicContact CG2-CD1 4.2Å
77V82Confident86.1Confident0 Ų031.3 Ų31.30%018%0.177CC..Hα-helixtrans-104.6-45.7-171.2-179.10000112.9T81 F103 F176 F177 T278V77-T81 WeakPolarHBondContact O-CB 3.43Å; V77-T81 PolarHBondContact O-N 3.36Å; V77-T81 VanDerWaalsContact O-N 3.09Å; V77-T81 PolarHBondContact O-OG1 3.49Å; V77-F103 HydrophobicContact CG2-CD2 3.86Å; V77-F103 HydrophobicContact CG2-CE2 4.24Å; V77-F176 HydrophobicContact CG1-CE2 4.12Å; V77-F177 HydrophobicContact CG1-CB 4.01Å; V77-F177 HydrophobicContact CG1-CD1 4.15Å; V77-F177 HydrophobicContact CG1-CG 4.05Å; V77-T278 HydrophobicContact CG1-CG2 4.45Å
78T85.1Confident85.1Confident2 Ų233.6 Ų33.61%0.01219%0.193CC..Hα-helixtrans-70.5-44-165.3-49.90000113.8Y35 S74 K80 T81 L82Y35-T78 HydrophobicContact CD2-CG2 4.01Å; Y35-T78 HydrophobicContact CG-CG2 4.13Å; S74-T78 WeakPolarHBondContact O-CB 3.36Å; S74-T78 PolarHBondContact O-N 3.06Å; S74-T78 PolarHBondContact O-OG1 3.49Å; S74-T78 VanDerWaalsContact O-OG1 3.07Å; T78-K80 VanDerWaalsContact C-N 3.32Å; T78-K80 PolarHBondContact O-N 2.74Å; T78-T81 WeakPolarHBondContact O-CB 3.43Å; T78-T81 PolarHBondContact O-N 3.38Å; T78-L82 HydrophobicContact CG2-CD1 3.98Å; T78-L82 HydrophobicContact CG2-CG 4.17Å; T78-L82 WeakPolarHBondContact O-CB 3.29Å; T78-L82 VanDerWaalsContact O-CG 3.31Å; T78-L82 WeakPolarHBondContact O-CG 3.29Å; T78-L82 PolarHBondContact O-N 2.99Å
79P86.9Confident84.5Confident51 Ų5131 Ų3133%0.33118%0.184SC..Hα-helixtrans-58.7-41.4178.1-26.235.8000113.1Y35 S74 T75 L82 A83Y35-P79 HydrophobicContact CE2-CG 4.39Å; S74-P79 WeakPolarHBondContact O-CD 3.33Å; T75-P79 HydrophobicContact CG2-CG 4.44Å; T75-P79 WeakPolarHBondContact O-CD 3.27Å; T75-P79 VanDerWaalsContact O-CG 3.32Å; T75-P79 WeakPolarHBondContact O-CG 3.39Å; P79-L82 PolarHBondContact O-N 2.95Å; P79-A83 PolarHBondContact O-N 3.27Å
80K86.4Confident84.1Confident50 Ų5037 Ų3722%0.21721%0.207CC..Hα-helixtrans-69.2-41.9178.3-174.752176.3147.90111.3T78 L82 A83 N84 S88 Y90 I91T78-K80 VanDerWaalsContact C-N 3.32Å; T78-K80 PolarHBondContact O-N 2.74Å; K80-L82 VanDerWaalsContact C-N 3.33Å; K80-L82 PolarHBondContact O-N 2.79Å; K80-A83 PolarHBondContact O-N 3.48Å; K80-N84 VanDerWaalsContact CE-OD1 3.22Å; K80-N84 WeakPolarHBondContact CE-OD1 3.25Å; K80-N84 PolarHBondContact NZ-OD1 3.38Å; K80-N84 WeakPolarHBondContact O-CB 3.22Å; K80-N84 PolarHBondContact O-N 3Å; K80-N84 PolarHBondContact O-ND2 3.43Å; K80-N84 PolarHBondContact O-OD1 2.97Å; K80-S88 PolarHBondContact NZ-O 3.12Å; K80-Y90 VanDerWaalsContact CE-O 3.28Å; K80-Y90 WeakPolarHBondContact CE-O 3.31Å; K80-Y90 PolarHBondContact NZ-O 3.45Å; K80-I91 HydrophobicContact CG-CD1 4.36Å
81T83.6Confident84Confident3 Ų337.6 Ų37.62%0.01821%0.21CC..Hα-helixtrans-57.5-45.2173.3-53.70000111.7F31 V77 T78 N84 L85 F176F31-T81 HydrophobicContact CD2-CG2 3.93Å; F31-T81 HydrophobicContact CE2-CG2 3.93Å; V77-T81 WeakPolarHBondContact O-CB 3.43Å; V77-T81 PolarHBondContact O-N 3.36Å; V77-T81 VanDerWaalsContact O-N 3.09Å; V77-T81 PolarHBondContact O-OG1 3.49Å; T78-T81 WeakPolarHBondContact O-CB 3.43Å; T78-T81 PolarHBondContact O-N 3.38Å; T81-N84 PolarHBondContact O-N 3.06Å; T81-L85 WeakPolarHBondContact O-CG 3.38Å; T81-L85 PolarHBondContact O-N 3.31Å; T81-L85 VanDerWaalsContact O-N 3.13Å; T81-F176 HydrophobicContact CG2-CD2 3.59Å; T81-F176 HydrophobicContact CG2-CE2 4.11Å; T81-F176 HydrophobicContact CG2-CG 4.44Å; T81-F176 WeakPolarHBondContact OG1-CD2 3.27Å
82L86.6Confident83.9Confident15 Ų1539.3 Ų39.38%0.07922%0.224CC..Hα-helixtrans-63-42.1177.1-72.5172.2000112.2F28 F31 L32 T78 P79 K80 L85F28-L82 HydrophobicContact CD2-CB 4.21Å; F28-L82 HydrophobicContact CD2-CD2 3.58Å; F28-L82 HydrophobicContact CE2-CB 3.98Å; F28-L82 HydrophobicContact CE2-CD2 3.79Å; F28-L82 HydrophobicContact CE2-CG 4.41Å; F28-L82 HydrophobicContact CG-CD2 4.28Å; F28-L82 WeakPolarHBondContact O-CD2 3.3Å; F31-L82 HydrophobicContact CB-CD2 3.71Å; L32-L82 HydrophobicContact CB-CD1 4.47Å; L32-L82 HydrophobicContact CB-CD2 4.15Å; L32-L82 HydrophobicContact CD1-CD1 4.16Å; T78-L82 HydrophobicContact CG2-CD1 3.98Å; T78-L82 HydrophobicContact CG2-CG 4.17Å; T78-L82 WeakPolarHBondContact O-CB 3.29Å; T78-L82 VanDerWaalsContact O-CG 3.31Å; T78-L82 WeakPolarHBondContact O-CG 3.29Å; T78-L82 PolarHBondContact O-N 2.99Å; P79-L82 PolarHBondContact O-N 2.95Å; K80-L82 VanDerWaalsContact C-N 3.33Å; K80-L82 PolarHBondContact O-N 2.79Å; L82-L85 PolarHBondContact O-N 3.05Å
83A85.9Confident83.5Confident35 Ų3540 Ų4029%0.28922%0.223SC..Hα-helixtrans-65-39.1176.700000112.5P79 K80 L85 L86 T87P79-A83 PolarHBondContact O-N 3.27Å; K80-A83 PolarHBondContact O-N 3.48Å; A83-L85 VanDerWaalsContact C-N 3.29Å; A83-L85 PolarHBondContact O-N 2.93Å; A83-L86 PolarHBondContact O-N 3.44Å; A83-L86 VanDerWaalsContact O-N 3.15Å; A83-T87 PolarHBondContact O-N 3.42Å; A83-T87 PolarHBondContact O-OG1 3.34Å; A83-T87 VanDerWaalsContact O-OG1 3.07Å
84N82.9Confident83.6Confident10 Ų1044.6 Ų44.65%0.05325%0.253CS..Hα-helixtrans-62.9-36176.4-66.6-8.3000111.5L14 K80 T81 L86 S88 N89 F176L14-N84 VanDerWaalsContact CD1-ND2 3.26Å; L14-N84 WeakPolarHBondContact CD1-ND2 3.41Å; K80-N84 VanDerWaalsContact CE-OD1 3.22Å; K80-N84 WeakPolarHBondContact CE-OD1 3.25Å; K80-N84 PolarHBondContact NZ-OD1 3.38Å; K80-N84 WeakPolarHBondContact O-CB 3.22Å; K80-N84 PolarHBondContact O-N 3Å; K80-N84 PolarHBondContact O-ND2 3.43Å; K80-N84 PolarHBondContact O-OD1 2.97Å; T81-N84 PolarHBondContact O-N 3.06Å; N84-L86 PolarHBondContact O-N 2.85Å; N84-S88 PolarHBondContact OD1-O 3.23Å; N84-N89 WeakPolarHBondContact CB-OD1 3.3Å; N84-N89 PolarHBondContact O-OD1 3.13Å; N84-F176 PolarHBondContact ND2-O 3.34Å
85L81.7Confident83.7Confident12 Ų1245.8 Ų45.86%0.06327%0.265CS..THydrogen-bonded Turntrans-69-16.3176.4-69170.3000114Q24 L27 F28 F31 T81 L82 A83Q24-L85 HydrophobicContact CB-CD2 4.26Å; Q24-L85 HydrophobicContact CG-CD2 4.16Å; L27-L85 HydrophobicContact CB-CD1 4.15Å; L27-L85 HydrophobicContact CB-CD2 4.49Å; F28-L85 HydrophobicContact CB-CB 4.3Å; F28-L85 HydrophobicContact CB-CD1 4.15Å; F28-L85 HydrophobicContact CD2-CB 4.45Å; F31-L85 HydrophobicContact CD2-CD1 3.88Å; F31-L85 HydrophobicContact CE2-CD1 4.28Å; T81-L85 WeakPolarHBondContact O-CG 3.38Å; T81-L85 PolarHBondContact O-N 3.31Å; T81-L85 VanDerWaalsContact O-N 3.13Å; L82-L85 PolarHBondContact O-N 3.05Å; A83-L85 VanDerWaalsContact C-N 3.29Å; A83-L85 PolarHBondContact O-N 2.93Å
86L80.3Confident83.6Confident93 Ų9342.8 Ų42.849%0.48725%0.247SC..THydrogen-bonded Turntrans-111.8-39.6-174.6-68.9-179.2000115.1M25 F28 A83 N84M25-L86 HydrophobicContact SD-CD2 4.31Å; F28-L86 HydrophobicContact CD1-CD2 4.41Å; F28-L86 HydrophobicContact CD2-CD1 3.87Å; F28-L86 HydrophobicContact CD2-CD2 3.92Å; F28-L86 HydrophobicContact CD2-CG 3.66Å; F28-L86 HydrophobicContact CE1-CD1 4.46Å; F28-L86 HydrophobicContact CE2-CD1 3.27Å; F28-L86 HydrophobicContact CE2-CD2 4.13Å; F28-L86 HydrophobicContact CE2-CG 3.64Å; F28-L86 HydrophobicContact CG-CD2 4.08Å; F28-L86 HydrophobicContact CG-CG 4.33Å; F28-L86 HydrophobicContact CZ-CD1 3.63Å; F28-L86 HydrophobicContact CZ-CD2 4.46Å; F28-L86 HydrophobicContact CZ-CG 4.29Å; A83-L86 PolarHBondContact O-N 3.44Å; A83-L86 VanDerWaalsContact O-N 3.15Å; N84-L86 PolarHBondContact O-N 2.85Å
87T72.3Confident83.7Confident119 Ų11942 Ų4273%0.7324%0.241SC*.THydrogen-bonded Turntrans-136.9-52.5-160.6530000114.7A83A83-T87 PolarHBondContact O-N 3.42Å; A83-T87 PolarHBondContact O-OG1 3.34Å; A83-T87 VanDerWaalsContact O-OG1 3.07Å
88S70.3Confident84.2Confident50 Ų5043.8 Ų43.835%0.3526%0.256SS..  trans-154.6123.9-167.5174.60000111.8K80 N84 Y90K80-S88 PolarHBondContact NZ-O 3.12Å; N84-S88 PolarHBondContact OD1-O 3.23Å; S88-Y90 VanDerWaalsContact C-N 3.27Å; S88-Y90 PolarHBondContact O-N 2.97Å; S88-Y90 WeakPolarHBondContact OG-CD2 2.74Å; S88-Y90 PolarHBondContact OG-N 3.44Å
89N81Confident84.5Confident55 Ų5544.3 Ų44.329%0.29426%0.258SS..  trans-85.96.2180-68.4-28.1000113.5I13 L14 N84I13-N89 HydrophobicContact CG2-CB 4.38Å; L14-N89 PolarHBondContact N-O 3.26Å; L14-N89 WeakPolarHBondContact O-CB 3.5Å; N84-N89 WeakPolarHBondContact CB-OD1 3.3Å; N84-N89 PolarHBondContact O-OD1 3.13Å
90Y83.1Confident84.6Confident128 Ų12842.2 Ų42.250%0.50224%0.244SC..EExtended strand (participates in β ladder)trans-86.2137.1-175.9-65.3-88.9000111.8D11 F12 I13 K80 S88D11-Y90 HydrophobicContact CB-CD1 4.32Å; F12-Y90 CarbonylContact O-C 3.16Å; F12-Y90 VanDerWaalsContact O-CA 3.29Å; F12-Y90 WeakPolarHBondContact O-CA 3.45Å; I13-Y90 HydrophobicContact CD1-CE1 3.77Å; I13-Y90 HydrophobicContact CG1-CD1 3.76Å; I13-Y90 HydrophobicContact CG1-CE1 3.49Å; I13-Y90 VanDerWaalsContact CG1-CE1 3.49Å; K80-Y90 VanDerWaalsContact CE-O 3.28Å; K80-Y90 WeakPolarHBondContact CE-O 3.31Å; K80-Y90 PolarHBondContact NZ-O 3.45Å; S88-Y90 VanDerWaalsContact C-N 3.27Å; S88-Y90 PolarHBondContact O-N 2.97Å; S88-Y90 WeakPolarHBondContact OG-CD2 2.74Å; S88-Y90 PolarHBondContact OG-N 3.44Å
91I86.1Confident84.9Confident13 Ų1341.3 Ų41.37%0.06724%0.24CC..EExtended strand (participates in β ladder)trans-131.5133169.8-169.7169.1000109.1F12 L14 K80 C96F12-I91 HydrophobicContact CB-CG2 3.82Å; F12-I91 PolarHBondContact N-O 3.48Å; F12-I91 PolarHBondContact O-N 3.28Å; L14-I91 HydrophobicContact CD1-CB 4.07Å; L14-I91 HydrophobicContact CD1-CD1 4.44Å; L14-I91 HydrophobicContact CD1-CG2 3.79Å; L14-I91 HydrophobicContact CD2-CG2 4.28Å; L14-I91 HydrophobicContact CG-CG2 3.84Å; K80-I91 HydrophobicContact CG-CD1 4.36Å; I91-C96 HydrophobicContact CD1-CB 4.27Å; I91-C96 HydrophobicContact CG1-CB 4.37Å; I91-C96 HydrophobicContact CG2-CB 4.22Å
92S87.9Confident85.4Confident55 Ų5545.9 Ų45.939%0.38526%0.26SS..  trans-66.6154.2177.267.90000110.8D11 T94 G95 C96D11-S92 VanDerWaalsContact OD1-CA 3.29Å; D11-S92 WeakPolarHBondContact OD1-CA 3.38Å; S92-T94 VanDerWaalsContact C-N 3.29Å; S92-T94 PolarHBondContact O-N 2.88Å; S92-G95 WeakPolarHBondContact O-CA 3.3Å; S92-G95 PolarHBondContact O-N 2.96Å; S92-G95 PolarHBondContact OG-N 3.38Å; S92-G95 VanDerWaalsContact OG-N 3.08Å; S92-C96 WeakPolarHBondContact O-CB 3.25Å; S92-C96 PolarHBondContact O-N 2.92Å
93F83.3Confident85.4Confident44 Ų4445.9 Ų45.919%0.19326%0.259CS..Hα-helixtrans-51.7-50175.3179.2-90.3000111.7V9 F12 G95 C96 F97 F167V9-F93 HydrophobicContact CB-CB 4.09Å; V9-F93 HydrophobicContact CB-CG 4.32Å; V9-F93 HydrophobicContact CG1-CB 3.5Å; V9-F93 HydrophobicContact CG1-CD1 4.29Å; V9-F93 HydrophobicContact CG1-CD2 3.43Å; V9-F93 VanDerWaalsContact CG1-CD2 3.43Å; V9-F93 HydrophobicContact CG1-CE2 4.17Å; V9-F93 HydrophobicContact CG1-CG 3.49Å; V9-F93 VanDerWaalsContact CG1-CG 3.49Å; F12-F93 HydrophobicContact CE2-CB 4.22Å; F12-F93 AromaticContact CE2-CD2 3.53Å; F12-F93 HydrophobicContact CE2-CD2 3.53Å; F12-F93 HydrophobicContact CE2-CE2 4.35Å; F12-F93 HydrophobicContact CE2-CG 4.25Å; F12-F93 AromaticContact CZ-CD2 3.82Å; F12-F93 HydrophobicContact CZ-CD2 3.82Å; F12-F93 HydrophobicContact CZ-CE2 4.36Å; F93-G95 VanDerWaalsContact C-N 3.32Å; F93-G95 PolarHBondContact O-N 2.85Å; F93-C96 WeakPolarHBondContact O-CB 3.33Å; F93-C96 PolarHBondContact O-N 3.35Å; F93-F97 HydrophobicContact CD1-CD2 4.12Å; F93-F97 HydrophobicContact CD1-CE2 4.44Å; F93-F97 HydrophobicContact CD2-CD2 4.08Å; F93-F97 AromaticContact CD2-CE2 3.76Å; F93-F97 HydrophobicContact CD2-CE2 3.76Å; F93-F97 AromaticContact CE1-CD2 3.87Å; F93-F97 HydrophobicContact CE1-CD2 3.87Å; F93-F97 AromaticContact CE1-CE2 3.96Å; F93-F97 HydrophobicContact CE1-CE2 3.96Å; F93-F97 HydrophobicContact CE1-CG 4.48Å; F93-F97 AromaticContact CE2-CD2 3.85Å; F93-F97 HydrophobicContact CE2-CD2 3.85Å; F93-F97 AromaticContact CE2-CE2 3.21Å; F93-F97 HydrophobicContact CE2-CE2 3.21Å; F93-F97 AromaticContact CE2-CZ 3.93Å; F93-F97 HydrophobicContact CE2-CZ 3.93Å; F93-F97 HydrophobicContact CG-CD2 4.22Å; F93-F97 HydrophobicContact CG-CE2 4.35Å; F93-F97 AromaticContact CZ-CD2 3.72Å; F93-F97 HydrophobicContact CZ-CD2 3.72Å; F93-F97 AromaticContact CZ-CE2 3.32Å; F93-F97 HydrophobicContact CZ-CE2 3.32Å; F93-F97 AromaticContact CZ-CZ 3.8Å; F93-F97 HydrophobicContact CZ-CZ 3.8Å; F93-F97 WeakPolarHBondContact O-CD2 3.41Å; F93-F97 PolarHBondContact O-N 3.44Å; F93-F167 HydrophobicContact CE2-CD2 4.35Å; F93-F167 HydrophobicContact CE2-CE2 4.02Å
94T86.9Confident85.6Confident108 Ų10845.5 Ų45.566%0.66326%0.256SS*.Hα-helixtrans-62.3-39.4177.6-50.40000112S92 A98S92-T94 VanDerWaalsContact C-N 3.29Å; S92-T94 PolarHBondContact O-N 2.88Å; T94-A98 WeakPolarHBondContact O-CB 3.37Å; T94-A98 PolarHBondContact O-N 3.44Å
95G88.5Confident86.1Confident26 Ų2646.5 Ų46.527%0.26826%0.26SS..Hα-helixtrans-63-41.417600000112.5S92 F93 A98 Q99S92-G95 WeakPolarHBondContact O-CA 3.3Å; S92-G95 PolarHBondContact O-N 2.96Å; S92-G95 PolarHBondContact OG-N 3.38Å; S92-G95 VanDerWaalsContact OG-N 3.08Å; F93-G95 VanDerWaalsContact C-N 3.32Å; F93-G95 PolarHBondContact O-N 2.85Å; G95-A98 PolarHBondContact O-N 3.18Å; G95-Q99 WeakPolarHBondContact O-CB 3.47Å; G95-Q99 PolarHBondContact O-N 2.86Å
96C88.1Confident86.6Confident0 Ų046.1 Ų46.10%026%0.258CS..Hα-helixtrans-63.5-49178.6-1710000112.2F12 I91 S92 F93 Q99 M100 C178F12-C96 HydrophobicContact CD2-CB 3.92Å; F12-C96 HydrophobicContact CE2-CB 4.25Å; I91-C96 HydrophobicContact CD1-CB 4.27Å; I91-C96 HydrophobicContact CG1-CB 4.37Å; I91-C96 HydrophobicContact CG2-CB 4.22Å; S92-C96 WeakPolarHBondContact O-CB 3.25Å; S92-C96 PolarHBondContact O-N 2.92Å; F93-C96 WeakPolarHBondContact O-CB 3.33Å; F93-C96 PolarHBondContact O-N 3.35Å; C96-Q99 WeakPolarHBondContact O-CB 3.38Å; C96-Q99 PolarHBondContact O-N 3.33Å; C96-M100 WeakPolarHBondContact O-CG 3.36Å; C96-M100 PolarHBondContact O-N 3.32Å; C96-C178 WeakPolarHBondContact CA-SG 3.21Å; C96-C178 HydrophobicContact CB-CB 3.99Å; C96-C178 WeakPolarHBondContact CB-SG 3.33Å; C96-C178 WeakPolarHBondContact SG-CB 3.45Å; C96-C178 CovalentContact SG-SG 2.02Å; C96-C178 PolarHBondContact SG-SG 3.43Å
97F89.8Confident87Confident12 Ų1242.3 Ų42.35%0.05324%0.242CC..Hα-helixtrans-70-34.2178.1-83.5-96.1000112.8F93 Q99 M100 F101 V159 M162 F167F93-F97 HydrophobicContact CD1-CD2 4.12Å; F93-F97 HydrophobicContact CD1-CE2 4.44Å; F93-F97 HydrophobicContact CD2-CD2 4.08Å; F93-F97 AromaticContact CD2-CE2 3.76Å; F93-F97 HydrophobicContact CD2-CE2 3.76Å; F93-F97 AromaticContact CE1-CD2 3.87Å; F93-F97 HydrophobicContact CE1-CD2 3.87Å; F93-F97 AromaticContact CE1-CE2 3.96Å; F93-F97 HydrophobicContact CE1-CE2 3.96Å; F93-F97 HydrophobicContact CE1-CG 4.48Å; F93-F97 AromaticContact CE2-CD2 3.85Å; F93-F97 HydrophobicContact CE2-CD2 3.85Å; F93-F97 AromaticContact CE2-CE2 3.21Å; F93-F97 HydrophobicContact CE2-CE2 3.21Å; F93-F97 AromaticContact CE2-CZ 3.93Å; F93-F97 HydrophobicContact CE2-CZ 3.93Å; F93-F97 HydrophobicContact CG-CD2 4.22Å; F93-F97 HydrophobicContact CG-CE2 4.35Å; F93-F97 AromaticContact CZ-CD2 3.72Å; F93-F97 HydrophobicContact CZ-CD2 3.72Å; F93-F97 AromaticContact CZ-CE2 3.32Å; F93-F97 HydrophobicContact CZ-CE2 3.32Å; F93-F97 AromaticContact CZ-CZ 3.8Å; F93-F97 HydrophobicContact CZ-CZ 3.8Å; F93-F97 WeakPolarHBondContact O-CD2 3.41Å; F93-F97 PolarHBondContact O-N 3.44Å; F97-Q99 VanDerWaalsContact C-N 3.35Å; F97-M100 HydrophobicContact CD1-CE 4.46Å; F97-M100 PolarHBondContact O-N 3.29Å; F97-F101 WeakPolarHBondContact O-CB 3.42Å; F97-F101 PolarHBondContact O-N 2.99Å; F97-V159 HydrophobicContact CB-CG1 4.5Å; F97-V159 HydrophobicContact CD1-CG1 4.02Å; F97-M162 HydrophobicContact CE1-CB 3.75Å; F97-M162 HydrophobicContact CZ-CB 4.41Å; F97-F167 HydrophobicContact CZ-CE2 4.2Å; F97-F167 HydrophobicContact CZ-CZ 4Å
98A91.8Very high88Confident39 Ų3937.5 Ų37.532%0.32221%0.212SC..Hα-helixtrans-63.7-42.7171.700000111.2T94 G95 F101 F102T94-A98 WeakPolarHBondContact O-CB 3.37Å; T94-A98 PolarHBondContact O-N 3.44Å; G95-A98 PolarHBondContact O-N 3.18Å; A98-F101 WeakPolarHBondContact O-CB 3.36Å; A98-F101 PolarHBondContact O-N 2.97Å; A98-F102 WeakPolarHBondContact O-CD2 3.47Å; A98-F102 PolarHBondContact O-N 2.99Å
99Q91.2Very high89.1Confident13 Ų1335.1 Ų35.16%0.06120%0.195CC..Hα-helixtrans-60.6-47.8177.1-167.5-172.2-45.900111.3V76 G95 C96 F97 F101 F102 F103 F177V76-Q99 HydrophobicContact CG1-CB 4.44Å; V76-Q99 HydrophobicContact CG1-CG 3.57Å; V76-Q99 WeakPolarHBondContact CG1-O 3.1Å; G95-Q99 WeakPolarHBondContact O-CB 3.47Å; G95-Q99 PolarHBondContact O-N 2.86Å; C96-Q99 WeakPolarHBondContact O-CB 3.38Å; C96-Q99 PolarHBondContact O-N 3.33Å; F97-Q99 VanDerWaalsContact C-N 3.35Å; Q99-F101 PolarHBondContact O-N 3.15Å; Q99-F102 PolarHBondContact O-N 3.2Å; Q99-F103 WeakPolarHBondContact O-CB 3.01Å; Q99-F103 PolarHBondContact O-N 3.45Å; Q99-F177 VanDerWaalsContact NE2-CB 3.29Å; Q99-F177 VanDerWaalsContact NE2-CD2 3.31Å
100M89Confident89.7Confident7 Ų732.6 Ų32.63%0.03418%0.182CC..Hα-helixtrans-61.3-42175.7-73168.340.100112.6C96 F97 F103 A104 M162 C178 I183C96-M100 WeakPolarHBondContact O-CG 3.36Å; C96-M100 PolarHBondContact O-N 3.32Å; F97-M100 HydrophobicContact CD1-CE 4.46Å; F97-M100 PolarHBondContact O-N 3.29Å; M100-F103 PolarHBondContact O-N 2.95Å; M100-A104 WeakPolarHBondContact O-CB 3.45Å; M100-A104 PolarHBondContact O-N 3.23Å; M100-M162 HydrophobicContact CE-CE 3.32Å; M100-M162 HydrophobicContact CE-SD 3.3Å; M100-M162 WeakPolarHBondContact CE-SD 3.35Å; M100-M162 HydrophobicContact SD-CE 4.38Å; M100-C178 HydrophobicContact CG-CB 3.98Å; M100-C178 VanDerWaalsContact CG-O 3.23Å; M100-C178 WeakPolarHBondContact CG-O 3.38Å; M100-C178 HydrophobicContact SD-CB 4.32Å; M100-I183 HydrophobicContact SD-CG1 3.89Å
101F93.1Very high90.1Very high30 Ų3026.7 Ų26.713%0.13216%0.159CC..Hα-helixtrans-55.2-56176.7176.4-97.4000111F97 A98 Q99 F103 A104 F105 F152 S155 F156 V159F97-F101 WeakPolarHBondContact O-CB 3.42Å; F97-F101 PolarHBondContact O-N 2.99Å; A98-F101 WeakPolarHBondContact O-CB 3.36Å; A98-F101 PolarHBondContact O-N 2.97Å; Q99-F101 PolarHBondContact O-N 3.15Å; F101-F103 VanDerWaalsContact C-N 3.32Å; F101-F103 PolarHBondContact O-N 3.3Å; F101-A104 PolarHBondContact O-N 3.16Å; F101-F105 WeakPolarHBondContact O-CB 3.48Å; F101-F105 PolarHBondContact O-N 3.34Å; F101-F152 HydrophobicContact CE1-CD2 4.4Å; F101-F152 HydrophobicContact CE1-CE2 4.39Å; F101-F152 AromaticContact CZ-CD2 3.61Å; F101-F152 HydrophobicContact CZ-CD2 3.61Å; F101-F152 AromaticContact CZ-CE2 3.63Å; F101-F152 HydrophobicContact CZ-CE2 3.63Å; F101-F152 HydrophobicContact CZ-CG 4.34Å; F101-F152 HydrophobicContact CZ-CZ 4.37Å; F101-S155 WeakPolarHBondContact O-CB 3.28Å; F101-F156 HydrophobicContact CE2-CB 4.06Å; F101-V159 HydrophobicContact CB-CG2 3.9Å; F101-V159 HydrophobicContact CD2-CG2 4.36Å
102F93.1Very high90.5Very high99 Ų9927.7 Ų27.743%0.43416%0.163SC..Hα-helixtrans-66.8-36.5-177.6-75.1-67.7000111.9V76 A98 Q99 F105 L106V76-F102 HydrophobicContact CG1-CB 4.14Å; V76-F102 HydrophobicContact CG2-CB 3.56Å; V76-F102 HydrophobicContact CG2-CG 4.3Å; A98-F102 WeakPolarHBondContact O-CD2 3.47Å; A98-F102 PolarHBondContact O-N 2.99Å; Q99-F102 PolarHBondContact O-N 3.2Å; F102-F105 HydrophobicContact CD1-CD1 4.22Å; F102-F105 PolarHBondContact O-N 3.05Å; F102-L106 VanDerWaalsContact O-CB 3.28Å; F102-L106 WeakPolarHBondContact O-CB 3.2Å; F102-L106 WeakPolarHBondContact O-CD1 3.41Å; F102-L106 WeakPolarHBondContact O-CG 3.44Å; F102-L106 PolarHBondContact O-N 3.42Å
103F87.4Confident90.9Very high15 Ų1525.2 Ų25.27%0.06615%0.145CC..Hα-helixtrans-60.6-51.6176.8-174.6-95.2000112Y73 V76 V77 Q99 M100 F101 F105 G107 F177 Y277 T278Y73-F103 HydrophobicContact CD1-CE2 4.47Å; Y73-F103 HydrophobicContact CD2-CD2 4.46Å; Y73-F103 HydrophobicContact CE1-CD2 4.17Å; Y73-F103 AromaticContact CE1-CE2 3.53Å; Y73-F103 HydrophobicContact CE1-CE2 3.53Å; Y73-F103 HydrophobicContact CE1-CZ 4.24Å; Y73-F103 AromaticContact CE2-CD2 3.77Å; Y73-F103 HydrophobicContact CE2-CD2 3.77Å; Y73-F103 AromaticContact CE2-CE2 3.76Å; Y73-F103 HydrophobicContact CE2-CE2 3.76Å; Y73-F103 HydrophobicContact CE2-CG 4.35Å; Y73-F103 HydrophobicContact CE2-CZ 4.3Å; Y73-F103 AromaticContact CZ-CD2 3.65Å; Y73-F103 AromaticContact CZ-CE2 3.12Å; Y73-F103 AromaticContact CZ-CZ 3.57Å; Y73-F103 WeakPolarHBondContact OH-CE2 3.27Å; Y73-F103 WeakPolarHBondContact OH-CZ 3.33Å; V76-F103 HydrophobicContact CG1-CB 4.47Å; V77-F103 HydrophobicContact CG2-CD2 3.86Å; V77-F103 HydrophobicContact CG2-CE2 4.24Å; Q99-F103 WeakPolarHBondContact O-CB 3.01Å; Q99-F103 PolarHBondContact O-N 3.45Å; M100-F103 PolarHBondContact O-N 2.95Å; F101-F103 VanDerWaalsContact C-N 3.32Å; F101-F103 PolarHBondContact O-N 3.3Å; F103-F105 VanDerWaalsContact C-N 3.34Å; F103-F105 PolarHBondContact O-N 3.44Å; F103-G107 PolarHBondContact O-N 3.47Å; F103-F177 HydrophobicContact CZ-CZ 4.45Å; F103-Y277 HydrophobicContact CE1-CE2 4.37Å; F103-Y277 HydrophobicContact CE2-CE2 4.35Å; F103-Y277 AromaticContact CZ-CD2 3.92Å; F103-Y277 HydrophobicContact CZ-CD2 3.92Å; F103-Y277 AromaticContact CZ-CE2 3.56Å; F103-Y277 HydrophobicContact CZ-CE2 3.56Å; F103-T278 HydrophobicContact CE2-CG2 3.65Å; F103-T278 HydrophobicContact CZ-CG2 3.99Å
104A88.9Confident91.3Very high27 Ų2723.1 Ų23.122%0.22314%0.136CC..Hα-helixtrans-63.2-41.6176.700000111.6M100 F101 L106 G107 T108 S155M100-A104 WeakPolarHBondContact O-CB 3.45Å; M100-A104 PolarHBondContact O-N 3.23Å; F101-A104 PolarHBondContact O-N 3.16Å; A104-L106 PolarHBondContact O-N 3.28Å; A104-G107 PolarHBondContact O-N 2.93Å; A104-T108 PolarHBondContact O-N 3.37Å; A104-T108 PolarHBondContact O-OG1 2.86Å; A104-S155 WeakPolarHBondContact CB-OG 3.46Å
105F94.5Very high91.7Very high31 Ų3118.2 Ų18.214%0.13611%0.106CC..Hα-helixtrans-62-50.2-176.2158.6-123.4000111.2F101 F102 F103 A109 Y148 F152 S155F101-F105 WeakPolarHBondContact O-CB 3.48Å; F101-F105 PolarHBondContact O-N 3.34Å; F102-F105 HydrophobicContact CD1-CD1 4.22Å; F102-F105 PolarHBondContact O-N 3.05Å; F103-F105 VanDerWaalsContact C-N 3.34Å; F103-F105 PolarHBondContact O-N 3.44Å; F105-A109 WeakPolarHBondContact O-CB 3.26Å; F105-A109 PolarHBondContact O-N 3.19Å; F105-Y148 AromaticContact CE2-CD1 3.83Å; F105-Y148 HydrophobicContact CE2-CD1 3.83Å; F105-Y148 VanDerWaalsContact CE2-O 3.29Å; F105-Y148 WeakPolarHBondContact CE2-O 3.42Å; F105-Y148 AromaticContact CZ-CD1 3.56Å; F105-Y148 HydrophobicContact CZ-CD1 3.56Å; F105-Y148 HydrophobicContact CZ-CE1 4.32Å; F105-Y148 HydrophobicContact CZ-CG 4.44Å; F105-F152 HydrophobicContact CD2-CB 4.19Å; F105-F152 HydrophobicContact CE2-CB 4.2Å; F105-S155 WeakPolarHBondContact CA-OG 3.2Å; F105-S155 WeakPolarHBondContact CB-OG 3.02Å; F105-S155 PolarHBondContact N-OG 3.49Å
106L92.5Very high92.1Very high4 Ų417.4 Ų17.42%0.02110%0.096CC..Hα-helixtrans-68.1-39.9-179.2-67.8171.5000111.3I69 Y73 V76 F102 A104 A109 E110I69-L106 HydrophobicContact CB-CD2 4.49Å; I69-L106 HydrophobicContact CG1-CD2 4.23Å; I69-L106 HydrophobicContact CG2-CB 4.12Å; I69-L106 HydrophobicContact CG2-CD2 4.24Å; Y73-L106 HydrophobicContact CD2-CB 3.68Å; Y73-L106 HydrophobicContact CD2-CD1 4.23Å; Y73-L106 HydrophobicContact CE2-CB 4.31Å; V76-L106 HydrophobicContact CG2-CD1 4.2Å; F102-L106 VanDerWaalsContact O-CB 3.28Å; F102-L106 WeakPolarHBondContact O-CB 3.2Å; F102-L106 WeakPolarHBondContact O-CD1 3.41Å; F102-L106 WeakPolarHBondContact O-CG 3.44Å; F102-L106 PolarHBondContact O-N 3.42Å; A104-L106 PolarHBondContact O-N 3.28Å; L106-A109 PolarHBondContact O-N 2.92Å; L106-E110 WeakPolarHBondContact O-CB 3.33Å; L106-E110 PolarHBondContact O-N 3.43Å
107G88.6Confident92.5Very high14 Ų1417.4 Ų17.414%0.14410%0.096CC..Hα-helixtrans-63.1-43.8176.600000113F103 A104 E110 C111F103-G107 PolarHBondContact O-N 3.47Å; A104-G107 PolarHBondContact O-N 2.93Å; G107-E110 PolarHBondContact O-N 3.32Å; G107-C111 PolarHBondContact O-N 2.9Å; G107-C111 VanDerWaalsContact O-N 3.12Å; G107-C111 PolarHBondContact O-SG 3.43Å
108T91.9Very high92.7Very high17 Ų1716.9 Ų16.910%0.1049%0.094CC..Hα-helixtrans-65.2-43.5174.9-64.50000111.3A104 E110 C111 Y112 I150 T205A104-T108 PolarHBondContact O-N 3.37Å; A104-T108 PolarHBondContact O-OG1 2.86Å; T108-E110 VanDerWaalsContact C-N 3.33Å; T108-E110 PolarHBondContact O-N 3.26Å; T108-C111 PolarHBondContact O-N 2.99Å; T108-Y112 HydrophobicContact CG2-CD2 3.85Å; T108-Y112 HydrophobicContact CG2-CE2 3.64Å; T108-Y112 WeakPolarHBondContact O-CD2 3.41Å; T108-Y112 PolarHBondContact O-N 3.42Å; T108-I150 HydrophobicContact CG2-CG2 4.32Å; T108-T205 HydrophobicContact CG2-CG2 3.97Å
109A94.8Very high92.9Very high0 Ų017.5 Ų17.50%09%0.09CC..Hα-helixtrans-61.2-41.4177.200000111.7I69 F105 L106 Y112 L113 P147 Y148I69-A109 HydrophobicContact CD1-CB 3.86Å; F105-A109 WeakPolarHBondContact O-CB 3.26Å; F105-A109 PolarHBondContact O-N 3.19Å; L106-A109 PolarHBondContact O-N 2.92Å; A109-Y112 PolarHBondContact O-N 3.34Å; A109-L113 WeakPolarHBondContact O-CB 3.39Å; A109-L113 PolarHBondContact O-N 3.31Å; A109-P147 HydrophobicContact CB-CB 4.42Å; A109-Y148 HydrophobicContact CB-CD1 3.98Å; A109-Y148 HydrophobicContact CB-CE1 4.25Å
110E92.3Very high93.1Very high2 Ų217 Ų171%0.0099%0.087CC..Hα-helixtrans-60.3-46.5175.9-174.1169.3-176.600111.9L66 I69 L106 G107 T108 Y112 L113 L114 F250 N285L66-E110 HydrophobicContact CD1-CG 3.71Å; I69-E110 HydrophobicContact CG2-CB 4.16Å; L106-E110 WeakPolarHBondContact O-CB 3.33Å; L106-E110 PolarHBondContact O-N 3.43Å; G107-E110 PolarHBondContact O-N 3.32Å; T108-E110 VanDerWaalsContact C-N 3.33Å; T108-E110 PolarHBondContact O-N 3.26Å; E110-Y112 PolarHBondContact O-N 3.41Å; E110-L113 PolarHBondContact O-N 3.17Å; E110-L114 HydrophobicContact CG-CD1 4.24Å; E110-L114 HydrophobicContact CG-CG 4.42Å; E110-L114 WeakPolarHBondContact O-CG 3.36Å; E110-L114 PolarHBondContact O-N 3.16Å; E110-F250 HydrophobicContact CB-CE2 4.5Å; E110-F250 HydrophobicContact CB-CZ 4.16Å; E110-F250 HydrophobicContact CG-CD2 4.47Å; E110-F250 HydrophobicContact CG-CE1 4.47Å; E110-F250 HydrophobicContact CG-CE2 3.84Å; E110-F250 HydrophobicContact CG-CZ 3.81Å; E110-F250 WeakPolarHBondContact OE1-CD2 3.4Å; E110-F250 VanDerWaalsContact OE1-CE2 3.32Å; E110-F250 WeakPolarHBondContact OE1-CE2 3.3Å; E110-F250 WeakPolarHBondContact OE2-CE2 3.45Å; E110-N285 PolarHBondContact OE1-ND2 3.36Å
111C92.2Very high93.3Very high5 Ų518.1 Ų18.13%0.0349%0.091CC..Hα-helixtrans-54.1-50.5179-68.80000112.1G107 T108 S115 T205 Y251G107-C111 PolarHBondContact O-N 2.9Å; G107-C111 VanDerWaalsContact O-N 3.12Å; G107-C111 PolarHBondContact O-SG 3.43Å; T108-C111 PolarHBondContact O-N 2.99Å; C111-S115 PolarHBondContact O-N 2.96Å; C111-S115 PolarHBondContact O-OG 3.38Å; C111-T205 HydrophobicContact CB-CG2 3.85Å; C111-Y251 PolarHBondContact O-OH 3.41Å
112Y95.5Very high93.4Very high34 Ų3420 Ų2013%0.13310%0.098CC..Hα-helixtrans-74.7-28-179.8-69.7-60.1000113.3T108 A109 E110 S115 S116 I150 T205 V208T108-Y112 HydrophobicContact CG2-CD2 3.85Å; T108-Y112 HydrophobicContact CG2-CE2 3.64Å; T108-Y112 WeakPolarHBondContact O-CD2 3.41Å; T108-Y112 PolarHBondContact O-N 3.42Å; A109-Y112 PolarHBondContact O-N 3.34Å; E110-Y112 PolarHBondContact O-N 3.41Å; Y112-S115 WeakPolarHBondContact O-CB 3.34Å; Y112-S115 PolarHBondContact O-N 3.06Å; Y112-S116 PolarHBondContact O-N 3.03Å; Y112-S116 PolarHBondContact O-OG 2.98Å; Y112-I150 HydrophobicContact CD2-CG2 4.26Å; Y112-I150 HydrophobicContact CE2-CB 4.24Å; Y112-I150 HydrophobicContact CE2-CD1 4.38Å; Y112-I150 HydrophobicContact CE2-CG2 3.53Å; Y112-T205 HydrophobicContact CE2-CG2 3.98Å; Y112-V208 HydrophobicContact CE1-CB 4.19Å; Y112-V208 HydrophobicContact CE1-CG1 3.88Å
113L95Very high93.5Very high2 Ų215.2 Ų15.21%0.018%0.077CC..Hα-helixtrans-68.3-41.1174.5-172.660.4000111.3F62 H65 L66 I69 A109 E110 S115 S116 M117 I144F62-L113 HydrophobicContact CB-CD1 4.04Å; F62-L113 HydrophobicContact CD1-CD1 3.79Å; F62-L113 HydrophobicContact CG-CD1 4.3Å; H65-L113 HydrophobicContact CB-CD2 3.88Å; L66-L113 HydrophobicContact CB-CD2 3.87Å; L66-L113 HydrophobicContact CD1-CD2 4.33Å; I69-L113 HydrophobicContact CD1-CD2 3.86Å; A109-L113 WeakPolarHBondContact O-CB 3.39Å; A109-L113 PolarHBondContact O-N 3.31Å; E110-L113 PolarHBondContact O-N 3.17Å; L113-S115 VanDerWaalsContact C-N 3.28Å; L113-S115 PolarHBondContact O-N 2.92Å; L113-S116 WeakPolarHBondContact O-CB 3.42Å; L113-S116 PolarHBondContact O-N 2.9Å; L113-S116 VanDerWaalsContact O-N 3.08Å; L113-M117 WeakPolarHBondContact O-CG 3.34Å; L113-M117 PolarHBondContact O-N 3.04Å; L113-I144 HydrophobicContact CD1-CD1 3.48Å; L113-I144 VanDerWaalsContact CD1-CD1 3.48Å
114L93.1Very high93.8Very high0 Ų016 Ų160%09%0.086CC..Hα-helixtrans-60.3-37.6171.5-69.3173.9000111.7L66 E110 M117 A118 I213 H243 V247 F250 Y251L66-L114 HydrophobicContact CD2-CD2 4.3Å; E110-L114 HydrophobicContact CG-CD1 4.24Å; E110-L114 HydrophobicContact CG-CG 4.42Å; E110-L114 WeakPolarHBondContact O-CG 3.36Å; E110-L114 PolarHBondContact O-N 3.16Å; L114-M117 HydrophobicContact CD2-SD 4.32Å; L114-M117 PolarHBondContact O-N 3.25Å; L114-A118 PolarHBondContact O-N 3.45Å; L114-I213 HydrophobicContact CB-CD1 4.24Å; L114-H243 PolarHBondContact O-CE1 3.43Å; L114-H243 PolarHBondContact O-NE2 3.44Å; L114-V247 HydrophobicContact CB-CG2 4.44Å; L114-V247 HydrophobicContact CD2-CG2 4.42Å; L114-F250 HydrophobicContact CD1-CB 4.3Å; L114-F250 HydrophobicContact CD1-CD1 3.57Å; L114-F250 HydrophobicContact CD1-CE1 3.98Å; L114-F250 HydrophobicContact CD1-CG 3.92Å; L114-Y251 HydrophobicContact CD1-CE2 4.17Å
115S95.4Very high93.9Very high6 Ų616 Ų164%0.0428%0.082CC..Hα-helixtrans-65.2-39.4172.1-57.70000112.7C111 Y112 L113 M117 A118 H119 S209C111-S115 PolarHBondContact O-N 2.96Å; C111-S115 PolarHBondContact O-OG 3.38Å; Y112-S115 WeakPolarHBondContact O-CB 3.34Å; Y112-S115 PolarHBondContact O-N 3.06Å; L113-S115 VanDerWaalsContact C-N 3.28Å; L113-S115 PolarHBondContact O-N 2.92Å; S115-M117 VanDerWaalsContact C-N 3.33Å; S115-M117 PolarHBondContact O-N 3.33Å; S115-A118 WeakPolarHBondContact O-CB 3.24Å; S115-A118 PolarHBondContact O-N 3.35Å; S115-H119 PolarHBondContact O-N 3.45Å; S115-S209 WeakPolarHBondContact OG-CA 3.33Å; S115-S209 VanDerWaalsContact OG-CB 3.27Å; S115-S209 WeakPolarHBondContact OG-CB 3.36Å; S115-S209 PolarHBondContact OG-O 2.8Å
116S96.7Very high93.8Very high9 Ų915.9 Ų15.96%0.0639%0.085CC..Hα-helixtrans-64.5-38.5176.1-60.30000111.9Y112 L113 H119 D120 L143Y112-S116 PolarHBondContact O-N 3.03Å; Y112-S116 PolarHBondContact O-OG 2.98Å; L113-S116 WeakPolarHBondContact O-CB 3.42Å; L113-S116 PolarHBondContact O-N 2.9Å; L113-S116 VanDerWaalsContact O-N 3.08Å; S116-H119 WeakPolarHBondContact O-CB 3.29Å; S116-H119 PolarHBondContact O-N 3.09Å; S116-D120 PolarHBondContact O-N 2.87Å; S116-L143 PolarHBondContact OG-O 3.26Å
117M95.1Very high93.9Very high0 Ų017.4 Ų17.40%010%0.096CC..Hα-helixtrans-66.4-37.9172.9-68.1168.273.100112.1M59 F62 L63 L66 L113 L114 S115 H119 D120 R121 H243 Y289M59-M117 HydrophobicContact CE-CE 3.37Å; M59-M117 HydrophobicContact SD-CB 4.25Å; M59-M117 HydrophobicContact SD-CE 4.14Å; M59-M117 HydrophobicContact SD-CG 4.42Å; F62-M117 HydrophobicContact CB-CG 3.5Å; F62-M117 VanDerWaalsContact CB-CG 3.5Å; F62-M117 HydrophobicContact CB-SD 4.21Å; F62-M117 HydrophobicContact CD2-CG 4.23Å; F62-M117 HydrophobicContact CG-CG 4.08Å; L63-M117 HydrophobicContact CD1-CE 4.05Å; L66-M117 HydrophobicContact CD2-CE 4.26Å; L66-M117 HydrophobicContact CD2-SD 4.14Å; L113-M117 WeakPolarHBondContact O-CG 3.34Å; L113-M117 PolarHBondContact O-N 3.04Å; L114-M117 HydrophobicContact CD2-SD 4.32Å; L114-M117 PolarHBondContact O-N 3.25Å; S115-M117 VanDerWaalsContact C-N 3.33Å; S115-M117 PolarHBondContact O-N 3.33Å; M117-H119 VanDerWaalsContact C-N 3.34Å; M117-D120 WeakPolarHBondContact O-CB 3.37Å; M117-D120 PolarHBondContact O-N 3.36Å; M117-R121 WeakPolarHBondContact O-CG 3.33Å; M117-R121 PolarHBondContact O-N 3.03Å; M117-R121 VanDerWaalsContact O-N 3.13Å; M117-H243 WeakPolarHBondContact CB-NE2 3.37Å; M117-Y289 HydrophobicContact CE-CE1 3.87Å
118A95.1Very high93.9Very high0 Ų021 Ų210%012%0.116CC..Hα-helixtrans-62.8-41.3171.900000111.8L114 S115 R121 Y122 I213 Y217L114-A118 PolarHBondContact O-N 3.45Å; S115-A118 WeakPolarHBondContact O-CB 3.24Å; S115-A118 PolarHBondContact O-N 3.35Å; A118-R121 PolarHBondContact O-N 2.94Å; A118-Y122 PolarHBondContact O-N 3.35Å; A118-I213 HydrophobicContact CB-CB 4.28Å; A118-I213 HydrophobicContact CB-CG1 3.93Å; A118-I213 HydrophobicContact CB-CG2 4.35Å; A118-Y217 HydrophobicContact CB-CD2 4.47Å; A118-Y217 HydrophobicContact CB-CE2 4.03Å
119H95.7Very high94Very high53 Ų5327.8 Ų27.825%0.24515%0.151CC..Hα-helixtrans-63.7-41.3176.2179.9-88.1000112.2S115 S116 M117 R121 Y122 A123S115-H119 PolarHBondContact O-N 3.45Å; S116-H119 WeakPolarHBondContact O-CB 3.29Å; S116-H119 PolarHBondContact O-N 3.09Å; M117-H119 VanDerWaalsContact C-N 3.34Å; H119-R121 VanDerWaalsContact C-N 3.33Å; H119-R121 PolarHBondContact O-N 3.29Å; H119-Y122 WeakPolarHBondContact O-CB 3.39Å; H119-Y122 PolarHBondContact O-N 3.03Å; H119-A123 PolarHBondContact O-N 2.91Å
120D95.1Very high93.9Very high1 Ų133.4 Ų33.41%0.00518%0.177CC..Hα-helixtrans-54.9-49.3171.8173.672000111.8P58 M59 F62 S116 M117 Y122 A123 A124 Y131 M135P58-D120 WeakPolarHBondContact CB-OD1 3.33Å; M59-D120 WeakPolarHBondContact CB-OD2 3.18Å; F62-D120 HydrophobicContact CD2-CB 4.34Å; F62-D120 HydrophobicContact CE2-CB 4.03Å; S116-D120 PolarHBondContact O-N 2.87Å; M117-D120 WeakPolarHBondContact O-CB 3.37Å; M117-D120 PolarHBondContact O-N 3.36Å; D120-Y122 VanDerWaalsContact C-N 3.3Å; D120-Y122 PolarHBondContact O-N 2.89Å; D120-A123 PolarHBondContact O-N 2.91Å; D120-A124 WeakPolarHBondContact O-CB 3.36Å; D120-A124 PolarHBondContact O-N 3.47Å; D120-Y131 WeakPolarHBondContact OD1-CE2 3.14Å; D120-Y131 PolarHBondContact OD1-OH 3.21Å; D120-M135 VanDerWaalsContact CA-CE 3.48Å; D120-M135 HydrophobicContact CB-CE 3.48Å; D120-M135 VanDerWaalsContact CB-CE 3.48Å; D120-M135 WeakPolarHBondContact OD1-CE 3.29Å
121R93.7Very high94Very high31 Ų3135.3 Ų35.312%0.11719%0.185CC..Hα-helixtrans-63.9-38.9180-66.3-69.4155.4-166.47111.9M59 M117 A118 H119 A124 I125 I220M59-R121 HydrophobicContact SD-CG 4.39Å; M59-R121 PolarHBondContact SD-NE 3.37Å; M59-R121 PolarHBondContact SD-NH2 3.42Å; M117-R121 WeakPolarHBondContact O-CG 3.33Å; M117-R121 PolarHBondContact O-N 3.03Å; M117-R121 VanDerWaalsContact O-N 3.13Å; A118-R121 PolarHBondContact O-N 2.94Å; H119-R121 VanDerWaalsContact C-N 3.33Å; H119-R121 PolarHBondContact O-N 3.29Å; R121-A124 PolarHBondContact O-N 2.8Å; R121-I125 WeakPolarHBondContact O-CB 3.26Å; R121-I125 WeakPolarHBondContact O-CG1 3.3Å; R121-I125 PolarHBondContact O-N 3.44Å; R121-I125 VanDerWaalsContact O-N 3.07Å; R121-I220 HydrophobicContact CB-CD1 4.05Å
122Y95.1Very high93.9Very high69 Ų6940.3 Ų40.327%0.27122%0.215SC..Hα-helixtrans-58.9-53172.9162.1-95.2000110.9A118 H119 D120 A124 I125 C126 F219A118-Y122 PolarHBondContact O-N 3.35Å; H119-Y122 WeakPolarHBondContact O-CB 3.39Å; H119-Y122 PolarHBondContact O-N 3.03Å; D120-Y122 VanDerWaalsContact C-N 3.3Å; D120-Y122 PolarHBondContact O-N 2.89Å; Y122-A124 VanDerWaalsContact C-N 3.3Å; Y122-A124 PolarHBondContact O-N 3.38Å; Y122-I125 PolarHBondContact O-N 2.86Å; Y122-C126 HydrophobicContact CD2-CB 3.92Å; Y122-C126 WeakPolarHBondContact CD2-SG 3.49Å; Y122-C126 HydrophobicContact CE2-CB 3.71Å; Y122-C126 WeakPolarHBondContact O-CB 3.35Å; Y122-C126 PolarHBondContact O-N 2.99Å; Y122-F219 HydrophobicContact CD2-CB 3.78Å; Y122-F219 HydrophobicContact CE2-CB 3.59Å; Y122-F219 HydrophobicContact CE2-CD2 4.18Å; Y122-F219 HydrophobicContact CE2-CG 4.02Å
123A95.3Very high93.8Very high0 Ų043.9 Ų43.90%024%0.24CC..Hα-helixtrans-60.5-41.1-179.500000111.8H119 D120 I125 S127 Y131 I134 M135H119-A123 PolarHBondContact O-N 2.91Å; D120-A123 PolarHBondContact O-N 2.91Å; A123-I125 PolarHBondContact O-N 3.48Å; A123-S127 CarbonylContact O-C 3.57Å; A123-S127 VanDerWaalsContact O-C 3.27Å; A123-S127 PolarHBondContact O-N 2.98Å; A123-S127 VanDerWaalsContact O-N 3.16Å; A123-Y131 HydrophobicContact CB-CD2 3.96Å; A123-Y131 HydrophobicContact CB-CE2 4.37Å; A123-I134 HydrophobicContact CB-CB 4.48Å; A123-I134 HydrophobicContact CB-CG2 3.85Å; A123-M135 HydrophobicContact CB-CG 3.92Å; A123-M135 HydrophobicContact CB-SD 4.22Å
124A92.9Very high93.7Very high30 Ų3046.5 Ų46.525%0.24825%0.254CS..Hα-helixtrans-65.6-36.9-179.200000113.3D120 R121 Y122 Y131D120-A124 WeakPolarHBondContact O-CB 3.36Å; D120-A124 PolarHBondContact O-N 3.47Å; R121-A124 PolarHBondContact O-N 2.8Å; Y122-A124 VanDerWaalsContact C-N 3.3Å; Y122-A124 PolarHBondContact O-N 3.38Å; A124-Y131 VanDerWaalsContact CA-CD2 3.47Å; A124-Y131 HydrophobicContact CB-CD2 3.84Å; A124-Y131 HydrophobicContact CB-CE2 3.72Å
125I92Very high93.9Very high29 Ų2947 Ų4715%0.14926%0.256CS..Hα-helixtrans-94.2-45.2-175-63.7171.6000111.7R121 Y122 A123 I220 T223 I224 C240R121-I125 WeakPolarHBondContact O-CB 3.26Å; R121-I125 WeakPolarHBondContact O-CG1 3.3Å; R121-I125 PolarHBondContact O-N 3.44Å; R121-I125 VanDerWaalsContact O-N 3.07Å; Y122-I125 PolarHBondContact O-N 2.86Å; A123-I125 PolarHBondContact O-N 3.48Å; I125-I220 HydrophobicContact CD1-CG1 4.49Å; I125-I220 HydrophobicContact CD1-CG2 3.83Å; I125-I220 HydrophobicContact CG2-CG2 4.28Å; I125-T223 HydrophobicContact CG2-CG2 4.19Å; I125-I224 HydrophobicContact CG2-CG1 4.34Å; I125-C240 VanDerWaalsContact CD1-SG 3.51Å
126C92.8Very high93.9Very high28 Ų2848.8 Ų48.819%0.18927%0.269CS..Hα-helixtrans-81.3-21.2-174.8-59.90000112.9Y122 T223Y122-C126 HydrophobicContact CD2-CB 3.92Å; Y122-C126 WeakPolarHBondContact CD2-SG 3.49Å; Y122-C126 HydrophobicContact CE2-CB 3.71Å; Y122-C126 WeakPolarHBondContact O-CB 3.35Å; Y122-C126 PolarHBondContact O-N 2.99Å; C126-T223 PolarHBondContact SG-OG1 3.48Å
127S92.6Very high93.7Very high36 Ų3657.2 Ų57.225%0.25230%0.304SS..  trans-144.156.3-177.4-67.60000112.6A123 L129 H130 Y131A123-S127 CarbonylContact O-C 3.57Å; A123-S127 VanDerWaalsContact O-C 3.27Å; A123-S127 PolarHBondContact O-N 2.98Å; A123-S127 VanDerWaalsContact O-N 3.16Å; S127-L129 VanDerWaalsContact C-N 3.3Å; S127-L129 PolarHBondContact O-N 2.89Å; S127-H130 CarbonylContact O-C 3.51Å; S127-H130 PolarHBondContact O-N 3.5Å; S127-Y131 PolarHBondContact O-N 3.47Å
128P89.9Confident93.8Very high88 Ų8867.5 Ų67.557%0.57134%0.343SS*.G310 helixtrans-58.7-36.7-171.423.1-34.1000113.6H130 Y131P128-H130 VanDerWaalsContact C-N 3.29Å; P128-H130 PolarHBondContact O-N 3.39Å; P128-Y131 WeakPolarHBondContact O-CB 3.24Å; P128-Y131 PolarHBondContact O-N 3.45Å
129L92.7Very high93.8Very high160 Ų16070.2 Ų70.284%0.83836%0.357SS*.G310 helixtrans-69.2-25.5179.2-65.7175.5000113.5S127S127-L129 VanDerWaalsContact C-N 3.3Å; S127-L129 PolarHBondContact O-N 2.89Å
130H93.4Very high93.8Very high118 Ų11868.1 Ų68.155%0.54635%0.348SS..G310 helixtrans-105.80.8-178.6-63.791.7000112.5S127 P128 T132 V133 I134S127-H130 CarbonylContact O-C 3.51Å; S127-H130 PolarHBondContact O-N 3.5Å; P128-H130 VanDerWaalsContact C-N 3.29Å; P128-H130 PolarHBondContact O-N 3.39Å; H130-T132 VanDerWaalsContact C-N 3.31Å; H130-T132 PolarHBondContact O-N 2.93Å; H130-V133 PolarHBondContact O-N 3.47Å; H130-I134 HydrophobicContact CB-CD1 3.86Å; H130-I134 HydrophobicContact CB-CG1 4.25Å; H130-I134 WeakPolarHBondContact O-CG1 3.36Å; H130-I134 PolarHBondContact O-N 2.95Å
131Y93.9Very high93.9Very high43 Ų4372.6 Ų72.617%0.16937%0.372CS..Hα-helixtrans-53.2-45-172.6173.3-106.9000113P58 D120 A123 A124 S127 P128 V133 I134 M135P58-Y131 WeakPolarHBondContact CD-OH 3.12Å; P58-Y131 WeakPolarHBondContact CG-OH 3.26Å; D120-Y131 WeakPolarHBondContact OD1-CE2 3.14Å; D120-Y131 PolarHBondContact OD1-OH 3.21Å; A123-Y131 HydrophobicContact CB-CD2 3.96Å; A123-Y131 HydrophobicContact CB-CE2 4.37Å; A124-Y131 VanDerWaalsContact CA-CD2 3.47Å; A124-Y131 HydrophobicContact CB-CD2 3.84Å; A124-Y131 HydrophobicContact CB-CE2 3.72Å; S127-Y131 PolarHBondContact O-N 3.47Å; P128-Y131 WeakPolarHBondContact O-CB 3.24Å; P128-Y131 PolarHBondContact O-N 3.45Å; Y131-V133 VanDerWaalsContact C-N 3.28Å; Y131-V133 PolarHBondContact O-N 3.17Å; Y131-I134 PolarHBondContact O-N 2.7Å; Y131-M135 HydrophobicContact CD2-CB 4.37Å; Y131-M135 HydrophobicContact CD2-CG 3.84Å; Y131-M135 HydrophobicContact CE2-CB 4Å; Y131-M135 HydrophobicContact CE2-CG 3.46Å; Y131-M135 VanDerWaalsContact CE2-CG 3.46Å; Y131-M135 WeakPolarHBondContact O-CB 3.46Å; Y131-M135 PolarHBondContact O-N 2.79Å
132T91.3Very high94.1Very high109 Ų10973.5 Ų73.567%0.66939%0.386SS*.Hα-helixtrans-67.7-27.4-178.352.60000113.3H130H130-T132 VanDerWaalsContact C-N 3.31Å; H130-T132 PolarHBondContact O-N 2.93Å
133V93.3Very high94.1Very high109 Ų10971.9 Ų71.966%0.66138%0.382SS*.Hα-helixtrans-81.4-44.3176.3-178.90000110.1H130 Y131H130-V133 PolarHBondContact O-N 3.47Å; Y131-V133 VanDerWaalsContact C-N 3.28Å; Y131-V133 PolarHBondContact O-N 3.17Å
134I93.4Very high94.2Very high58 Ų5872.3 Ų72.330%0.29738%0.384SS..Hα-helixtrans-62.9-58.7177.8-65166.6000109.7A123 H130 Y131 S136 L139A123-I134 HydrophobicContact CB-CB 4.48Å; A123-I134 HydrophobicContact CB-CG2 3.85Å; H130-I134 HydrophobicContact CB-CD1 3.86Å; H130-I134 HydrophobicContact CB-CG1 4.25Å; H130-I134 WeakPolarHBondContact O-CG1 3.36Å; H130-I134 PolarHBondContact O-N 2.95Å; Y131-I134 PolarHBondContact O-N 2.7Å; I134-S136 PolarHBondContact O-N 3.03Å; I134-L139 WeakPolarHBondContact O-CD2 3.3Å
135M95.9Very high94.4Very high9 Ų974.5 Ų74.54%0.04439%0.394CS..THydrogen-bonded Turntrans-83.851.7179.3-59.7-59-80.100111.3P58 F62 D120 A123 Y131 L139 L143P58-M135 HydrophobicContact CB-CB 4.4Å; P58-M135 HydrophobicContact CB-CE 4.15Å; P58-M135 HydrophobicContact CG-CB 4.02Å; F62-M135 HydrophobicContact CE2-CE 3.66Å; F62-M135 HydrophobicContact CZ-CE 4.01Å; D120-M135 VanDerWaalsContact CA-CE 3.48Å; D120-M135 HydrophobicContact CB-CE 3.48Å; D120-M135 VanDerWaalsContact CB-CE 3.48Å; D120-M135 WeakPolarHBondContact OD1-CE 3.29Å; A123-M135 HydrophobicContact CB-CG 3.92Å; A123-M135 HydrophobicContact CB-SD 4.22Å; Y131-M135 HydrophobicContact CD2-CB 4.37Å; Y131-M135 HydrophobicContact CD2-CG 3.84Å; Y131-M135 HydrophobicContact CE2-CB 4Å; Y131-M135 HydrophobicContact CE2-CG 3.46Å; Y131-M135 VanDerWaalsContact CE2-CG 3.46Å; Y131-M135 WeakPolarHBondContact O-CB 3.46Å; Y131-M135 PolarHBondContact O-N 2.79Å; M135-L139 HydrophobicContact SD-CD2 4.27Å; M135-L143 HydrophobicContact CE-CD1 4.24Å
136S95.4Very high94.6Very high45 Ų4574.2 Ų74.232%0.31540%0.399SS..  trans-61.2156.7172.970.90000111.2I134 R138 L139 C140I134-S136 PolarHBondContact O-N 3.03Å; S136-R138 PolarHBondContact O-N 3.24Å; S136-L139 PolarHBondContact O-N 2.93Å; S136-L139 VanDerWaalsContact O-N 3.12Å; S136-L139 PolarHBondContact OG-N 3.36Å; S136-C140 PolarHBondContact O-N 3.31Å; S136-C140 PolarHBondContact O-SG 3.49Å
137K93.8Very high94.8Very high185 Ų18573.3 Ų73.380%0.80439%0.393SS*.Hα-helixtrans-54.3-39.3175.7-67.5-176.3-180179.40112.2C140 L141K137-C140 PolarHBondContact O-N 3.44Å; K137-L141 WeakPolarHBondContact O-CB 3.09Å; K137-L141 VanDerWaalsContact O-CG 3.29Å; K137-L141 WeakPolarHBondContact O-CG 3.27Å; K137-L141 PolarHBondContact O-N 3.12Å
138R95.9Very high95.1Very high217 Ų21773.5 Ų73.582%0.81939%0.388SS*.Hα-helixtrans-64.3-44.3179.4-173.3178.4179.8-177-0111.6S136 A142S136-R138 PolarHBondContact O-N 3.24Å; R138-A142 PolarHBondContact O-N 3.48Å
139L96.2Very high95.5Very high57 Ų5773.3 Ų73.330%0.29839%0.385SS..Hα-helixtrans-66.6-44.5176.5-178.462.4000111.1I134 M135 S136 L141 A142 L143I134-L139 WeakPolarHBondContact O-CD2 3.3Å; M135-L139 HydrophobicContact SD-CD2 4.27Å; S136-L139 PolarHBondContact O-N 2.93Å; S136-L139 VanDerWaalsContact O-N 3.12Å; S136-L139 PolarHBondContact OG-N 3.36Å; L139-L141 VanDerWaalsContact C-N 3.29Å; L139-L141 PolarHBondContact O-N 3.42Å; L139-A142 WeakPolarHBondContact O-CB 3.14Å; L139-A142 PolarHBondContact O-N 2.9Å; L139-A142 VanDerWaalsContact O-N 3.09Å; L139-L143 HydrophobicContact CD1-CD1 4.24Å; L139-L143 HydrophobicContact CD1-CG 4.05Å; L139-L143 HydrophobicContact CD2-CD1 4.29Å; L139-L143 HydrophobicContact CG-CD1 3.84Å; L139-L143 HydrophobicContact CG-CG 4.12Å; L139-L143 WeakPolarHBondContact O-CB 3.3Å; L139-L143 WeakPolarHBondContact O-CG 3.3Å; L139-L143 PolarHBondContact O-N 3.29Å
140C95.9Very high95.6Very high8 Ų868.8 Ų68.85%0.05436%0.361CS..Hα-helixtrans-59.1-41.2178.4-62.70000111.9F61 F62 S136 K137 L143 I144F61-C140 HydrophobicContact CD1-CB 4.25Å; F61-C140 HydrophobicContact CE1-CB 4.36Å; F62-C140 HydrophobicContact CZ-CB 4.37Å; S136-C140 PolarHBondContact O-N 3.31Å; S136-C140 PolarHBondContact O-SG 3.49Å; K137-C140 PolarHBondContact O-N 3.44Å; C140-L143 PolarHBondContact O-N 3.21Å; C140-I144 WeakPolarHBondContact O-CG1 3.29Å; C140-I144 PolarHBondContact O-N 2.78Å; C140-I144 VanDerWaalsContact O-N 3.13Å
141L96.3Very high95.7Very high95 Ų9563.2 Ų63.250%0.49734%0.335SS..Hα-helixtrans-62.8-45.5173.6-73.4169.5000111.4F61 K137 L139 L143 I144 T145F61-L141 HydrophobicContact CZ-CD2 4.2Å; K137-L141 WeakPolarHBondContact O-CB 3.09Å; K137-L141 VanDerWaalsContact O-CG 3.29Å; K137-L141 WeakPolarHBondContact O-CG 3.27Å; K137-L141 PolarHBondContact O-N 3.12Å; L139-L141 VanDerWaalsContact C-N 3.29Å; L139-L141 PolarHBondContact O-N 3.42Å; L141-L143 VanDerWaalsContact C-N 3.34Å; L141-L143 PolarHBondContact O-N 3.36Å; L141-I144 WeakPolarHBondContact O-CB 3.46Å; L141-I144 PolarHBondContact O-N 3.31Å; L141-I144 VanDerWaalsContact O-N 3.09Å; L141-T145 WeakPolarHBondContact O-CG2 3.46Å; L141-T145 PolarHBondContact O-N 2.96Å; L141-T145 PolarHBondContact O-OG1 3.09Å; L141-T145 VanDerWaalsContact O-OG1 3.06Å
142A97.3Very high95.9Very high50 Ų5066.3 Ų66.341%0.41335%0.35SS..Hα-helixtrans-61.2-41.5177.100000112.6R138 L139 I144 T145 G146R138-A142 PolarHBondContact O-N 3.48Å; L139-A142 WeakPolarHBondContact O-CB 3.14Å; L139-A142 PolarHBondContact O-N 2.9Å; L139-A142 VanDerWaalsContact O-N 3.09Å; A142-I144 PolarHBondContact O-N 3.37Å; A142-T145 WeakPolarHBondContact CA-OG1 3.16Å; A142-T145 PolarHBondContact O-N 3.16Å; A142-T145 PolarHBondContact O-OG1 3.24Å; A142-G146 PolarHBondContact O-N 3.21Å
143L96.6Very high96.2Very high36 Ų3665.3 Ų65.319%0.18834%0.339CS..Hα-helixtrans-68.3-14.2176.2-71.1176.7000113.3F62 S116 M135 L139 C140 L141 P147F62-L143 HydrophobicContact CE1-CB 3.72Å; F62-L143 HydrophobicContact CZ-CB 3.91Å; F62-L143 HydrophobicContact CZ-CD1 3.94Å; S116-L143 PolarHBondContact OG-O 3.26Å; M135-L143 HydrophobicContact CE-CD1 4.24Å; L139-L143 HydrophobicContact CD1-CD1 4.24Å; L139-L143 HydrophobicContact CD1-CG 4.05Å; L139-L143 HydrophobicContact CD2-CD1 4.29Å; L139-L143 HydrophobicContact CG-CD1 3.84Å; L139-L143 HydrophobicContact CG-CG 4.12Å; L139-L143 WeakPolarHBondContact O-CB 3.3Å; L139-L143 WeakPolarHBondContact O-CG 3.3Å; L139-L143 PolarHBondContact O-N 3.29Å; C140-L143 PolarHBondContact O-N 3.21Å; L141-L143 VanDerWaalsContact C-N 3.34Å; L141-L143 PolarHBondContact O-N 3.36Å; L143-P147 WeakPolarHBondContact O-CD 3.26Å; L143-P147 WeakPolarHBondContact O-CG 3.23Å
144I96.2Very high96.2Very high8 Ų861.4 Ų61.44%0.04132%0.315CS..Hα-helixtrans-92.4-50.3169.4-75.9-59.2000111.3F61 F62 H65 L113 C140 L141 A142 G146 P147 Y148F61-I144 HydrophobicContact CD1-CG1 4.08Å; F61-I144 HydrophobicContact CE1-CB 4.4Å; F61-I144 HydrophobicContact CE1-CD1 4.46Å; F61-I144 HydrophobicContact CE1-CG1 3.46Å; F61-I144 VanDerWaalsContact CE1-CG1 3.46Å; F61-I144 HydrophobicContact CZ-CG1 4Å; F62-I144 HydrophobicContact CD1-CD1 3.46Å; F62-I144 VanDerWaalsContact CD1-CD1 3.46Å; F62-I144 HydrophobicContact CD1-CG1 3.91Å; F62-I144 HydrophobicContact CE1-CD1 4Å; F62-I144 HydrophobicContact CE1-CG1 3.95Å; H65-I144 HydrophobicContact CB-CD1 3.72Å; H65-I144 VanDerWaalsContact CD2-CD1 3.44Å; H65-I144 WeakPolarHBondContact CD2-CD1 3.33Å; L113-I144 HydrophobicContact CD1-CD1 3.48Å; L113-I144 VanDerWaalsContact CD1-CD1 3.48Å; C140-I144 WeakPolarHBondContact O-CG1 3.29Å; C140-I144 PolarHBondContact O-N 2.78Å; C140-I144 VanDerWaalsContact O-N 3.13Å; L141-I144 WeakPolarHBondContact O-CB 3.46Å; L141-I144 PolarHBondContact O-N 3.31Å; L141-I144 VanDerWaalsContact O-N 3.09Å; A142-I144 PolarHBondContact O-N 3.37Å; I144-G146 VanDerWaalsContact C-N 3.33Å; I144-G146 PolarHBondContact O-N 3.44Å; I144-P147 WeakPolarHBondContact O-CD 3.24Å; I144-Y148 HydrophobicContact CG2-CD2 4.11Å; I144-Y148 HydrophobicContact CG2-CE2 3.9Å; I144-Y148 WeakPolarHBondContact O-CD2 3.24Å
145T97.2Very high96.2Very high76 Ų7658.6 Ų58.647%0.46630%0.301SS..Hα-helixtrans-68.7-35.6-173.954.40000111.7L141 A142 Y148 V149L141-T145 WeakPolarHBondContact O-CG2 3.46Å; L141-T145 PolarHBondContact O-N 2.96Å; L141-T145 PolarHBondContact O-OG1 3.09Å; L141-T145 VanDerWaalsContact O-OG1 3.06Å; A142-T145 WeakPolarHBondContact CA-OG1 3.16Å; A142-T145 PolarHBondContact O-N 3.16Å; A142-T145 PolarHBondContact O-OG1 3.24Å; T145-Y148 PolarHBondContact O-N 2.95Å; T145-V149 WeakPolarHBondContact O-CB 3.46Å; T145-V149 VanDerWaalsContact O-CG2 3.29Å; T145-V149 WeakPolarHBondContact O-CG2 3.4Å; T145-V149 PolarHBondContact O-N 3.41Å
146G97.4Very high96.1Very high24 Ų2463.5 Ų63.525%0.24732%0.322CS..Hα-helixtrans-55.4-57.8177.900000113A142 I144 Y148 V149 I150A142-G146 PolarHBondContact O-N 3.21Å; I144-G146 VanDerWaalsContact C-N 3.33Å; I144-G146 PolarHBondContact O-N 3.44Å; G146-Y148 VanDerWaalsContact C-N 3.31Å; G146-Y148 PolarHBondContact O-N 3.39Å; G146-V149 PolarHBondContact O-N 3.29Å; G146-V149 VanDerWaalsContact O-N 3.17Å; G146-I150 VanDerWaalsContact O-CG1 3.32Å; G146-I150 WeakPolarHBondContact O-CG1 3.45Å; G146-I150 PolarHBondContact O-N 2.91Å
147P96.9Very high96Very high8 Ų864.1 Ų64.15%0.05232%0.323CS..Hα-helixtrans-49.1-46.4175.1-30.532.7000114.4A109 L143 I144 G151A109-P147 HydrophobicContact CB-CB 4.42Å; L143-P147 WeakPolarHBondContact O-CD 3.26Å; L143-P147 WeakPolarHBondContact O-CG 3.23Å; I144-P147 WeakPolarHBondContact O-CD 3.24Å; P147-G151 PolarHBondContact O-N 2.79Å
148Y97.5Very high95.8Very high41 Ų4156.1 Ų56.116%0.16129%0.289CS..Hα-helixtrans-68.2-43.2179.2-70.6-63.1000112.3H65 I69 F105 A109 I144 T145 G146 F152H65-Y148 AromaticContact ND1-CE2 3.45Å; H65-Y148 WeakPolarHBondContact ND1-CE2 3.43Å; H65-Y148 AromaticContact ND1-CZ 3.7Å; H65-Y148 PolarHBondContact ND1-OH 2.93Å; I69-Y148 HydrophobicContact CD1-CE1 3.91Å; I69-Y148 HydrophobicContact CG1-CE1 3.89Å; F105-Y148 AromaticContact CE2-CD1 3.83Å; F105-Y148 HydrophobicContact CE2-CD1 3.83Å; F105-Y148 VanDerWaalsContact CE2-O 3.29Å; F105-Y148 WeakPolarHBondContact CE2-O 3.42Å; F105-Y148 AromaticContact CZ-CD1 3.56Å; F105-Y148 HydrophobicContact CZ-CD1 3.56Å; F105-Y148 HydrophobicContact CZ-CE1 4.32Å; F105-Y148 HydrophobicContact CZ-CG 4.44Å; A109-Y148 HydrophobicContact CB-CD1 3.98Å; A109-Y148 HydrophobicContact CB-CE1 4.25Å; I144-Y148 HydrophobicContact CG2-CD2 4.11Å; I144-Y148 HydrophobicContact CG2-CE2 3.9Å; I144-Y148 WeakPolarHBondContact O-CD2 3.24Å; T145-Y148 PolarHBondContact O-N 2.95Å; G146-Y148 VanDerWaalsContact C-N 3.31Å; G146-Y148 PolarHBondContact O-N 3.39Å; Y148-F152 VanDerWaalsContact O-CB 3.28Å; Y148-F152 WeakPolarHBondContact O-CB 3.16Å; Y148-F152 PolarHBondContact O-N 3.45Å
149V98.1Very high95.5Very high84 Ų8447 Ų4751%0.50926%0.258SS..Hα-helixtrans-63.6-46.2179.2170.10000110.9T145 G146 F152 I153T145-V149 WeakPolarHBondContact O-CB 3.46Å; T145-V149 VanDerWaalsContact O-CG2 3.29Å; T145-V149 WeakPolarHBondContact O-CG2 3.4Å; T145-V149 PolarHBondContact O-N 3.41Å; G146-V149 PolarHBondContact O-N 3.29Å; G146-V149 VanDerWaalsContact O-N 3.17Å; V149-F152 PolarHBondContact O-N 2.66Å; V149-I153 HydrophobicContact CG1-CD1 3.86Å; V149-I153 VanDerWaalsContact O-CG1 3.32Å; V149-I153 WeakPolarHBondContact O-CG1 3.46Å; V149-I153 PolarHBondContact O-N 2.92Å
150I96.6Very high95.1Very high65 Ų6546.2 Ų46.233%0.33326%0.255SS..Hα-helixtrans-62.8-50.7178.9-64.1166.1000109.9T108 Y112 G146 F152 I153 D154T108-I150 HydrophobicContact CG2-CG2 4.32Å; Y112-I150 HydrophobicContact CD2-CG2 4.26Å; Y112-I150 HydrophobicContact CE2-CB 4.24Å; Y112-I150 HydrophobicContact CE2-CD1 4.38Å; Y112-I150 HydrophobicContact CE2-CG2 3.53Å; G146-I150 VanDerWaalsContact O-CG1 3.32Å; G146-I150 WeakPolarHBondContact O-CG1 3.45Å; G146-I150 PolarHBondContact O-N 2.91Å; I150-F152 VanDerWaalsContact C-N 3.26Å; I150-F152 PolarHBondContact O-N 3.44Å; I150-I153 PolarHBondContact O-N 2.99Å; I150-I153 VanDerWaalsContact O-N 3.15Å; I150-D154 WeakPolarHBondContact O-CB 3.2Å; I150-D154 PolarHBondContact O-N 3.05Å
151G95.6Very high94.7Very high0 Ų047.1 Ų47.10%026%0.262CS..Hα-helixtrans-58.7-37178.600000113.3P147 S155P147-G151 PolarHBondContact O-N 2.79Å; G151-S155 VanDerWaalsContact O-CB 3.24Å; G151-S155 WeakPolarHBondContact O-CB 3.38Å; G151-S155 PolarHBondContact O-N 2.98Å; G151-S155 PolarHBondContact O-OG 3.44Å
152F97.3Very high94.1Very high108 Ų10842.7 Ų42.747%0.47424%0.239SC..Hα-helixtrans-65.1-48177.1179.1-84.2000110.9F101 F105 Y148 V149 I150 S155 F156F101-F152 HydrophobicContact CE1-CD2 4.4Å; F101-F152 HydrophobicContact CE1-CE2 4.39Å; F101-F152 AromaticContact CZ-CD2 3.61Å; F101-F152 HydrophobicContact CZ-CD2 3.61Å; F101-F152 AromaticContact CZ-CE2 3.63Å; F101-F152 HydrophobicContact CZ-CE2 3.63Å; F101-F152 HydrophobicContact CZ-CG 4.34Å; F101-F152 HydrophobicContact CZ-CZ 4.37Å; F105-F152 HydrophobicContact CD2-CB 4.19Å; F105-F152 HydrophobicContact CE2-CB 4.2Å; Y148-F152 VanDerWaalsContact O-CB 3.28Å; Y148-F152 WeakPolarHBondContact O-CB 3.16Å; Y148-F152 PolarHBondContact O-N 3.45Å; V149-F152 PolarHBondContact O-N 2.66Å; I150-F152 VanDerWaalsContact C-N 3.26Å; I150-F152 PolarHBondContact O-N 3.44Å; F152-S155 PolarHBondContact O-N 3.12Å; F152-F156 WeakPolarHBondContact O-CB 3.36Å; F152-F156 PolarHBondContact O-N 2.92Å
153I97Very high93.4Very high88 Ų8842.9 Ų42.945%0.45124%0.237SC..Hα-helixtrans-61.6-50179.6-68166.8000110.2V149 I150 S155 F156 V157V149-I153 HydrophobicContact CG1-CD1 3.86Å; V149-I153 VanDerWaalsContact O-CG1 3.32Å; V149-I153 WeakPolarHBondContact O-CG1 3.46Å; V149-I153 PolarHBondContact O-N 2.92Å; I150-I153 PolarHBondContact O-N 2.99Å; I150-I153 VanDerWaalsContact O-N 3.15Å; I153-S155 VanDerWaalsContact C-N 3.32Å; I153-S155 PolarHBondContact O-N 3.47Å; I153-F156 PolarHBondContact O-N 2.94Å; I153-V157 HydrophobicContact CG2-CG2 4.41Å; I153-V157 WeakPolarHBondContact O-CB 3.21Å; I153-V157 VanDerWaalsContact O-CG2 3.31Å; I153-V157 WeakPolarHBondContact O-CG2 3.4Å; I153-V157 PolarHBondContact O-N 3.29Å
154D93.6Very high92.8Very high27 Ų2750.5 Ų50.514%0.14426%0.263CS..Hα-helixtrans-58-45.8-179.5-73.8-10.5000111.6I150 V157 N158 I201I150-D154 WeakPolarHBondContact O-CB 3.2Å; I150-D154 PolarHBondContact O-N 3.05Å; D154-V157 PolarHBondContact O-N 2.97Å; D154-N158 WeakPolarHBondContact O-CB 3.46Å; D154-N158 VanDerWaalsContact O-CG 3.3Å; D154-N158 PolarHBondContact O-N 2.93Å; D154-N158 PolarHBondContact O-ND2 2.86Å; D154-N158 VanDerWaalsContact O-ND2 3.17Å; D154-I201 HydrophobicContact CB-CG2 3.72Å
155S93.2Very high92Very high0 Ų051 Ų510%027%0.266CS..Hα-helixtrans-70.5-37.4-178.9-55.80000112.2F101 A104 F105 G151 F152 I153 N158 V159F101-S155 WeakPolarHBondContact O-CB 3.28Å; A104-S155 WeakPolarHBondContact CB-OG 3.46Å; F105-S155 WeakPolarHBondContact CA-OG 3.2Å; F105-S155 WeakPolarHBondContact CB-OG 3.02Å; F105-S155 PolarHBondContact N-OG 3.49Å; G151-S155 VanDerWaalsContact O-CB 3.24Å; G151-S155 WeakPolarHBondContact O-CB 3.38Å; G151-S155 PolarHBondContact O-N 2.98Å; G151-S155 PolarHBondContact O-OG 3.44Å; F152-S155 PolarHBondContact O-N 3.12Å; I153-S155 VanDerWaalsContact C-N 3.32Å; I153-S155 PolarHBondContact O-N 3.47Å; S155-N158 PolarHBondContact O-N 3.3Å; S155-V159 WeakPolarHBondContact O-CB 3.34Å; S155-V159 WeakPolarHBondContact O-CG2 3.05Å; S155-V159 PolarHBondContact O-N 2.78Å
156F94.5Very high91.1Very high111 Ų11153.7 Ų53.749%0.48727%0.273SS..Hα-helixtrans-63.1-48175.2-178.7-101.4000110.8F101 F152 I153 N158 V159 V160F101-F156 HydrophobicContact CE2-CB 4.06Å; F152-F156 WeakPolarHBondContact O-CB 3.36Å; F152-F156 PolarHBondContact O-N 2.92Å; I153-F156 PolarHBondContact O-N 2.94Å; F156-N158 PolarHBondContact O-N 2.83Å; F156-V159 PolarHBondContact O-N 3.45Å; F156-V160 HydrophobicContact CD1-CG2 4.24Å; F156-V160 HydrophobicContact CD2-CG2 4.26Å; F156-V160 HydrophobicContact CE1-CG2 3.89Å; F156-V160 HydrophobicContact CE2-CG2 3.91Å; F156-V160 HydrophobicContact CG-CG2 4.42Å; F156-V160 HydrophobicContact CZ-CG2 3.71Å; F156-V160 WeakPolarHBondContact O-CB 3.47Å; F156-V160 VanDerWaalsContact O-CG2 3.26Å; F156-V160 WeakPolarHBondContact O-CG2 3.46Å; F156-V160 PolarHBondContact O-N 3.35Å
157V92.7Very high90Very high58 Ų5854.7 Ų54.735%0.35227%0.271SS..Hα-helixtrans-59.5-46.7177.1168.40000110.8I153 D154 S161 L197 I201I153-V157 HydrophobicContact CG2-CG2 4.41Å; I153-V157 WeakPolarHBondContact O-CB 3.21Å; I153-V157 VanDerWaalsContact O-CG2 3.31Å; I153-V157 WeakPolarHBondContact O-CG2 3.4Å; I153-V157 PolarHBondContact O-N 3.29Å; D154-V157 PolarHBondContact O-N 2.97Å; V157-S161 WeakPolarHBondContact O-CB 2.8Å; V157-S161 PolarHBondContact O-N 3.43Å; V157-L197 HydrophobicContact CG1-CD1 4.25Å; V157-L197 HydrophobicContact CG1-CD2 3.92Å; V157-L197 HydrophobicContact CG1-CG 4.44Å; V157-I201 HydrophobicContact CG1-CD1 4.07Å
158N89.1Confident88.6Confident17 Ų1761.5 Ų61.59%0.09130%0.296CS..Hα-helixtrans-59.1-51.2177.5-79.3-33.2000112D154 S155 F156 V160 S161 M162 I198 I201D154-N158 WeakPolarHBondContact O-CB 3.46Å; D154-N158 VanDerWaalsContact O-CG 3.3Å; D154-N158 PolarHBondContact O-N 2.93Å; D154-N158 PolarHBondContact O-ND2 2.86Å; D154-N158 VanDerWaalsContact O-ND2 3.17Å; S155-N158 PolarHBondContact O-N 3.3Å; F156-N158 PolarHBondContact O-N 2.83Å; N158-V160 PolarHBondContact O-N 3.42Å; N158-S161 PolarHBondContact O-N 2.73Å; N158-M162 WeakPolarHBondContact O-CB 3.41Å; N158-M162 VanDerWaalsContact O-CG 3.31Å; N158-M162 WeakPolarHBondContact O-CG 3.21Å; N158-M162 PolarHBondContact O-N 3.44Å; N158-I198 WeakPolarHBondContact OD1-CG1 3.25Å; N158-I201 WeakPolarHBondContact OD1-CD1 3.32Å
159V89.6Confident86.9Confident26 Ų2667.9 Ų67.916%0.15833%0.333CS..Hα-helixtrans-65-42.2-178.5157.70000112.1F97 F101 S155 F156 M162 S163F97-V159 HydrophobicContact CB-CG1 4.5Å; F97-V159 HydrophobicContact CD1-CG1 4.02Å; F101-V159 HydrophobicContact CB-CG2 3.9Å; F101-V159 HydrophobicContact CD2-CG2 4.36Å; S155-V159 WeakPolarHBondContact O-CB 3.34Å; S155-V159 WeakPolarHBondContact O-CG2 3.05Å; S155-V159 PolarHBondContact O-N 2.78Å; F156-V159 PolarHBondContact O-N 3.45Å; V159-M162 PolarHBondContact O-N 3.5Å; V159-S163 VanDerWaalsContact O-CB 3.29Å; V159-S163 WeakPolarHBondContact O-CB 3.14Å; V159-S163 PolarHBondContact O-N 2.98Å; V159-S163 PolarHBondContact O-OG 3.29Å
160V89.1Confident85.3Confident40 Ų4066.8 Ų66.824%0.24233%0.329CS..Hα-helixtrans-63.1-43.8175.8170.80000110.6F156 N158 M162 S163 R164F156-V160 HydrophobicContact CD1-CG2 4.24Å; F156-V160 HydrophobicContact CD2-CG2 4.26Å; F156-V160 HydrophobicContact CE1-CG2 3.89Å; F156-V160 HydrophobicContact CE2-CG2 3.91Å; F156-V160 HydrophobicContact CG-CG2 4.42Å; F156-V160 HydrophobicContact CZ-CG2 3.71Å; F156-V160 WeakPolarHBondContact O-CB 3.47Å; F156-V160 VanDerWaalsContact O-CG2 3.26Å; F156-V160 WeakPolarHBondContact O-CG2 3.46Å; F156-V160 PolarHBondContact O-N 3.35Å; N158-V160 PolarHBondContact O-N 3.42Å; V160-M162 PolarHBondContact O-N 2.89Å; V160-S163 PolarHBondContact O-N 2.82Å; V160-S163 PolarHBondContact O-OG 2.97Å; V160-R164 WeakPolarHBondContact O-CG 3.13Å; V160-R164 PolarHBondContact O-N 2.91Å
161S87.1Confident84.1Confident27 Ų2765.8 Ų65.819%0.18932%0.324CS..Hα-helixtrans-59.7-46.8176.7-167.70000111.5V157 N158 R164 T194V157-S161 WeakPolarHBondContact O-CB 2.8Å; V157-S161 PolarHBondContact O-N 3.43Å; N158-S161 PolarHBondContact O-N 2.73Å; S161-R164 PolarHBondContact O-N 3.5Å; S161-T194 PolarHBondContact OG-OG1 2.82Å
162M84.3Confident83.2Confident2 Ų267.5 Ų67.51%0.0134%0.335CS..Hα-helixtrans-68.8-34.9-179.6-70-178.372.200113.1F97 M100 N158 V159 V160 R164 L165 T180 I183 L184 T194 I198F97-M162 HydrophobicContact CE1-CB 3.75Å; F97-M162 HydrophobicContact CZ-CB 4.41Å; M100-M162 HydrophobicContact CE-CE 3.32Å; M100-M162 HydrophobicContact CE-SD 3.3Å; M100-M162 WeakPolarHBondContact CE-SD 3.35Å; M100-M162 HydrophobicContact SD-CE 4.38Å; N158-M162 WeakPolarHBondContact O-CB 3.41Å; N158-M162 VanDerWaalsContact O-CG 3.31Å; N158-M162 WeakPolarHBondContact O-CG 3.21Å; N158-M162 PolarHBondContact O-N 3.44Å; V159-M162 PolarHBondContact O-N 3.5Å; V160-M162 PolarHBondContact O-N 2.89Å; M162-R164 PolarHBondContact O-N 3.03Å; M162-L165 WeakPolarHBondContact O-CB 3.35Å; M162-L165 PolarHBondContact O-N 3.35Å; M162-L165 VanDerWaalsContact O-N 3.12Å; M162-T180 HydrophobicContact CE-CG2 4.08Å; M162-T180 HydrophobicContact SD-CG2 3.86Å; M162-I183 HydrophobicContact CE-CB 3.84Å; M162-I183 HydrophobicContact CE-CG2 3.5Å; M162-L184 HydrophobicContact CE-CD2 4.13Å; M162-L184 HydrophobicContact CE-CG 4.06Å; M162-L184 HydrophobicContact CG-CD2 4.42Å; M162-T194 HydrophobicContact CG-CG2 3.73Å; M162-I198 HydrophobicContact CG-CD1 4.48Å; M162-I198 HydrophobicContact SD-CD1 4.25Å
163S82.7Confident82.2Confident54 Ų5462.4 Ų62.438%0.37831%0.313SS..Hα-helixtrans-66.6-17.1179.471.10000113.6V159 V160V159-S163 VanDerWaalsContact O-CB 3.29Å; V159-S163 WeakPolarHBondContact O-CB 3.14Å; V159-S163 PolarHBondContact O-N 2.98Å; V159-S163 PolarHBondContact O-OG 3.29Å; V160-S163 PolarHBondContact O-N 2.82Å; V160-S163 PolarHBondContact O-OG 2.97Å
164R82.5Confident80.9Confident197 Ų19762.5 Ų62.574%0.74331%0.311SS*.THydrogen-bonded Turntrans-85.1-9.1176.8-67.4174.9-178.4-161.81.1113.3V160 S161 M162V160-R164 WeakPolarHBondContact O-CG 3.13Å; V160-R164 PolarHBondContact O-N 2.91Å; S161-R164 PolarHBondContact O-N 3.5Å; M162-R164 PolarHBondContact O-N 3.03Å
165L81Confident79.9Confident18 Ų1861.3 Ų61.39%0.09431%0.305CS..SBendtrans-73.2146.8176.8-62173.1000110.3M162 F167 L184 T191 T194M162-L165 WeakPolarHBondContact O-CB 3.35Å; M162-L165 PolarHBondContact O-N 3.35Å; M162-L165 VanDerWaalsContact O-N 3.12Å; L165-F167 HydrophobicContact CB-CE1 4.33Å; L165-F167 HydrophobicContact CB-CE2 4.4Å; L165-F167 HydrophobicContact CB-CZ 3.98Å; L165-F167 WeakPolarHBondContact O-CE2 3.46Å; L165-L184 HydrophobicContact CD1-CD2 3.49Å; L165-L184 VanDerWaalsContact CD1-CD2 3.49Å; L165-T191 HydrophobicContact CD1-CG2 4.32Å; L165-T194 HydrophobicContact CD1-CG2 4.43Å
166H76.6Confident78.9Confident132 Ų13261.4 Ų61.461%0.61131%0.305SS*.PPolyproline II helixtrans-91.8129.4170.2-76.1-80.9000109.1S187 C188 T189H166-S187 CarbonylContact O-C 3.27Å; H166-S187 WeakPolarHBondContact O-CA 3.28Å; H166-C188 PolarHBondContact O-N 2.86Å; H166-T189 HydrophobicContact CB-CG2 4.03Å; H166-T189 PolarHBondContact N-OG1 2.94Å
167F76.3Confident78Confident46 Ų4656.2 Ų56.220%0.20228%0.282CS..BIsolated β-bridgetrans-101.1151.3179.4-57.2-77.8000110.9F93 F97 L165 I183 L186F93-F167 HydrophobicContact CE2-CD2 4.35Å; F93-F167 HydrophobicContact CE2-CE2 4.02Å; F97-F167 HydrophobicContact CZ-CE2 4.2Å; F97-F167 HydrophobicContact CZ-CZ 4Å; L165-F167 HydrophobicContact CB-CE1 4.33Å; L165-F167 HydrophobicContact CB-CE2 4.4Å; L165-F167 HydrophobicContact CB-CZ 3.98Å; L165-F167 WeakPolarHBondContact O-CE2 3.46Å; F167-I183 HydrophobicContact CE1-CG2 3.68Å; F167-I183 HydrophobicContact CZ-CG2 3.97Å; F167-L186 HydrophobicContact CD1-CB 4.16Å
168Y66.4Low77.4Confident150 Ų15053.4 Ų53.459%0.58827%0.265SS*.PPolyproline II helixtrans-63.5166.8173.4-82.6-80.3000111.1S170 L186 C188Y168-S170 PolarHBondContact O-N 3.49Å; Y168-L186 PolarHBondContact N-O 3.07Å; Y168-L186 VanDerWaalsContact N-O 3.13Å; Y168-C188 WeakPolarHBondContact CA-SG 3.36Å; Y168-C188 WeakPolarHBondContact CD1-SG 3.46Å; Y168-C188 HydrophobicContact CD2-CB 4.35Å; Y168-C188 WeakPolarHBondContact CD2-SG 3.36Å; Y168-C188 HydrophobicContact CE2-CB 4.17Å; Y168-C188 PolarHBondContact N-SG 3.02Å
169D61Low76.9Confident176 Ų17653 Ų5394%0.94126%0.263SS*.SBendtrans-64.2-5.2167.7-73.1-33.5000113.1N171D169-N171 PolarHBondContact O-N 2.9Å
170S64.8Low76.2Confident60 Ų6053.4 Ų53.442%0.4227%0.266SS..  trans-79.7113.9170.3-176.20000110.3Y168Y168-S170 PolarHBondContact O-N 3.49Å
171N72.9Confident75.5Confident44 Ų4454.4 Ų54.424%0.23527%0.274CS..  trans-9610.4177.265.2-23.5000113.2D11 F12 I13 D169D11-N171 WeakPolarHBondContact O-CB 3.42Å; D11-N171 PolarHBondContact O-ND2 2.78Å; F12-N171 CarbonylContact C-O 3.59Å; F12-N171 VanDerWaalsContact CA-O 3.3Å; F12-N171 WeakPolarHBondContact CA-O 3.29Å; F12-N171 HydrophobicContact CD1-CB 4.5Å; I13-N171 PolarHBondContact N-O 3.43Å; D169-N171 PolarHBondContact O-N 2.9Å
172V76.4Confident74.7Confident37 Ų3753.7 Ų53.722%0.22427%0.269CS..EExtended strand (participates in β ladder)trans-92.3115.8-174.9-175.40000111.3I13 M15I13-V172 HydrophobicContact CB-CG2 4.4Å; I13-V172 HydrophobicContact CD1-CG2 4.37Å; M15-V172 HydrophobicContact CG-CG1 3.74Å
173I75.6Confident74.4Confident1 Ų153.6 Ų53.61%0.00527%0.269CS..EExtended strand (participates in β ladder)trans-96.4118.6173.4-60.9169.7000108.1F12 I13 L14 M15 H175 P182 I183 L186F12-I173 HydrophobicContact CB-CD1 3.59Å; F12-I173 HydrophobicContact CB-CG1 4.24Å; F12-I173 HydrophobicContact CD1-CD1 3.93Å; F12-I173 HydrophobicContact CD1-CG1 4.13Å; F12-I173 HydrophobicContact CD2-CD1 4.27Å; F12-I173 HydrophobicContact CG-CD1 3.7Å; F12-I173 HydrophobicContact CG-CG1 4.35Å; I13-I173 PolarHBondContact O-N 3.09Å; L14-I173 HydrophobicContact CD2-CB 4.03Å; L14-I173 HydrophobicContact CD2-CD1 3.95Å; L14-I173 HydrophobicContact CD2-CG2 3.99Å; M15-I173 PolarHBondContact N-O 2.96Å; I173-H175 HydrophobicContact CG2-CB 3.78Å; I173-H175 PolarHBondContact O-N 3.18Å; I173-P182 HydrophobicContact CG2-CB 3.77Å; I173-I183 HydrophobicContact CD1-CD1 3.48Å; I173-I183 VanDerWaalsContact CD1-CD1 3.48Å; I173-I183 HydrophobicContact CG1-CD1 4.07Å; I173-L186 HydrophobicContact CG1-CD1 3.7Å
174H70.6Confident74Confident90 Ų9051.6 Ų51.642%0.41725%0.254SS..SBendtrans-76.446177.4-71.5-78.5000113.7L267 Q271H174-L267 HydrophobicContact CB-CD1 4.13Å; H174-Q271 PolarHBondContact O-NE2 2.96Å
175H71.1Confident73.6Confident2 Ų246.3 Ų46.31%0.00925%0.252CS..SBendtrans-150.4149.1-175.6-152.5-84.1000110.3L14 M15 I173 F177 P182 S274L14-H175 WeakPolarHBondContact CB-O 3.19Å; L14-H175 WeakPolarHBondContact CD2-O 3.47Å; M15-H175 CarbonylContact O-C 3.54Å; I173-H175 HydrophobicContact CG2-CB 3.78Å; I173-H175 PolarHBondContact O-N 3.18Å; H175-F177 AromaticContact CE1-CD1 3.22Å; H175-F177 WeakPolarHBondContact CE1-CD1 3.36Å; H175-F177 AromaticContact CE1-CE1 3.16Å; H175-F177 WeakPolarHBondContact CE1-CE1 3.08Å; H175-F177 AromaticContact CE1-CZ 3.93Å; H175-F177 AromaticContact ND1-CD1 3.36Å; H175-F177 WeakPolarHBondContact ND1-CD1 3.1Å; H175-F177 AromaticContact ND1-CE1 3.72Å; H175-F177 AromaticContact ND1-CG 3.79Å; H175-F177 PolarHBondContact ND1-N 3.38Å; H175-F177 PolarHBondContact ND1-O 3.07Å; H175-F177 VanDerWaalsContact ND1-O 3.09Å; H175-F177 PolarHBondContact O-N 3.03Å; H175-P182 HydrophobicContact CB-CB 4.17Å; H175-P182 HydrophobicContact CB-CG 3.81Å; H175-S274 PolarHBondContact CE1-OG 3.49Å; H175-S274 PolarHBondContact NE2-OG 3.1Å
176F72.4Confident73.2Confident2 Ų246.5 Ų46.51%0.00925%0.253CS..SBendtrans-76.8-6.1-177.668.2-94.4000113.8M15 L17 V77 T81 N84 S274 V275 I279M15-F176 PolarHBondContact O-N 3.42Å; L17-F176 HydrophobicContact CD2-CB 4.3Å; L17-F176 HydrophobicContact CD2-CD1 3.42Å; L17-F176 VanDerWaalsContact CD2-CD1 3.42Å; L17-F176 HydrophobicContact CD2-CE1 3.91Å; L17-F176 HydrophobicContact CD2-CG 4.08Å; L17-F176 HydrophobicContact CG-CB 4.15Å; L17-F176 HydrophobicContact CG-CD1 4.07Å; L17-F176 HydrophobicContact CG-CG 4.24Å; V77-F176 HydrophobicContact CG1-CE2 4.12Å; T81-F176 HydrophobicContact CG2-CD2 3.59Å; T81-F176 HydrophobicContact CG2-CE2 4.11Å; T81-F176 HydrophobicContact CG2-CG 4.44Å; T81-F176 WeakPolarHBondContact OG1-CD2 3.27Å; N84-F176 PolarHBondContact ND2-O 3.34Å; F176-S274 WeakPolarHBondContact CE1-OG 3.12Å; F176-V275 HydrophobicContact CE1-CG2 3.83Å; F176-V275 HydrophobicContact CZ-CG2 3.88Å; F176-I279 HydrophobicContact CE2-CD1 4.34Å
177F76Confident73.3Confident1 Ų141 Ų410%0.00423%0.229CC..SBendtrans-154159-176.889.8-106.3000109.6V77 Q99 F103 H175 D179 Y277 T278V77-F177 HydrophobicContact CG1-CB 4.01Å; V77-F177 HydrophobicContact CG1-CD1 4.15Å; V77-F177 HydrophobicContact CG1-CG 4.05Å; Q99-F177 VanDerWaalsContact NE2-CB 3.29Å; Q99-F177 VanDerWaalsContact NE2-CD2 3.31Å; F103-F177 HydrophobicContact CZ-CZ 4.45Å; H175-F177 AromaticContact CE1-CD1 3.22Å; H175-F177 WeakPolarHBondContact CE1-CD1 3.36Å; H175-F177 AromaticContact CE1-CE1 3.16Å; H175-F177 WeakPolarHBondContact CE1-CE1 3.08Å; H175-F177 AromaticContact CE1-CZ 3.93Å; H175-F177 AromaticContact ND1-CD1 3.36Å; H175-F177 WeakPolarHBondContact ND1-CD1 3.1Å; H175-F177 AromaticContact ND1-CE1 3.72Å; H175-F177 AromaticContact ND1-CG 3.79Å; H175-F177 PolarHBondContact ND1-N 3.38Å; H175-F177 PolarHBondContact ND1-O 3.07Å; H175-F177 VanDerWaalsContact ND1-O 3.09Å; H175-F177 PolarHBondContact O-N 3.03Å; F177-D179 HydrophobicContact CD2-CB 4.25Å; F177-D179 HydrophobicContact CE2-CB 3.57Å; F177-D179 HydrophobicContact CZ-CB 3.85Å; F177-D179 PolarHBondContact O-N 3.19Å; F177-Y277 HydrophobicContact CE1-CE2 4.39Å; F177-Y277 AromaticContact CZ-CE2 3.99Å; F177-Y277 HydrophobicContact CZ-CE2 3.99Å; F177-Y277 WeakPolarHBondContact CZ-OH 3.29Å; F177-T278 HydrophobicContact CD1-CG2 4.24Å; F177-T278 HydrophobicContact CE1-CG2 3.39Å; F177-T278 HydrophobicContact CE2-CG2 4.47Å; F177-T278 HydrophobicContact CZ-CG2 3.57Å
178C80.4Confident73.2Confident0 Ų041.6 Ų41.60%024%0.239CC..  trans-75107.9178.1-74.20000112.2C96 M100C96-C178 WeakPolarHBondContact CA-SG 3.21Å; C96-C178 HydrophobicContact CB-CB 3.99Å; C96-C178 WeakPolarHBondContact CB-SG 3.33Å; C96-C178 WeakPolarHBondContact SG-CB 3.45Å; C96-C178 CovalentContact SG-SG 2.02Å; C96-C178 PolarHBondContact SG-SG 3.43Å; M100-C178 HydrophobicContact CG-CB 3.98Å; M100-C178 VanDerWaalsContact CG-O 3.23Å; M100-C178 WeakPolarHBondContact CG-O 3.38Å; M100-C178 HydrophobicContact SD-CB 4.32Å
179D78.1Confident73.6Confident8 Ų837 Ų374%0.04323%0.226CC..  trans-118.5160.2175-170.721.8000110.9F177 P182 I183F177-D179 HydrophobicContact CD2-CB 4.25Å; F177-D179 HydrophobicContact CE2-CB 3.57Å; F177-D179 HydrophobicContact CZ-CB 3.85Å; F177-D179 PolarHBondContact O-N 3.19Å; D179-P182 HydrophobicContact CB-CG 4.18Å; D179-P182 WeakPolarHBondContact O-CD 3.49Å; D179-I183 VanDerWaalsContact O-CG1 3.23Å; D179-I183 WeakPolarHBondContact O-CG1 3.32Å; D179-I183 PolarHBondContact O-N 3.03Å
180T75.9Confident74.3Confident35 Ų3534.6 Ų34.622%0.21521%0.213CC..Hα-helixtrans-60.6-48.1-175.2-53.80000112M162 I183 L184 I198M162-T180 HydrophobicContact CE-CG2 4.08Å; M162-T180 HydrophobicContact SD-CG2 3.86Å; T180-I183 PolarHBondContact O-N 3.39Å; T180-L184 HydrophobicContact CG2-CD1 3.97Å; T180-L184 VanDerWaalsContact O-CG 3.28Å; T180-L184 WeakPolarHBondContact O-CG 3.37Å; T180-L184 PolarHBondContact O-N 3.48Å; T180-I198 HydrophobicContact CG2-CD1 3.44Å; T180-I198 VanDerWaalsContact CG2-CD1 3.44Å; T180-I198 HydrophobicContact CG2-CG1 4.32Å; T180-I198 HydrophobicContact CG2-CG2 4.25Å
181S73.5Confident75.2Confident60 Ų6032.8 Ų32.842%0.4220%0.2SC..Hα-helixtrans-67.3-47.7-175.5-52.30000113.3I183 L184 A185S181-I183 VanDerWaalsContact C-N 3.31Å; S181-I183 PolarHBondContact O-N 3.5Å; S181-L184 PolarHBondContact O-N 2.55Å; S181-A185 PolarHBondContact O-N 2.8Å; S181-A185 VanDerWaalsContact O-N 3.17Å
182P71.2Confident75.5Confident13 Ų1337.2 Ų37.28%0.08421%0.214CC..Hα-helixtrans-60.3-35.7175-24.934.8000114.1I173 H175 D179I173-P182 HydrophobicContact CG2-CB 3.77Å; H175-P182 HydrophobicContact CB-CB 4.17Å; H175-P182 HydrophobicContact CB-CG 3.81Å; D179-P182 HydrophobicContact CB-CG 4.18Å; D179-P182 WeakPolarHBondContact O-CD 3.49Å
183I77.1Confident75.8Confident0 Ų041.3 Ų41.30%024%0.235CC..Hα-helixtrans-71.3-42.7179-68.4-70000111.4F12 M100 M162 F167 I173 D179 T180 S181 A185 L186F12-I183 HydrophobicContact CZ-CD1 4.46Å; M100-I183 HydrophobicContact SD-CG1 3.89Å; M162-I183 HydrophobicContact CE-CB 3.84Å; M162-I183 HydrophobicContact CE-CG2 3.5Å; F167-I183 HydrophobicContact CE1-CG2 3.68Å; F167-I183 HydrophobicContact CZ-CG2 3.97Å; I173-I183 HydrophobicContact CD1-CD1 3.48Å; I173-I183 VanDerWaalsContact CD1-CD1 3.48Å; I173-I183 HydrophobicContact CG1-CD1 4.07Å; D179-I183 VanDerWaalsContact O-CG1 3.23Å; D179-I183 WeakPolarHBondContact O-CG1 3.32Å; D179-I183 PolarHBondContact O-N 3.03Å; T180-I183 PolarHBondContact O-N 3.39Å; S181-I183 VanDerWaalsContact C-N 3.31Å; S181-I183 PolarHBondContact O-N 3.5Å; I183-A185 PolarHBondContact O-N 3.14Å; I183-L186 PolarHBondContact O-N 3.25Å; I183-L186 VanDerWaalsContact O-N 3.1Å
184L75.3Confident76.3Confident12 Ų1241.7 Ų41.76%0.06324%0.237CC..Hα-helixtrans-61.4-35.4176.3-70173.1000112M162 L165 T180 S181 L186 S187 T191 T194 E195 I198M162-L184 HydrophobicContact CE-CD2 4.13Å; M162-L184 HydrophobicContact CE-CG 4.06Å; M162-L184 HydrophobicContact CG-CD2 4.42Å; L165-L184 HydrophobicContact CD1-CD2 3.49Å; L165-L184 VanDerWaalsContact CD1-CD2 3.49Å; T180-L184 HydrophobicContact CG2-CD1 3.97Å; T180-L184 VanDerWaalsContact O-CG 3.28Å; T180-L184 WeakPolarHBondContact O-CG 3.37Å; T180-L184 PolarHBondContact O-N 3.48Å; S181-L184 PolarHBondContact O-N 2.55Å; L184-L186 PolarHBondContact O-N 3.34Å; L184-S187 VanDerWaalsContact O-CB 3.3Å; L184-S187 WeakPolarHBondContact O-CB 3.32Å; L184-S187 PolarHBondContact O-N 3.29Å; L184-S187 VanDerWaalsContact O-N 3.12Å; L184-T191 HydrophobicContact CB-CG2 4.29Å; L184-T191 HydrophobicContact CD2-CG2 4.02Å; L184-T194 HydrophobicContact CD2-CG2 3.87Å; L184-E195 HydrophobicContact CD1-CG 3.8Å; L184-I198 HydrophobicContact CD1-CD1 3.87Å
185A73.8Confident76.8Confident85 Ų8539.2 Ų39.270%0.70223%0.226SC*.THydrogen-bonded Turntrans-64.1-17.817700000114.2S181 I183S181-A185 PolarHBondContact O-N 2.8Å; S181-A185 VanDerWaalsContact O-N 3.17Å; I183-A185 PolarHBondContact O-N 3.14Å
186L72.9Confident77.4Confident23 Ų2342.2 Ų42.212%0.1224%0.241CC..THydrogen-bonded Turntrans-90.8-4.6177.3-64.7173.7000113.5F167 Y168 I173 I183 L184F167-L186 HydrophobicContact CD1-CB 4.16Å; Y168-L186 PolarHBondContact N-O 3.07Å; Y168-L186 VanDerWaalsContact N-O 3.13Å; I173-L186 HydrophobicContact CG1-CD1 3.7Å; I183-L186 PolarHBondContact O-N 3.25Å; I183-L186 VanDerWaalsContact O-N 3.1Å; L184-L186 PolarHBondContact O-N 3.34Å
187S77.3Confident78.1Confident15 Ų1544.7 Ų44.711%0.10525%0.254CS..BIsolated β-bridgetrans-70.9132.8-178.9176.80000111.9H166 L184 T189 T191H166-S187 CarbonylContact O-C 3.27Å; H166-S187 WeakPolarHBondContact O-CA 3.28Å; L184-S187 VanDerWaalsContact O-CB 3.3Å; L184-S187 WeakPolarHBondContact O-CB 3.32Å; L184-S187 PolarHBondContact O-N 3.29Å; L184-S187 VanDerWaalsContact O-N 3.12Å; S187-T189 VanDerWaalsContact C-N 3.34Å; S187-T189 PolarHBondContact OG-N 2.89Å; S187-T189 VanDerWaalsContact OG-N 3.1Å; S187-T189 PolarHBondContact OG-O 3.48Å; S187-T189 PolarHBondContact OG-OG1 3.49Å; S187-T191 VanDerWaalsContact CB-CG2 3.48Å
188C74.5Confident78.5Confident60 Ų6045.7 Ų45.741%0.40526%0.259SS..SBendtrans-77-22.7166.5-63.50000112.7H166 Y168H166-C188 PolarHBondContact O-N 2.86Å; Y168-C188 WeakPolarHBondContact CA-SG 3.36Å; Y168-C188 WeakPolarHBondContact CD1-SG 3.46Å; Y168-C188 HydrophobicContact CD2-CB 4.35Å; Y168-C188 WeakPolarHBondContact CD2-SG 3.36Å; Y168-C188 HydrophobicContact CE2-CB 4.17Å; Y168-C188 PolarHBondContact N-SG 3.02Å
189T75Confident78.6Confident53 Ų5353.1 Ų53.133%0.32529%0.292SS..SBendtrans-94.5151.2-178.439.50000111.3H166 S187 T191H166-T189 HydrophobicContact CB-CG2 4.03Å; H166-T189 PolarHBondContact N-OG1 2.94Å; S187-T189 VanDerWaalsContact C-N 3.34Å; S187-T189 PolarHBondContact OG-N 2.89Å; S187-T189 VanDerWaalsContact OG-N 3.1Å; S187-T189 PolarHBondContact OG-O 3.48Å; S187-T189 PolarHBondContact OG-OG1 3.49Å; T189-T191 PolarHBondContact O-N 3.38Å; T189-T191 VanDerWaalsContact O-N 3.14Å
190D76Confident79.1Confident125 Ų12557.5 Ų57.567%0.66831%0.314SS*.  trans-55119173.9-178.513.7000110.7Y192D190-Y192 VanDerWaalsContact OD1-CB 3.23Å; D190-Y192 WeakPolarHBondContact OD1-CB 3.18Å; D190-Y192 PolarHBondContact OD1-N 3.45Å
191T82.7Confident79.7Confident23 Ų2356.6 Ų56.614%0.14131%0.308CS..  trans-87.2-6.8-177.3530000112.7L165 L184 S187 T189 N193 T194 E195L165-T191 HydrophobicContact CD1-CG2 4.32Å; L184-T191 HydrophobicContact CB-CG2 4.29Å; L184-T191 HydrophobicContact CD2-CG2 4.02Å; S187-T191 VanDerWaalsContact CB-CG2 3.48Å; T189-T191 PolarHBondContact O-N 3.38Å; T189-T191 VanDerWaalsContact O-N 3.14Å; T191-N193 VanDerWaalsContact C-N 3.34Å; T191-N193 PolarHBondContact O-N 2.94Å; T191-T194 PolarHBondContact O-N 3.46Å; T191-E195 WeakPolarHBondContact CB-OE1 3.33Å; T191-E195 WeakPolarHBondContact O-CG 3.31Å; T191-E195 PolarHBondContact O-N 2.95Å; T191-E195 VanDerWaalsContact OG1-CD 3.28Å; T191-E195 PolarHBondContact OG1-OE1 2.93Å
192Y80.6Confident80.3Confident137 Ų13756.5 Ų56.554%0.53731%0.305SS..Hα-helixtrans-49.1-49.2-170.9-179.5-104.7000113.8D190 T194 E195 I196D190-Y192 VanDerWaalsContact OD1-CB 3.23Å; D190-Y192 WeakPolarHBondContact OD1-CB 3.18Å; D190-Y192 PolarHBondContact OD1-N 3.45Å; Y192-T194 PolarHBondContact O-N 2.93Å; Y192-E195 PolarHBondContact O-N 3.29Å; Y192-I196 HydrophobicContact CD1-CD1 3.95Å; Y192-I196 HydrophobicContact CD2-CD1 4.24Å; Y192-I196 HydrophobicContact CE1-CD1 3.34Å; Y192-I196 HydrophobicContact CE1-CG1 4.49Å; Y192-I196 HydrophobicContact CE2-CD1 3.67Å; Y192-I196 HydrophobicContact CE2-CG1 4.35Å; Y192-I196 HydrophobicContact CG-CD1 4.38Å; Y192-I196 WeakPolarHBondContact O-CG1 3.32Å; Y192-I196 PolarHBondContact O-N 3.4Å; Y192-I196 WeakPolarHBondContact OH-CD1 3.25Å
193N82.6Confident81Confident122 Ų12257 Ų5765%0.65231%0.312SS*.Hα-helixtrans-64.2-40.4179.8-70-31.7000112.6T191 L197T191-N193 VanDerWaalsContact C-N 3.34Å; T191-N193 PolarHBondContact O-N 2.94Å; N193-L197 WeakPolarHBondContact O-CB 3.27Å; N193-L197 PolarHBondContact O-N 3.44Å
194T84.4Confident81.7Confident9 Ų959.5 Ų59.56%0.05533%0.33CS..Hα-helixtrans-69.9-40.2178.5-620000110.4S161 M162 L165 L184 T191 Y192 L197 I198S161-T194 PolarHBondContact OG-OG1 2.82Å; M162-T194 HydrophobicContact CG-CG2 3.73Å; L165-T194 HydrophobicContact CD1-CG2 4.43Å; L184-T194 HydrophobicContact CD2-CG2 3.87Å; T191-T194 PolarHBondContact O-N 3.46Å; Y192-T194 PolarHBondContact O-N 2.93Å; T194-L197 WeakPolarHBondContact O-CB 3.27Å; T194-L197 PolarHBondContact O-N 3.35Å; T194-I198 HydrophobicContact CG2-CD1 3.72Å; T194-I198 VanDerWaalsContact O-CD1 3.32Å; T194-I198 WeakPolarHBondContact O-CD1 3.45Å; T194-I198 VanDerWaalsContact O-CG1 3.27Å; T194-I198 WeakPolarHBondContact O-CG1 3.38Å; T194-I198 PolarHBondContact O-N 3.05Å
195E81.5Confident82.4Confident38 Ų3859.1 Ų59.118%0.17833%0.328CS..Hα-helixtrans-63.5-42.7176.2-72.5176.6-17900112.6L184 T191 Y192 I198 F199 R262L184-E195 HydrophobicContact CD1-CG 3.8Å; T191-E195 WeakPolarHBondContact CB-OE1 3.33Å; T191-E195 WeakPolarHBondContact O-CG 3.31Å; T191-E195 PolarHBondContact O-N 2.95Å; T191-E195 VanDerWaalsContact OG1-CD 3.28Å; T191-E195 PolarHBondContact OG1-OE1 2.93Å; Y192-E195 PolarHBondContact O-N 3.29Å; E195-I198 PolarHBondContact O-N 2.86Å; E195-F199 VanDerWaalsContact O-CB 3.27Å; E195-F199 WeakPolarHBondContact O-CB 3.27Å; E195-F199 PolarHBondContact O-N 2.89Å; E195-R262 IonicContact OE1-CZ 2.7Å; E195-R262 IonicContact OE1-NH1 3.39Å; E195-R262 PolarHBondContact OE1-NH1 3.34Å; E195-R262 VanDerWaalsContact OE1-NH1 3.12Å; E195-R262 IonicContact OE1-NH2 3.16Å; E195-R262 PolarHBondContact OE1-NH2 2.99Å; E195-R262 IonicContact OE2-CZ 3.61Å; E195-R262 IonicContact OE2-NH1 2.74Å; E195-R262 PolarHBondContact OE2-NH1 3.19Å; E195-R262 IonicContact OE2-NH2 3.12Å; E195-R262 PolarHBondContact OE2-NH2 3.48Å
196I83.3Confident83.1Confident65 Ų6556.6 Ų56.633%0.33330%0.303SS..Hα-helixtrans-63.8-44.3174.5-75.9-177.8000110.8Y192 I198 F199 I200Y192-I196 HydrophobicContact CD1-CD1 3.95Å; Y192-I196 HydrophobicContact CD2-CD1 4.24Å; Y192-I196 HydrophobicContact CE1-CD1 3.34Å; Y192-I196 HydrophobicContact CE1-CG1 4.49Å; Y192-I196 HydrophobicContact CE2-CD1 3.67Å; Y192-I196 HydrophobicContact CE2-CG1 4.35Å; Y192-I196 HydrophobicContact CG-CD1 4.38Å; Y192-I196 WeakPolarHBondContact O-CG1 3.32Å; Y192-I196 PolarHBondContact O-N 3.4Å; Y192-I196 WeakPolarHBondContact OH-CD1 3.25Å; I196-I198 PolarHBondContact O-N 3.34Å; I196-F199 PolarHBondContact O-N 3.37Å; I196-I200 HydrophobicContact CG2-CD1 3.62Å; I196-I200 HydrophobicContact CG2-CG1 4.26Å; I196-I200 WeakPolarHBondContact O-CB 3.37Å; I196-I200 VanDerWaalsContact O-CG1 3.27Å; I196-I200 WeakPolarHBondContact O-CG1 3.36Å; I196-I200 PolarHBondContact O-N 3.4Å
197L87.4Confident84Confident54 Ų5462 Ų6228%0.28333%0.329SS..Hα-helixtrans-57.9-49.4177.5176.363.8000111.2V157 N193 T194 F199 I200 I201V157-L197 HydrophobicContact CG1-CD1 4.25Å; V157-L197 HydrophobicContact CG1-CD2 3.92Å; V157-L197 HydrophobicContact CG1-CG 4.44Å; N193-L197 WeakPolarHBondContact O-CB 3.27Å; N193-L197 PolarHBondContact O-N 3.44Å; T194-L197 WeakPolarHBondContact O-CB 3.27Å; T194-L197 PolarHBondContact O-N 3.35Å; L197-F199 VanDerWaalsContact C-N 3.34Å; L197-F199 PolarHBondContact O-N 2.84Å; L197-I200 PolarHBondContact O-N 3.12Å; L197-I201 HydrophobicContact CD1-CD1 3.81Å; L197-I201 HydrophobicContact CD1-CG1 4.37Å; L197-I201 HydrophobicContact CG-CD1 3.92Å; L197-I201 WeakPolarHBondContact O-CG1 3.15Å; L197-I201 PolarHBondContact O-N 3.36Å
198I85.4Confident84.8Confident23 Ų2364.8 Ų64.812%0.11835%0.345CS..Hα-helixtrans-61.1-44.7177-68.7156.6000110.5N158 M162 T180 L184 T194 E195 I196 I200 I201 V202N158-I198 WeakPolarHBondContact OD1-CG1 3.25Å; M162-I198 HydrophobicContact CG-CD1 4.48Å; M162-I198 HydrophobicContact SD-CD1 4.25Å; T180-I198 HydrophobicContact CG2-CD1 3.44Å; T180-I198 VanDerWaalsContact CG2-CD1 3.44Å; T180-I198 HydrophobicContact CG2-CG1 4.32Å; T180-I198 HydrophobicContact CG2-CG2 4.25Å; L184-I198 HydrophobicContact CD1-CD1 3.87Å; T194-I198 HydrophobicContact CG2-CD1 3.72Å; T194-I198 VanDerWaalsContact O-CD1 3.32Å; T194-I198 WeakPolarHBondContact O-CD1 3.45Å; T194-I198 VanDerWaalsContact O-CG1 3.27Å; T194-I198 WeakPolarHBondContact O-CG1 3.38Å; T194-I198 PolarHBondContact O-N 3.05Å; E195-I198 PolarHBondContact O-N 2.86Å; I196-I198 PolarHBondContact O-N 3.34Å; I198-I200 VanDerWaalsContact C-N 3.33Å; I198-I200 PolarHBondContact O-N 2.92Å; I198-I201 PolarHBondContact O-N 2.99Å; I198-V202 HydrophobicContact CG2-CG2 4.1Å; I198-V202 WeakPolarHBondContact O-CB 3.33Å; I198-V202 WeakPolarHBondContact O-CG2 3.21Å; I198-V202 PolarHBondContact O-N 3.35Å
199F83.1Confident85.7Confident155 Ų15561.9 Ų61.968%0.6833%0.326SS*.Hα-helixtrans-61.2-41.9178.4-179.9-96.2000112E195 I196 L197 G203E195-F199 VanDerWaalsContact O-CB 3.27Å; E195-F199 WeakPolarHBondContact O-CB 3.27Å; E195-F199 PolarHBondContact O-N 2.89Å; I196-F199 PolarHBondContact O-N 3.37Å; L197-F199 VanDerWaalsContact C-N 3.34Å; L197-F199 PolarHBondContact O-N 2.84Å; F199-G203 VanDerWaalsContact O-CA 3.3Å; F199-G203 WeakPolarHBondContact O-CA 3.45Å; F199-G203 PolarHBondContact O-N 3.45Å
200I87.5Confident86.5Confident101 Ų10161.5 Ų61.552%0.51832%0.321SS..Hα-helixtrans-63.4-49.6175.9-70.6168.4000110I196 L197 I198 G203 S204I196-I200 HydrophobicContact CG2-CD1 3.62Å; I196-I200 HydrophobicContact CG2-CG1 4.26Å; I196-I200 WeakPolarHBondContact O-CB 3.37Å; I196-I200 VanDerWaalsContact O-CG1 3.27Å; I196-I200 WeakPolarHBondContact O-CG1 3.36Å; I196-I200 PolarHBondContact O-N 3.4Å; L197-I200 PolarHBondContact O-N 3.12Å; I198-I200 VanDerWaalsContact C-N 3.33Å; I198-I200 PolarHBondContact O-N 2.92Å; I200-G203 PolarHBondContact O-N 3.17Å; I200-S204 VanDerWaalsContact O-CB 3.24Å; I200-S204 WeakPolarHBondContact O-CB 3.25Å; I200-S204 PolarHBondContact O-N 3.02Å; I200-S204 PolarHBondContact O-OG 3.17Å
201I89Confident87.4Confident15 Ų1562.8 Ų62.88%0.07732%0.321CS..Hα-helixtrans-62.6-51.8-177.6-72.2168.2000111.4D154 V157 N158 L197 I198 S204 T205D154-I201 HydrophobicContact CB-CG2 3.72Å; V157-I201 HydrophobicContact CG1-CD1 4.07Å; N158-I201 WeakPolarHBondContact OD1-CD1 3.32Å; L197-I201 HydrophobicContact CD1-CD1 3.81Å; L197-I201 HydrophobicContact CD1-CG1 4.37Å; L197-I201 HydrophobicContact CG-CD1 3.92Å; L197-I201 WeakPolarHBondContact O-CG1 3.15Å; L197-I201 PolarHBondContact O-N 3.36Å; I198-I201 PolarHBondContact O-N 2.99Å; I201-S204 PolarHBondContact O-OG 2.91Å; I201-S204 VanDerWaalsContact O-OG 3.05Å; I201-T205 WeakPolarHBondContact O-CB 3.35Å; I201-T205 PolarHBondContact O-N 3.37Å; I201-T205 PolarHBondContact O-OG1 2.67Å
202V85.8Confident88Confident59 Ų5964 Ų6436%0.35833%0.329SS..Hα-helixtrans-66.1-44.6179.9175.20000110I198 T205 L206I198-V202 HydrophobicContact CG2-CG2 4.1Å; I198-V202 WeakPolarHBondContact O-CB 3.33Å; I198-V202 WeakPolarHBondContact O-CG2 3.21Å; I198-V202 PolarHBondContact O-N 3.35Å; V202-T205 PolarHBondContact O-N 3.33Å; V202-L206 HydrophobicContact CG1-CD1 3.98Å; V202-L206 HydrophobicContact CG1-CG 4.39Å; V202-L206 VanDerWaalsContact O-CG 3.3Å; V202-L206 WeakPolarHBondContact O-CG 3.38Å; V202-L206 PolarHBondContact O-N 2.86Å
203G86.7Confident88.7Confident23 Ų2357.8 Ų57.824%0.23730%0.304CS..Hα-helixtrans-60.8-47.6178.300000112.4F199 I200 T205 L206 M207F199-G203 VanDerWaalsContact O-CA 3.3Å; F199-G203 WeakPolarHBondContact O-CA 3.45Å; F199-G203 PolarHBondContact O-N 3.45Å; I200-G203 PolarHBondContact O-N 3.17Å; G203-T205 PolarHBondContact O-N 3.46Å; G203-L206 PolarHBondContact O-N 2.84Å; G203-M207 VanDerWaalsContact O-CB 3.3Å; G203-M207 WeakPolarHBondContact O-CB 3.49Å; G203-M207 WeakPolarHBondContact O-CG 3.43Å; G203-M207 PolarHBondContact O-N 2.9Å
204S90.4Very high89.2Confident53 Ų5355.1 Ų55.137%0.37130%0.295SS..Hα-helixtrans-64.8-40.5177.762.50000111.8I200 I201 M207 V208I200-S204 VanDerWaalsContact O-CB 3.24Å; I200-S204 WeakPolarHBondContact O-CB 3.25Å; I200-S204 PolarHBondContact O-N 3.02Å; I200-S204 PolarHBondContact O-OG 3.17Å; I201-S204 PolarHBondContact O-OG 2.91Å; I201-S204 VanDerWaalsContact O-OG 3.05Å; S204-M207 PolarHBondContact O-N 2.94Å; S204-V208 WeakPolarHBondContact O-CB 3.34Å; S204-V208 VanDerWaalsContact O-CG2 3.25Å; S204-V208 WeakPolarHBondContact O-CG2 3.36Å; S204-V208 PolarHBondContact O-N 3.45Å
205T91Very high89.8Confident4 Ų456.1 Ų56.13%0.02531%0.305CS..Hα-helixtrans-57.1-55.7176-63.40000110.3T108 C111 Y112 I201 V202 G203 M207 V208 S209T108-T205 HydrophobicContact CG2-CG2 3.97Å; C111-T205 HydrophobicContact CB-CG2 3.85Å; Y112-T205 HydrophobicContact CE2-CG2 3.98Å; I201-T205 WeakPolarHBondContact O-CB 3.35Å; I201-T205 PolarHBondContact O-N 3.37Å; I201-T205 PolarHBondContact O-OG1 2.67Å; V202-T205 PolarHBondContact O-N 3.33Å; G203-T205 PolarHBondContact O-N 3.46Å; T205-M207 PolarHBondContact O-N 3.34Å; T205-V208 PolarHBondContact O-N 3.02Å; T205-S209 VanDerWaalsContact O-CB 3.29Å; T205-S209 WeakPolarHBondContact O-CB 3.34Å; T205-S209 PolarHBondContact O-N 2.93Å; T205-S209 PolarHBondContact O-OG 3.25Å
206L89.1Confident90.5Very high32 Ų3254.8 Ų54.817%0.16830%0.299CS..Hα-helixtrans-61.6-42.1-179.6-67.6175.9000112.3V202 G203 S209 L210 Y251 L254V202-L206 HydrophobicContact CG1-CD1 3.98Å; V202-L206 HydrophobicContact CG1-CG 4.39Å; V202-L206 VanDerWaalsContact O-CG 3.3Å; V202-L206 WeakPolarHBondContact O-CG 3.38Å; V202-L206 PolarHBondContact O-N 2.86Å; G203-L206 PolarHBondContact O-N 2.84Å; L206-S209 PolarHBondContact O-OG 2.87Å; L206-S209 VanDerWaalsContact O-OG 3.12Å; L206-L210 WeakPolarHBondContact O-CB 3.45Å; L206-L210 VanDerWaalsContact O-CG 3.27Å; L206-L210 WeakPolarHBondContact O-CG 3.19Å; L206-L210 PolarHBondContact O-N 2.91Å; L206-Y251 HydrophobicContact CD2-CD1 3.97Å; L206-Y251 HydrophobicContact CD2-CE1 3.67Å; L206-L254 HydrophobicContact CD2-CD1 4.11Å
207M90.3Very high91Very high135 Ų13552.9 Ų52.967%0.66529%0.288SS*.Hα-helixtrans-65.4-49.8-179.1-73.8-65.6137.900111.6G203 S204 T205 S209 F211G203-M207 VanDerWaalsContact O-CB 3.3Å; G203-M207 WeakPolarHBondContact O-CB 3.49Å; G203-M207 WeakPolarHBondContact O-CG 3.43Å; G203-M207 PolarHBondContact O-N 2.9Å; S204-M207 PolarHBondContact O-N 2.94Å; T205-M207 PolarHBondContact O-N 3.34Å; M207-S209 PolarHBondContact O-N 3.32Å; M207-F211 WeakPolarHBondContact O-CB 3.35Å; M207-F211 PolarHBondContact O-N 2.96Å
208V94.3Very high91.3Very high74 Ų7454.9 Ų54.945%0.44830%0.302SS..Hα-helixtrans-64.4-43.4-179.2173.70000110.6Y112 S204 T205 T212Y112-V208 HydrophobicContact CE1-CB 4.19Å; Y112-V208 HydrophobicContact CE1-CG1 3.88Å; S204-V208 WeakPolarHBondContact O-CB 3.34Å; S204-V208 VanDerWaalsContact O-CG2 3.25Å; S204-V208 WeakPolarHBondContact O-CG2 3.36Å; S204-V208 PolarHBondContact O-N 3.45Å; T205-V208 PolarHBondContact O-N 3.02Å; V208-T212 WeakPolarHBondContact O-CB 3.06Å; V208-T212 PolarHBondContact O-N 3.47Å; V208-T212 PolarHBondContact O-OG1 3.47Å
209S94.1Very high91.7Very high0 Ų059.2 Ų59.20%032%0.321CS..Hα-helixtrans-68.3-47.5-177.466.10000112.1S115 T205 L206 M207 T212 I213 Y251S115-S209 WeakPolarHBondContact OG-CA 3.33Å; S115-S209 VanDerWaalsContact OG-CB 3.27Å; S115-S209 WeakPolarHBondContact OG-CB 3.36Å; S115-S209 PolarHBondContact OG-O 2.8Å; T205-S209 VanDerWaalsContact O-CB 3.29Å; T205-S209 WeakPolarHBondContact O-CB 3.34Å; T205-S209 PolarHBondContact O-N 2.93Å; T205-S209 PolarHBondContact O-OG 3.25Å; L206-S209 PolarHBondContact O-OG 2.87Å; L206-S209 VanDerWaalsContact O-OG 3.12Å; M207-S209 PolarHBondContact O-N 3.32Å; S209-T212 PolarHBondContact O-N 3.46Å; S209-I213 VanDerWaalsContact O-CG1 3.26Å; S209-I213 WeakPolarHBondContact O-CG1 3.43Å; S209-I213 PolarHBondContact O-N 3.44Å; S209-Y251 WeakPolarHBondContact CB-OH 3.28Å; S209-Y251 PolarHBondContact OG-OH 3.34Å
210L91.6Very high92.3Very high45 Ų4552 Ų5224%0.23629%0.289CS..Hα-helixtrans-65.4-39.4177-76.2172.8000112.5L206 T212 I213 S214 Y251L206-L210 WeakPolarHBondContact O-CB 3.45Å; L206-L210 VanDerWaalsContact O-CG 3.27Å; L206-L210 WeakPolarHBondContact O-CG 3.19Å; L206-L210 PolarHBondContact O-N 2.91Å; L210-T212 VanDerWaalsContact C-N 3.34Å; L210-I213 PolarHBondContact O-N 2.92Å; L210-S214 VanDerWaalsContact O-CB 3.23Å; L210-S214 WeakPolarHBondContact O-CB 3.36Å; L210-S214 PolarHBondContact O-N 2.74Å; L210-S214 PolarHBondContact O-OG 3.41Å; L210-Y251 HydrophobicContact CD1-CD1 3.83Å; L210-Y251 HydrophobicContact CD1-CE1 4.06Å; L210-Y251 HydrophobicContact CD2-CD1 3.44Å; L210-Y251 VanDerWaalsContact CD2-CD1 3.44Å; L210-Y251 HydrophobicContact CD2-CD2 3.82Å; L210-Y251 HydrophobicContact CD2-CE1 3.62Å; L210-Y251 HydrophobicContact CD2-CE2 4Å; L210-Y251 HydrophobicContact CD2-CG 3.54Å; L210-Y251 HydrophobicContact CG-CD1 3.61Å; L210-Y251 HydrophobicContact CG-CE1 3.48Å; L210-Y251 VanDerWaalsContact CG-CE1 3.48Å; L210-Y251 HydrophobicContact CG-CG 4.26Å
211F94.9Very high92.5Very high152 Ų15251 Ų5167%0.66729%0.285SS*.Hα-helixtrans-59.6-48.2175.2175.5-100.9000110.6M207 I213 S214 A215M207-F211 WeakPolarHBondContact O-CB 3.35Å; M207-F211 PolarHBondContact O-N 2.96Å; F211-I213 PolarHBondContact O-N 3.49Å; F211-S214 PolarHBondContact O-N 2.88Å; F211-A215 VanDerWaalsContact O-CB 3.27Å; F211-A215 WeakPolarHBondContact O-CB 2.96Å; F211-A215 PolarHBondContact O-N 3.23Å
212T95.5Very high92.6Very high48 Ų4855.8 Ų55.829%0.29431%0.305SS..Hα-helixtrans-61.3-44.1179.4-56.80000111.7V208 S209 L210 S216V208-T212 WeakPolarHBondContact O-CB 3.06Å; V208-T212 PolarHBondContact O-N 3.47Å; V208-T212 PolarHBondContact O-OG1 3.47Å; S209-T212 PolarHBondContact O-N 3.46Å; L210-T212 VanDerWaalsContact C-N 3.34Å; T212-S216 WeakPolarHBondContact O-CB 3.38Å; T212-S216 PolarHBondContact O-N 2.84Å; T212-S216 PolarHBondContact O-OG 3.22Å
213I94.9Very high92.9Very high6 Ų654.7 Ų54.73%0.03130%0.299CS..Hα-helixtrans-62.7-51.1176.7-67.9166000110.1L114 A118 S209 L210 F211 A215 S216 Y217 V247 Y251L114-I213 HydrophobicContact CB-CD1 4.24Å; A118-I213 HydrophobicContact CB-CB 4.28Å; A118-I213 HydrophobicContact CB-CG1 3.93Å; A118-I213 HydrophobicContact CB-CG2 4.35Å; S209-I213 VanDerWaalsContact O-CG1 3.26Å; S209-I213 WeakPolarHBondContact O-CG1 3.43Å; S209-I213 PolarHBondContact O-N 3.44Å; L210-I213 PolarHBondContact O-N 2.92Å; F211-I213 PolarHBondContact O-N 3.49Å; I213-A215 PolarHBondContact O-N 2.89Å; I213-S216 WeakPolarHBondContact O-CB 3.23Å; I213-S216 PolarHBondContact O-N 3.1Å; I213-Y217 HydrophobicContact CG2-CD2 3.78Å; I213-Y217 HydrophobicContact CG2-CE2 4.05Å; I213-Y217 VanDerWaalsContact O-CD2 3.3Å; I213-Y217 WeakPolarHBondContact O-CD2 3.49Å; I213-Y217 PolarHBondContact O-N 3.08Å; I213-V247 HydrophobicContact CD1-CG1 4.16Å; I213-V247 HydrophobicContact CD1-CG2 4.23Å; I213-V247 HydrophobicContact CG2-CG1 4.08Å; I213-Y251 HydrophobicContact CD1-CE2 3.75Å
214S94.1Very high93Very high66 Ų6653.8 Ų53.846%0.46229%0.288SS..Hα-helixtrans-62.5-46.9-176.1-570000111.2L210 F211 S216 Y217 V218L210-S214 VanDerWaalsContact O-CB 3.23Å; L210-S214 WeakPolarHBondContact O-CB 3.36Å; L210-S214 PolarHBondContact O-N 2.74Å; L210-S214 PolarHBondContact O-OG 3.41Å; F211-S214 PolarHBondContact O-N 2.88Å; S214-S216 PolarHBondContact O-N 2.84Å; S214-Y217 PolarHBondContact O-N 3.05Å; S214-V218 VanDerWaalsContact O-CG2 3.29Å; S214-V218 WeakPolarHBondContact O-CG2 2.98Å; S214-V218 PolarHBondContact O-N 3.07Å
215A96.1Very high92.9Very high31 Ų3156.3 Ų56.326%0.25630%0.297SS..Hα-helixtrans-57.2-48.7175.800000111.2F211 I213 Y217 V218 F219F211-A215 VanDerWaalsContact O-CB 3.27Å; F211-A215 WeakPolarHBondContact O-CB 2.96Å; F211-A215 PolarHBondContact O-N 3.23Å; I213-A215 PolarHBondContact O-N 2.89Å; A215-Y217 VanDerWaalsContact C-N 3.32Å; A215-Y217 PolarHBondContact O-N 3.39Å; A215-V218 PolarHBondContact O-N 3.28Å; A215-F219 WeakPolarHBondContact O-CD2 2.97Å; A215-F219 PolarHBondContact O-N 3.19Å; A215-F219 VanDerWaalsContact O-N 3.13Å
216S96.1Very high92.9Very high9 Ų962.7 Ų62.76%0.06333%0.325CS..Hα-helixtrans-54.6-47.8177.2-62.10000111.5T212 I213 S214 F219 I220T212-S216 WeakPolarHBondContact O-CB 3.38Å; T212-S216 PolarHBondContact O-N 2.84Å; T212-S216 PolarHBondContact O-OG 3.22Å; I213-S216 WeakPolarHBondContact O-CB 3.23Å; I213-S216 PolarHBondContact O-N 3.1Å; S214-S216 PolarHBondContact O-N 2.84Å; S216-F219 PolarHBondContact O-N 3.47Å; S216-I220 WeakPolarHBondContact O-CG1 3.43Å; S216-I220 PolarHBondContact O-N 3.07Å
217Y93.9Very high92.9Very high25 Ų2563.5 Ų63.510%0.09833%0.329CS..Hα-helixtrans-73.6-30-177.9-84.6-73.4000114.6A118 I213 S214 A215 I220 L221 C240 H243 L244A118-Y217 HydrophobicContact CB-CD2 4.47Å; A118-Y217 HydrophobicContact CB-CE2 4.03Å; I213-Y217 HydrophobicContact CG2-CD2 3.78Å; I213-Y217 HydrophobicContact CG2-CE2 4.05Å; I213-Y217 VanDerWaalsContact O-CD2 3.3Å; I213-Y217 WeakPolarHBondContact O-CD2 3.49Å; I213-Y217 PolarHBondContact O-N 3.08Å; S214-Y217 PolarHBondContact O-N 3.05Å; A215-Y217 VanDerWaalsContact C-N 3.32Å; A215-Y217 PolarHBondContact O-N 3.39Å; Y217-I220 HydrophobicContact CD1-CD1 3.91Å; Y217-I220 HydrophobicContact CE1-CD1 3.99Å; Y217-I220 HydrophobicContact CG-CD1 4.38Å; Y217-I220 PolarHBondContact O-N 2.94Å; Y217-L221 VanDerWaalsContact O-CB 3.29Å; Y217-L221 WeakPolarHBondContact O-CB 3.46Å; Y217-L221 PolarHBondContact O-N 3.33Å; Y217-C240 HydrophobicContact CE1-CB 3.84Å; Y217-H243 AromaticContact CE2-ND1 3.59Å; Y217-H243 AromaticContact CZ-ND1 3.62Å; Y217-H243 WeakPolarHBondContact OH-CB 3.29Å; Y217-H243 PolarHBondContact OH-ND1 3.18Å; Y217-L244 HydrophobicContact CD1-CD1 3.84Å; Y217-L244 HydrophobicContact CD1-CD2 3.75Å; Y217-L244 HydrophobicContact CD1-CG 3.93Å; Y217-L244 HydrophobicContact CD2-CD2 3.61Å; Y217-L244 HydrophobicContact CD2-CG 4.46Å; Y217-L244 HydrophobicContact CE1-CD1 3.69Å; Y217-L244 HydrophobicContact CE1-CD2 3.71Å; Y217-L244 HydrophobicContact CE1-CG 3.5Å; Y217-L244 VanDerWaalsContact CE1-CG 3.5Å; Y217-L244 HydrophobicContact CE2-CD2 3.55Å; Y217-L244 HydrophobicContact CE2-CG 4.08Å; Y217-L244 HydrophobicContact CG-CD2 3.7Å; Y217-L244 HydrophobicContact CG-CG 4.39Å
218V94.3Very high92.8Very high96 Ų9665 Ų6558%0.58234%0.339SS*.Hα-helixtrans-62.3-46.2170.9167.80000110.2S214 A215 L221 F222S214-V218 VanDerWaalsContact O-CG2 3.29Å; S214-V218 WeakPolarHBondContact O-CG2 2.98Å; S214-V218 PolarHBondContact O-N 3.07Å; A215-V218 PolarHBondContact O-N 3.28Å; V218-L221 PolarHBondContact O-N 3.17Å; V218-F222 PolarHBondContact O-N 2.91Å
219F94.2Very high92.7Very high114 Ų11464.1 Ų64.150%0.534%0.336SS..Hα-helixtrans-67.2-38.9176.6-71.3-65.3000113Y122 A215 S216 L221 F222 T223Y122-F219 HydrophobicContact CD2-CB 3.78Å; Y122-F219 HydrophobicContact CE2-CB 3.59Å; Y122-F219 HydrophobicContact CE2-CD2 4.18Å; Y122-F219 HydrophobicContact CE2-CG 4.02Å; A215-F219 WeakPolarHBondContact O-CD2 2.97Å; A215-F219 PolarHBondContact O-N 3.19Å; A215-F219 VanDerWaalsContact O-N 3.13Å; S216-F219 PolarHBondContact O-N 3.47Å; F219-L221 VanDerWaalsContact C-N 3.34Å; F219-F222 PolarHBondContact O-N 3.48Å; F219-T223 PolarHBondContact O-N 3.3Å; F219-T223 PolarHBondContact O-OG1 3.44Å
220I93.8Very high92.3Very high3 Ų369.6 Ų69.62%0.01537%0.37CS..Hα-helixtrans-58.9-48.7173.4-71.5165.2000109.8R121 I125 S216 Y217 F222 T223 I224R121-I220 HydrophobicContact CB-CD1 4.05Å; I125-I220 HydrophobicContact CD1-CG1 4.49Å; I125-I220 HydrophobicContact CD1-CG2 3.83Å; I125-I220 HydrophobicContact CG2-CG2 4.28Å; S216-I220 WeakPolarHBondContact O-CG1 3.43Å; S216-I220 PolarHBondContact O-N 3.07Å; Y217-I220 HydrophobicContact CD1-CD1 3.91Å; Y217-I220 HydrophobicContact CE1-CD1 3.99Å; Y217-I220 HydrophobicContact CG-CD1 4.38Å; Y217-I220 PolarHBondContact O-N 2.94Å; I220-F222 VanDerWaalsContact C-N 3.35Å; I220-F222 PolarHBondContact O-N 3.06Å; I220-T223 WeakPolarHBondContact O-CB 3.36Å; I220-T223 PolarHBondContact O-N 3.15Å; I220-T223 VanDerWaalsContact O-N 3.17Å; I220-I224 HydrophobicContact CG2-CD1 3.63Å; I220-I224 HydrophobicContact CG2-CG1 4.25Å; I220-I224 VanDerWaalsContact O-CG1 3.3Å; I220-I224 WeakPolarHBondContact O-CG1 3.23Å; I220-I224 PolarHBondContact O-N 2.02Å
221L91.9Very high91.9Very high81 Ų8171.4 Ų71.442%0.42439%0.386SS..Hα-helixtrans-58.7-47.7179.4178.562.3000111Y217 V218 F219 T223 I224 L225 F237Y217-L221 VanDerWaalsContact O-CB 3.29Å; Y217-L221 WeakPolarHBondContact O-CB 3.46Å; Y217-L221 PolarHBondContact O-N 3.33Å; V218-L221 PolarHBondContact O-N 3.17Å; F219-L221 VanDerWaalsContact C-N 3.34Å; L221-T223 VanDerWaalsContact C-N 3.29Å; L221-T223 PolarHBondContact O-N 2.99Å; L221-I224 PolarHBondContact O-N 3.02Å; L221-L225 HydrophobicContact CD1-CD1 4.44Å; L221-L225 HydrophobicContact CD1-CG 4.33Å; L221-L225 HydrophobicContact CG-CD1 4.21Å; L221-L225 VanDerWaalsContact O-CG 3.3Å; L221-L225 WeakPolarHBondContact O-CG 3.13Å; L221-L225 PolarHBondContact O-N 3.34Å; L221-F237 HydrophobicContact CD1-CE1 4.44Å; L221-F237 HydrophobicContact CD1-CZ 4.05Å
222F91.9Very high91.3Very high115 Ų11565.3 Ų65.350%0.50437%0.366SS..Hα-helixtrans-58.4-41.8176.9-176.9-109.2000112.3V218 F219 I220 L225 K226V218-F222 PolarHBondContact O-N 2.91Å; F219-F222 PolarHBondContact O-N 3.48Å; I220-F222 VanDerWaalsContact C-N 3.35Å; I220-F222 PolarHBondContact O-N 3.06Å; F222-L225 PolarHBondContact O-N 2.95Å; F222-K226 HydrophobicContact CD1-CD 4.44Å; F222-K226 HydrophobicContact CE1-CD 4.12Å; F222-K226 HydrophobicContact CZ-CD 4.46Å; F222-K226 PolarHBondContact O-N 2.75Å
223T91.1Very high90.8Very high37 Ų3766.4 Ų66.423%0.22737%0.367CS..Hα-helixtrans-64.4-44.4176-58.30000111.5I125 C126 F219 I220 L221 L225 K226 I227I125-T223 HydrophobicContact CG2-CG2 4.19Å; C126-T223 PolarHBondContact SG-OG1 3.48Å; F219-T223 PolarHBondContact O-N 3.3Å; F219-T223 PolarHBondContact O-OG1 3.44Å; I220-T223 WeakPolarHBondContact O-CB 3.36Å; I220-T223 PolarHBondContact O-N 3.15Å; I220-T223 VanDerWaalsContact O-N 3.17Å; L221-T223 VanDerWaalsContact C-N 3.29Å; L221-T223 PolarHBondContact O-N 2.99Å; T223-L225 VanDerWaalsContact C-N 3.32Å; T223-L225 PolarHBondContact O-N 2.94Å; T223-K226 WeakPolarHBondContact O-CB 3.42Å; T223-K226 PolarHBondContact O-N 3.05Å; T223-I227 PolarHBondContact O-N 3.3Å
224I89.5Confident90.3Very high3 Ų373 Ų732%0.01540%0.397CS..Hα-helixtrans-62.7-40.2178.6-68.4172.8000111.3I125 I220 L221 K226 I227 K233 A236 F237I125-I224 HydrophobicContact CG2-CG1 4.34Å; I220-I224 HydrophobicContact CG2-CD1 3.63Å; I220-I224 HydrophobicContact CG2-CG1 4.25Å; I220-I224 VanDerWaalsContact O-CG1 3.3Å; I220-I224 WeakPolarHBondContact O-CG1 3.23Å; I220-I224 PolarHBondContact O-N 2.02Å; L221-I224 PolarHBondContact O-N 3.02Å; I224-K226 PolarHBondContact O-N 3.29Å; I224-I227 WeakPolarHBondContact O-CB 3.39Å; I224-I227 PolarHBondContact O-N 3.1Å; I224-I227 VanDerWaalsContact O-N 3.09Å; I224-K233 HydrophobicContact CG2-CB 4.27Å; I224-K233 HydrophobicContact CG2-CG 4.19Å; I224-A236 HydrophobicContact CD1-CB 3.74Å; I224-A236 HydrophobicContact CG1-CB 3.68Å; I224-F237 HydrophobicContact CG2-CD2 3.78Å; I224-F237 HydrophobicContact CG2-CE2 3.42Å; I224-F237 VanDerWaalsContact CG2-CE2 3.42Å; I224-F237 HydrophobicContact CG2-CZ 4.06Å
225L88.9Confident89.7Confident107 Ų10777.5 Ų77.556%0.5641%0.409SS*.Hα-helixtrans-61.6-31.2177.9-70.6173.8000112.4L221 F222 T223L221-L225 HydrophobicContact CD1-CD1 4.44Å; L221-L225 HydrophobicContact CD1-CG 4.33Å; L221-L225 HydrophobicContact CG-CD1 4.21Å; L221-L225 VanDerWaalsContact O-CG 3.3Å; L221-L225 WeakPolarHBondContact O-CG 3.13Å; L221-L225 PolarHBondContact O-N 3.34Å; F222-L225 PolarHBondContact O-N 2.95Å; T223-L225 VanDerWaalsContact C-N 3.32Å; T223-L225 PolarHBondContact O-N 2.94Å
226K90.1Very high89Confident138 Ų13876.6 Ų76.660%0.640%0.401SS*.Hα-helixtrans-76.1-14.8175.4-70.9-178.8171.9-1760114.8F222 T223 I224 N228F222-K226 HydrophobicContact CD1-CD 4.44Å; F222-K226 HydrophobicContact CE1-CD 4.12Å; F222-K226 HydrophobicContact CZ-CD 4.46Å; F222-K226 PolarHBondContact O-N 2.75Å; T223-K226 WeakPolarHBondContact O-CB 3.42Å; T223-K226 PolarHBondContact O-N 3.05Å; I224-K226 PolarHBondContact O-N 3.29Å; K226-N228 PolarHBondContact O-N 3.22Å
227I89.8Confident88.3Confident49 Ų4980.8 Ų80.825%0.25142%0.419SS..  trans-69.8124177.9-62.5174000108.6T223 I224 K233 A236T223-I227 PolarHBondContact O-N 3.3Å; I224-I227 WeakPolarHBondContact O-CB 3.39Å; I224-I227 PolarHBondContact O-N 3.1Å; I224-I227 VanDerWaalsContact O-N 3.09Å; I227-K233 HydrophobicContact CB-CG 4.1Å; I227-K233 HydrophobicContact CG2-CG 4.26Å; I227-K233 WeakPolarHBondContact O-CE 3.3Å; I227-A236 HydrophobicContact CD1-CB 4.4Å
228N88.1Confident87.5Confident165 Ų16583.8 Ų83.888%0.88244%0.444SS*.  trans-77.9-23.5-178.5-68.8-30.7000113.6K226K226-N228 PolarHBondContact O-N 3.22Å
229S91.3Very high86.7Confident56 Ų5681.5 Ų81.539%0.39243%0.43SS..  trans-88.7126.6-178.31750000112.7S231 G232 K233S229-S231 VanDerWaalsContact C-N 3.29Å; S229-S231 PolarHBondContact O-N 3.34Å; S229-S231 PolarHBondContact OG-N 3.1Å; S229-S231 PolarHBondContact OG-OG 3.22Å; S229-G232 PolarHBondContact O-N 2.96Å; S229-G232 VanDerWaalsContact O-N 3.12Å; S229-G232 PolarHBondContact OG-N 2.72Å; S229-K233 PolarHBondContact O-N 3.1Å
230T85.6Confident86.1Confident115 Ų11576.3 Ų76.371%0.70641%0.407SS*.Hα-helixtrans-57.9-39.2174.3-47.50000112.3K233 Q234T230-K233 PolarHBondContact O-N 2.75Å; T230-Q234 PolarHBondContact O-N 3.4Å
231S84.6Confident85.6Confident83 Ų8379.4 Ų79.458%0.5843%0.427SS*.Hα-helixtrans-68.3-36.2177.2650000111.9S229 Q234 K235S229-S231 VanDerWaalsContact C-N 3.29Å; S229-S231 PolarHBondContact O-N 3.34Å; S229-S231 PolarHBondContact OG-N 3.1Å; S229-S231 PolarHBondContact OG-OG 3.22Å; S231-Q234 PolarHBondContact O-N 2.85Å; S231-K235 WeakPolarHBondContact O-CB 2.85Å; S231-K235 PolarHBondContact O-N 3.28Å
232G81.6Confident85.1Confident24 Ų2476.4 Ų76.425%0.24741%0.412CS..Hα-helixtrans-63.5-45173.200000112.3S229 K235 A236S229-G232 PolarHBondContact O-N 2.96Å; S229-G232 VanDerWaalsContact O-N 3.12Å; S229-G232 PolarHBondContact OG-N 2.72Å; G232-K235 PolarHBondContact O-N 3.05Å; G232-A236 PolarHBondContact O-N 3.27Å
233K85.5Confident84.8Confident72 Ų7270.9 Ų70.931%0.31339%0.388SS..Hα-helixtrans-59.4-50.1174.6-68.8-172.6-174.1-174.70111.6I224 I227 S229 T230 K235 A236 F237I224-K233 HydrophobicContact CG2-CB 4.27Å; I224-K233 HydrophobicContact CG2-CG 4.19Å; I227-K233 HydrophobicContact CB-CG 4.1Å; I227-K233 HydrophobicContact CG2-CG 4.26Å; I227-K233 WeakPolarHBondContact O-CE 3.3Å; S229-K233 PolarHBondContact O-N 3.1Å; T230-K233 PolarHBondContact O-N 2.75Å; K233-K235 VanDerWaalsContact C-N 3.32Å; K233-K235 PolarHBondContact O-N 3.43Å; K233-A236 PolarHBondContact O-N 2.9Å; K233-F237 WeakPolarHBondContact O-CD2 3.4Å; K233-F237 PolarHBondContact O-N 3.35Å
234Q83.3Confident84.6Confident143 Ų14372.2 Ų72.267%0.66839%0.393SS*.Hα-helixtrans-61.8-40.6-178.1-169.5175.81000111.9T230 S231 S238T230-Q234 PolarHBondContact O-N 3.4Å; S231-Q234 PolarHBondContact O-N 2.85Å; Q234-S238 VanDerWaalsContact O-CB 3.29Å; Q234-S238 WeakPolarHBondContact O-CB 3.28Å; Q234-S238 PolarHBondContact O-N 3.06Å
235K81.5Confident84.3Confident161 Ų16174.8 Ų74.870%0.741%0.407SS*.Hα-helixtrans-62.3-46175.4-173.6177.1-179.6-178.60111.8S231 G232 K233 S238 T239S231-K235 WeakPolarHBondContact O-CB 2.85Å; S231-K235 PolarHBondContact O-N 3.28Å; G232-K235 PolarHBondContact O-N 3.05Å; K233-K235 VanDerWaalsContact C-N 3.32Å; K233-K235 PolarHBondContact O-N 3.43Å; K235-S238 PolarHBondContact O-N 2.72Å; K235-T239 PolarHBondContact O-N 2.99Å; K235-T239 PolarHBondContact O-OG1 3.38Å
236A81.9Confident84Confident12 Ų1269.7 Ų69.710%0.09938%0.38CS..Hα-helixtrans-65-44.7179.300000112.1I224 I227 G232 K233 T239 C240I224-A236 HydrophobicContact CD1-CB 3.74Å; I224-A236 HydrophobicContact CG1-CB 3.68Å; I227-A236 HydrophobicContact CD1-CB 4.4Å; G232-A236 PolarHBondContact O-N 3.27Å; K233-A236 PolarHBondContact O-N 2.9Å; A236-T239 WeakPolarHBondContact O-CB 3.39Å; A236-T239 PolarHBondContact O-N 3.43Å; A236-C240 PolarHBondContact O-N 3.35Å; A236-C240 PolarHBondContact O-SG 2.96Å
237F81.6Confident83.8Confident97 Ų9763.6 Ų63.643%0.42535%0.354SS..Hα-helixtrans-60-48.4174.4-89.8-68000111.9L221 I224 K233 T239 C240 V241L221-F237 HydrophobicContact CD1-CE1 4.44Å; L221-F237 HydrophobicContact CD1-CZ 4.05Å; I224-F237 HydrophobicContact CG2-CD2 3.78Å; I224-F237 HydrophobicContact CG2-CE2 3.42Å; I224-F237 VanDerWaalsContact CG2-CE2 3.42Å; I224-F237 HydrophobicContact CG2-CZ 4.06Å; K233-F237 WeakPolarHBondContact O-CD2 3.4Å; K233-F237 PolarHBondContact O-N 3.35Å; F237-T239 PolarHBondContact O-N 2.67Å; F237-T239 VanDerWaalsContact O-N 3.09Å; F237-C240 PolarHBondContact O-N 3.24Å; F237-V241 WeakPolarHBondContact O-CG2 3.3Å; F237-V241 PolarHBondContact O-N 2.87Å; F237-V241 VanDerWaalsContact O-N 3.16Å
238S77.6Confident83.5Confident89 Ų8965.4 Ų65.462%0.62237%0.368SS*.Hα-helixtrans-57.5-28.3179.6-176.10000113.1Q234 K235Q234-S238 VanDerWaalsContact O-CB 3.29Å; Q234-S238 WeakPolarHBondContact O-CB 3.28Å; Q234-S238 PolarHBondContact O-N 3.06Å; K235-S238 PolarHBondContact O-N 2.72Å
239T77.1Confident83.1Confident48 Ų4859.6 Ų59.629%0.29434%0.336SS..Hα-helixtrans-77.1-26.1179.2-50.70000112.1K235 A236 F237K235-T239 PolarHBondContact O-N 2.99Å; K235-T239 PolarHBondContact O-OG1 3.38Å; A236-T239 WeakPolarHBondContact O-CB 3.39Å; A236-T239 PolarHBondContact O-N 3.43Å; F237-T239 PolarHBondContact O-N 2.67Å; F237-T239 VanDerWaalsContact O-N 3.09Å
240C82.5Confident82.5Confident4 Ų457.1 Ų57.13%0.02732%0.318CS..Hα-helixtrans-90.3-28.4-176.6-69.40000113.6I125 Y217 A236 F237 S242 H243 L244I125-C240 VanDerWaalsContact CD1-SG 3.51Å; Y217-C240 HydrophobicContact CE1-CB 3.84Å; A236-C240 PolarHBondContact O-N 3.35Å; A236-C240 PolarHBondContact O-SG 2.96Å; F237-C240 PolarHBondContact O-N 3.24Å; C240-S242 PolarHBondContact O-N 3.22Å; C240-H243 PolarHBondContact O-N 3.12Å; C240-L244 HydrophobicContact CB-CD1 4.36Å; C240-L244 PolarHBondContact O-N 2.62Å
241V82.8Confident82.2Confident69 Ų6952 Ų5242%0.41829%0.286SS..Hα-helixtrans-59.8-42.3-170.7165.20000112.7F237 L245F237-V241 WeakPolarHBondContact O-CG2 3.3Å; F237-V241 PolarHBondContact O-N 2.87Å; F237-V241 VanDerWaalsContact O-N 3.16Å; V241-L245 WeakPolarHBondContact O-CB 3.11Å; V241-L245 PolarHBondContact O-N 3.14Å
242S80.2Confident81.8Confident17 Ų1751 Ų5112%0.11928%0.279CS..Hα-helixtrans-62.7-46.3-179.750.20000111.7C240 L245 G246 I288C240-S242 PolarHBondContact O-N 3.22Å; S242-L245 PolarHBondContact O-N 2.7Å; S242-G246 PolarHBondContact O-N 3.49Å; S242-I288 WeakPolarHBondContact O-CG2 3.3Å
243H86.5Confident81.3Confident0 Ų051.3 Ų51.30%028%0.277CS..Hα-helixtrans-67.2-46178.4-175.4-104.9000112.1M59 L114 M117 Y217 C240 L245 G246 V247 Y289M59-H243 HydrophobicContact CE-CB 4.47Å; L114-H243 PolarHBondContact O-CE1 3.43Å; L114-H243 PolarHBondContact O-NE2 3.44Å; M117-H243 WeakPolarHBondContact CB-NE2 3.37Å; Y217-H243 AromaticContact CE2-ND1 3.59Å; Y217-H243 AromaticContact CZ-ND1 3.62Å; Y217-H243 WeakPolarHBondContact OH-CB 3.29Å; Y217-H243 PolarHBondContact OH-ND1 3.18Å; C240-H243 PolarHBondContact O-N 3.12Å; H243-L245 VanDerWaalsContact C-N 3.29Å; H243-L245 PolarHBondContact O-N 3.39Å; H243-G246 PolarHBondContact O-N 2.94Å; H243-V247 WeakPolarHBondContact O-CG2 3.4Å; H243-V247 PolarHBondContact O-N 3.48Å; H243-Y289 HydrophobicContact CB-CE1 4.34Å; H243-Y289 PolarHBondContact CD2-OH 3.13Å; H243-Y289 VanDerWaalsContact CD2-OH 3.26Å
244L86Confident80.6Confident65 Ų6548.9 Ų48.934%0.3427%0.267SS..Hα-helixtrans-60.8-37.7176.3-77.6174.4000112.6Y217 C240 T248Y217-L244 HydrophobicContact CD1-CD1 3.84Å; Y217-L244 HydrophobicContact CD1-CD2 3.75Å; Y217-L244 HydrophobicContact CD1-CG 3.93Å; Y217-L244 HydrophobicContact CD2-CD2 3.61Å; Y217-L244 HydrophobicContact CD2-CG 4.46Å; Y217-L244 HydrophobicContact CE1-CD1 3.69Å; Y217-L244 HydrophobicContact CE1-CD2 3.71Å; Y217-L244 HydrophobicContact CE1-CG 3.5Å; Y217-L244 VanDerWaalsContact CE1-CG 3.5Å; Y217-L244 HydrophobicContact CE2-CD2 3.55Å; Y217-L244 HydrophobicContact CE2-CG 4.08Å; Y217-L244 HydrophobicContact CG-CD2 3.7Å; Y217-L244 HydrophobicContact CG-CG 4.39Å; C240-L244 HydrophobicContact CB-CD1 4.36Å; C240-L244 PolarHBondContact O-N 2.62Å; L244-T248 VanDerWaalsContact O-CB 3.25Å; L244-T248 WeakPolarHBondContact O-CB 3.49Å; L244-T248 PolarHBondContact O-N 3.33Å; L244-T248 PolarHBondContact O-OG1 2.98Å
245L84.4Confident79.9Confident56 Ų5645.5 Ų45.529%0.29325%0.252SS..Hα-helixtrans-64.5-45.9175-177.263.5000111.1V241 S242 H243 T248 I249 I288V241-L245 WeakPolarHBondContact O-CB 3.11Å; V241-L245 PolarHBondContact O-N 3.14Å; S242-L245 PolarHBondContact O-N 2.7Å; H243-L245 VanDerWaalsContact C-N 3.29Å; H243-L245 PolarHBondContact O-N 3.39Å; L245-T248 PolarHBondContact O-N 2.7Å; L245-I249 HydrophobicContact CD1-CD1 3.9Å; L245-I249 HydrophobicContact CD1-CG1 4.43Å; L245-I249 HydrophobicContact CG-CD1 3.96Å; L245-I249 WeakPolarHBondContact O-CB 3.23Å; L245-I249 WeakPolarHBondContact O-CG1 3.29Å; L245-I249 PolarHBondContact O-N 2.95Å; L245-I288 HydrophobicContact CB-CG2 4.35Å; L245-I288 HydrophobicContact CD2-CG1 4.32Å; L245-I288 HydrophobicContact CD2-CG2 4.36Å; L245-I288 HydrophobicContact CG-CD1 4.49Å; L245-I288 HydrophobicContact CG-CG1 4.5Å; L245-I288 HydrophobicContact CG-CG2 4.45Å
246G81.6Confident79.2Confident0 Ų045 Ų450%025%0.25CS..Hα-helixtrans-57.9-52.5174.800000112.2S242 H243 T248 I249 F250S242-G246 PolarHBondContact O-N 3.49Å; H243-G246 PolarHBondContact O-N 2.94Å; G246-T248 VanDerWaalsContact C-N 3.35Å; G246-T248 PolarHBondContact O-N 3.3Å; G246-I249 PolarHBondContact O-N 2.99Å; G246-F250 WeakPolarHBondContact O-CB 3.47Å; G246-F250 PolarHBondContact O-N 2.74Å
247V85.4Confident78.1Confident10 Ų1045.8 Ų45.86%0.06125%0.254CS..Hα-helixtrans-56.1-47.9175.9168.10000111.3L114 I213 H243 I249 F250 Y251L114-V247 HydrophobicContact CB-CG2 4.44Å; L114-V247 HydrophobicContact CD2-CG2 4.42Å; I213-V247 HydrophobicContact CD1-CG1 4.16Å; I213-V247 HydrophobicContact CD1-CG2 4.23Å; I213-V247 HydrophobicContact CG2-CG1 4.08Å; H243-V247 WeakPolarHBondContact O-CG2 3.4Å; H243-V247 PolarHBondContact O-N 3.48Å; V247-I249 PolarHBondContact O-N 2.83Å; V247-F250 PolarHBondContact O-N 2.7Å; V247-Y251 HydrophobicContact CG1-CD2 3.71Å; V247-Y251 HydrophobicContact CG1-CE2 4.1Å; V247-Y251 WeakPolarHBondContact O-CD2 3.27Å; V247-Y251 PolarHBondContact O-N 3.41Å
248T83.6Confident77Confident88 Ų8845.5 Ų45.554%0.5425%0.251SS..Hα-helixtrans-61.9-46.7-177.4-59.30000110.7L244 L245 G246 S252L244-T248 VanDerWaalsContact O-CB 3.25Å; L244-T248 WeakPolarHBondContact O-CB 3.49Å; L244-T248 PolarHBondContact O-N 3.33Å; L244-T248 PolarHBondContact O-OG1 2.98Å; L245-T248 PolarHBondContact O-N 2.7Å; G246-T248 VanDerWaalsContact C-N 3.35Å; G246-T248 PolarHBondContact O-N 3.3Å; T248-S252 WeakPolarHBondContact O-CB 3.29Å; T248-S252 PolarHBondContact O-N 3.3Å; T248-S252 PolarHBondContact O-OG 2.85Å
249I79.8Confident76.1Confident43 Ų4347.1 Ų47.122%0.22125%0.252CS..Hα-helixtrans-62.3-46.6178.3-73.8168.9000110.6L245 G246 V247 S252 T253 L284 I288L245-I249 HydrophobicContact CD1-CD1 3.9Å; L245-I249 HydrophobicContact CD1-CG1 4.43Å; L245-I249 HydrophobicContact CG-CD1 3.96Å; L245-I249 WeakPolarHBondContact O-CB 3.23Å; L245-I249 WeakPolarHBondContact O-CG1 3.29Å; L245-I249 PolarHBondContact O-N 2.95Å; G246-I249 PolarHBondContact O-N 2.99Å; V247-I249 PolarHBondContact O-N 2.83Å; I249-S252 PolarHBondContact O-OG 3.47Å; I249-T253 WeakPolarHBondContact O-CB 3.22Å; I249-T253 PolarHBondContact O-N 3.48Å; I249-T253 PolarHBondContact O-OG1 3.1Å; I249-L284 HydrophobicContact CG2-CD1 3.61Å; I249-I288 HydrophobicContact CD1-CD1 3.56Å; I249-I288 HydrophobicContact CD1-CG1 4.49Å
250F79.7Confident74.9Confident3 Ų347 Ų471%0.01325%0.247CC..Hα-helixtrans-61.2-57.6-179.2-178.7-101.7000112.1E110 L114 G246 V247 T253 L254 I281E110-F250 HydrophobicContact CB-CE2 4.5Å; E110-F250 HydrophobicContact CB-CZ 4.16Å; E110-F250 HydrophobicContact CG-CD2 4.47Å; E110-F250 HydrophobicContact CG-CE1 4.47Å; E110-F250 HydrophobicContact CG-CE2 3.84Å; E110-F250 HydrophobicContact CG-CZ 3.81Å; E110-F250 WeakPolarHBondContact OE1-CD2 3.4Å; E110-F250 VanDerWaalsContact OE1-CE2 3.32Å; E110-F250 WeakPolarHBondContact OE1-CE2 3.3Å; E110-F250 WeakPolarHBondContact OE2-CE2 3.45Å; L114-F250 HydrophobicContact CD1-CB 4.3Å; L114-F250 HydrophobicContact CD1-CD1 3.57Å; L114-F250 HydrophobicContact CD1-CE1 3.98Å; L114-F250 HydrophobicContact CD1-CG 3.92Å; G246-F250 WeakPolarHBondContact O-CB 3.47Å; G246-F250 PolarHBondContact O-N 2.74Å; V247-F250 PolarHBondContact O-N 2.7Å; F250-T253 PolarHBondContact O-N 3.46Å; F250-L254 HydrophobicContact CD1-CD1 3.84Å; F250-L254 HydrophobicContact CE1-CD1 3.29Å; F250-L254 HydrophobicContact CE1-CG 4.41Å; F250-L254 HydrophobicContact CE2-CD1 4.23Å; F250-L254 HydrophobicContact CZ-CD1 3.53Å; F250-L254 HydrophobicContact CZ-CG 4.42Å; F250-L254 PolarHBondContact O-N 2.81Å; F250-I281 HydrophobicContact CD2-CD1 4.45Å; F250-I281 HydrophobicContact CD2-CG2 3.78Å; F250-I281 HydrophobicContact CE2-CG2 4.36Å
251Y78.8Confident73.2Confident8 Ų850.9 Ų50.93%0.03127%0.273CS..Hα-helixtrans-71.2-36.6-175.8-79.3-83.7000113.5C111 L114 L206 S209 L210 I213 V247 T253 L254 I255C111-Y251 PolarHBondContact O-OH 3.41Å; L114-Y251 HydrophobicContact CD1-CE2 4.17Å; L206-Y251 HydrophobicContact CD2-CD1 3.97Å; L206-Y251 HydrophobicContact CD2-CE1 3.67Å; S209-Y251 WeakPolarHBondContact CB-OH 3.28Å; S209-Y251 PolarHBondContact OG-OH 3.34Å; L210-Y251 HydrophobicContact CD1-CD1 3.83Å; L210-Y251 HydrophobicContact CD1-CE1 4.06Å; L210-Y251 HydrophobicContact CD2-CD1 3.44Å; L210-Y251 VanDerWaalsContact CD2-CD1 3.44Å; L210-Y251 HydrophobicContact CD2-CD2 3.82Å; L210-Y251 HydrophobicContact CD2-CE1 3.62Å; L210-Y251 HydrophobicContact CD2-CE2 4Å; L210-Y251 HydrophobicContact CD2-CG 3.54Å; L210-Y251 HydrophobicContact CG-CD1 3.61Å; L210-Y251 HydrophobicContact CG-CE1 3.48Å; L210-Y251 VanDerWaalsContact CG-CE1 3.48Å; L210-Y251 HydrophobicContact CG-CG 4.26Å; I213-Y251 HydrophobicContact CD1-CE2 3.75Å; V247-Y251 HydrophobicContact CG1-CD2 3.71Å; V247-Y251 HydrophobicContact CG1-CE2 4.1Å; V247-Y251 WeakPolarHBondContact O-CD2 3.27Å; V247-Y251 PolarHBondContact O-N 3.41Å; Y251-T253 PolarHBondContact O-N 2.99Å; Y251-L254 PolarHBondContact O-N 2.83Å; Y251-I255 VanDerWaalsContact O-CB 3.29Å; Y251-I255 WeakPolarHBondContact O-CB 3.28Å; Y251-I255 WeakPolarHBondContact O-CD1 3.3Å; Y251-I255 VanDerWaalsContact O-CG1 3.23Å; Y251-I255 WeakPolarHBondContact O-CG1 3.23Å; Y251-I255 PolarHBondContact O-N 2.95Å
252S76.4Confident71.5Confident62 Ų6256 Ų5643%0.43429%0.285SS..Hα-helixtrans-61.6-37.4175.860.40000111.5T248 I249 F256T248-S252 WeakPolarHBondContact O-CB 3.29Å; T248-S252 PolarHBondContact O-N 3.3Å; T248-S252 PolarHBondContact O-OG 2.85Å; I249-S252 PolarHBondContact O-OG 3.47Å; S252-F256 VanDerWaalsContact O-CB 3.28Å; S252-F256 WeakPolarHBondContact O-CB 3.28Å; S252-F256 PolarHBondContact O-N 3.21Å
253T70.3Confident69.7Low31 Ų3165.2 Ų65.219%0.1932%0.322CS..Hα-helixtrans-71.1-43.2177.5-48.50000111.6I249 F250 Y251 F256 T257 I281I249-T253 WeakPolarHBondContact O-CB 3.22Å; I249-T253 PolarHBondContact O-N 3.48Å; I249-T253 PolarHBondContact O-OG1 3.1Å; F250-T253 PolarHBondContact O-N 3.46Å; Y251-T253 PolarHBondContact O-N 2.99Å; T253-F256 PolarHBondContact O-N 3.23Å; T253-T257 VanDerWaalsContact O-CB 3.29Å; T253-T257 WeakPolarHBondContact O-CB 3.42Å; T253-T257 PolarHBondContact O-N 2.96Å; T253-T257 PolarHBondContact O-OG1 3.44Å; T253-I281 HydrophobicContact CG2-CD1 3.77Å; T253-I281 HydrophobicContact CG2-CG1 4.24Å
254L70.8Confident67.8Low20 Ų2067.9 Ų67.911%0.10534%0.341CS..Hα-helixtrans-60.1-45.9173.8-76.2176.3000112.1L206 F250 Y251 T257 Y258L206-L254 HydrophobicContact CD2-CD1 4.11Å; F250-L254 HydrophobicContact CD1-CD1 3.84Å; F250-L254 HydrophobicContact CE1-CD1 3.29Å; F250-L254 HydrophobicContact CE1-CG 4.41Å; F250-L254 HydrophobicContact CE2-CD1 4.23Å; F250-L254 HydrophobicContact CZ-CD1 3.53Å; F250-L254 HydrophobicContact CZ-CG 4.42Å; F250-L254 PolarHBondContact O-N 2.81Å; Y251-L254 PolarHBondContact O-N 2.83Å; L254-T257 PolarHBondContact O-N 2.77Å; L254-Y258 HydrophobicContact CD2-CD2 4.09Å; L254-Y258 HydrophobicContact CD2-CE2 3.82Å; L254-Y258 WeakPolarHBondContact O-CD2 3.49Å; L254-Y258 PolarHBondContact O-N 3.09Å
255I70.2Confident66Low72 Ų7270.3 Ų70.337%0.36935%0.346SS..Hα-helixtrans-61.8-48178.4-74.8167.3000110.7Y251 T257 Y258 L259Y251-I255 VanDerWaalsContact O-CB 3.29Å; Y251-I255 WeakPolarHBondContact O-CB 3.28Å; Y251-I255 WeakPolarHBondContact O-CD1 3.3Å; Y251-I255 VanDerWaalsContact O-CG1 3.23Å; Y251-I255 WeakPolarHBondContact O-CG1 3.23Å; Y251-I255 PolarHBondContact O-N 2.95Å; I255-T257 PolarHBondContact O-N 3.22Å; I255-Y258 PolarHBondContact O-N 3.47Å; I255-L259 HydrophobicContact CB-CD1 4.36Å; I255-L259 HydrophobicContact CG1-CD1 4.34Å; I255-L259 HydrophobicContact CG2-CD1 3.64Å; I255-L259 HydrophobicContact CG2-CG 4.31Å; I255-L259 VanDerWaalsContact O-CB 3.3Å; I255-L259 WeakPolarHBondContact O-CB 3.5Å; I255-L259 PolarHBondContact O-N 3.24Å
256F65.7Low64.3Low150 Ų15069.7 Ų69.766%0.65835%0.347SS*.Hα-helixtrans-61.1-34.2178.8-174-98.1000112.4S252 T253S252-F256 VanDerWaalsContact O-CB 3.28Å; S252-F256 WeakPolarHBondContact O-CB 3.28Å; S252-F256 PolarHBondContact O-N 3.21Å; T253-F256 PolarHBondContact O-N 3.23Å
257T59.8Low62.7Low29 Ų2975.7 Ų75.718%0.17838%0.378CS..Hα-helixtrans-74.2-51.2179.7-60.80000112.2T253 L254 I255 Y277T253-T257 VanDerWaalsContact O-CB 3.29Å; T253-T257 WeakPolarHBondContact O-CB 3.42Å; T253-T257 PolarHBondContact O-N 2.96Å; T253-T257 PolarHBondContact O-OG1 3.44Å; L254-T257 PolarHBondContact O-N 2.77Å; I255-T257 PolarHBondContact O-N 3.22Å; T257-Y277 HydrophobicContact CG2-CD1 3.37Å; T257-Y277 HydrophobicContact CG2-CE1 3.1Å; T257-Y277 HydrophobicContact CG2-CG 4.33Å; T257-Y277 VanDerWaalsContact OG1-CD1 3.24Å; T257-Y277 WeakPolarHBondContact OG1-CD1 3.42Å
258Y58.1Low61.1Low91 Ų9176.5 Ų76.536%0.35739%0.389SS..Hα-helixtrans-99.7-18.4-166.3-69.4-74.7000114.6L254 I255 K260L254-Y258 HydrophobicContact CD2-CD2 4.09Å; L254-Y258 HydrophobicContact CD2-CE2 3.82Å; L254-Y258 WeakPolarHBondContact O-CD2 3.49Å; L254-Y258 PolarHBondContact O-N 3.09Å; I255-Y258 PolarHBondContact O-N 3.47Å; Y258-K260 VanDerWaalsContact C-N 3.32Å
259L57.4Low59.6Low123 Ų12379.6 Ų79.664%0.64439%0.391SS*.SBendtrans-89.47.5174.6-63.4-177.7000113.6I255I255-L259 HydrophobicContact CB-CD1 4.36Å; I255-L259 HydrophobicContact CG1-CD1 4.34Å; I255-L259 HydrophobicContact CG2-CD1 3.64Å; I255-L259 HydrophobicContact CG2-CG 4.31Å; I255-L259 VanDerWaalsContact O-CB 3.3Å; I255-L259 WeakPolarHBondContact O-CB 3.5Å; I255-L259 PolarHBondContact O-N 3.24Å
260K53.1Low58.5Low46 Ų4678.5 Ų78.520%0.239%0.386CS..SBendtrans-71.8125.2175.3-167.6179.8172-159.50109.9Y258 R262 S264 D270Y258-K260 VanDerWaalsContact C-N 3.32Å; K260-R262 PolarHBondContact O-N 3.09Å; K260-S264 WeakPolarHBondContact CE-O 3.33Å; K260-S264 PolarHBondContact NZ-O 3.12Å; K260-D270 IonicContact NZ-OD1 2.62Å; K260-D270 PolarHBondContact NZ-OD1 3.26Å; K260-D270 IonicContact NZ-OD2 3.46Å; K260-D270 PolarHBondContact NZ-OD2 2.98Å
261P46.1Very low57.6Low86 Ų8679.3 Ų79.356%0.55839%0.389SS*.  trans-58.9137179.2-22.231.3000111.8K263 S264P261-K263 PolarHBondContact O-N 3.27Å; P261-S264 WeakPolarHBondContact O-CB 3.47Å; P261-S264 PolarHBondContact O-N 2.61Å
262R47.3Very low56.7Low177 Ų17783 Ų8367%0.66841%0.412SS*.G310 helixtrans-51.7-31.1178.1-70.3-171-178.71739.6113.9E195 K260 S264 Y265E195-R262 IonicContact OE1-CZ 2.7Å; E195-R262 IonicContact OE1-NH1 3.39Å; E195-R262 PolarHBondContact OE1-NH1 3.34Å; E195-R262 VanDerWaalsContact OE1-NH1 3.12Å; E195-R262 IonicContact OE1-NH2 3.16Å; E195-R262 PolarHBondContact OE1-NH2 2.99Å; E195-R262 IonicContact OE2-CZ 3.61Å; E195-R262 IonicContact OE2-NH1 2.74Å; E195-R262 PolarHBondContact OE2-NH1 3.19Å; E195-R262 IonicContact OE2-NH2 3.12Å; E195-R262 PolarHBondContact OE2-NH2 3.48Å; K260-R262 PolarHBondContact O-N 3.09Å; R262-S264 PolarHBondContact O-N 3.29Å; R262-Y265 WeakPolarHBondContact O-CB 3.38Å; R262-Y265 PolarHBondContact O-N 2.95Å
263K42.1Very low55.8Low209 Ų20981 Ų8191%0.90940%0.399SS*.G310 helixtrans-70.2-11.3177.7-65.2-170.9178.9-176.50114.2P261P261-K263 PolarHBondContact O-N 3.27Å
264S46.7Very low55.4Low56 Ų5679.5 Ų79.539%0.39239%0.391SS..G310 helixtrans-102.69.6177.3-54.40000112.7K260 P261 R262 S266K260-S264 WeakPolarHBondContact CE-O 3.33Å; K260-S264 PolarHBondContact NZ-O 3.12Å; P261-S264 WeakPolarHBondContact O-CB 3.47Å; P261-S264 PolarHBondContact O-N 2.61Å; R262-S264 PolarHBondContact O-N 3.29Å; S264-S266 PolarHBondContact O-N 3.07Å
265Y49.1Very low55Low116 Ų11679.6 Ų79.646%0.45539%0.392SS..  trans-67.9120.7177-149.2-95.1000109.2R262 D270R262-Y265 WeakPolarHBondContact O-CB 3.38Å; R262-Y265 PolarHBondContact O-N 2.95Å; Y265-D270 WeakPolarHBondContact CA-OD2 3.3Å; Y265-D270 WeakPolarHBondContact CD2-OD2 3.36Å; Y265-D270 HydrophobicContact CE2-CB 4.11Å
266S49.3Very low54.6Low44 Ų4481.6 Ų81.631%0.30840%0.398SS..  trans-133.6118.3-178.762.80000108.3S264 G268 R269 D270S264-S266 PolarHBondContact O-N 3.07Å; S266-G268 PolarHBondContact O-N 3.08Å; S266-R269 PolarHBondContact O-N 2.91Å; S266-R269 VanDerWaalsContact O-N 3.17Å; S266-R269 WeakPolarHBondContact OG-CB 3.3Å; S266-D270 PolarHBondContact N-OD2 3.16Å
267L47.3Very low54.5Low125 Ų12574.7 Ų74.765%0.65437%0.368SS*.THydrogen-bonded Turntrans-47.3129177.8-126.581.1000110H174H174-L267 HydrophobicContact CB-CD1 4.13Å
268G52.2Low54.6Low28 Ų2873.3 Ų73.329%0.28936%0.359SS..THydrogen-bonded Turntrans96.1-48.3-177.200000115.1S266 D270 Q271 V272S266-G268 PolarHBondContact O-N 3.08Å; G268-D270 PolarHBondContact O-N 3.14Å; G268-Q271 PolarHBondContact O-N 3.02Å; G268-V272 WeakPolarHBondContact O-CG2 3.22Å; G268-V272 PolarHBondContact O-N 3.47Å
269R51.1Low54.9Low152 Ų15269 Ų6957%0.57434%0.343SS*.Hα-helixtrans-69.5-36.5-179.2-159.4173.7104.3-160.88.2112.6S266 V272 A273S266-R269 PolarHBondContact O-N 2.91Å; S266-R269 VanDerWaalsContact O-N 3.17Å; S266-R269 WeakPolarHBondContact OG-CB 3.3Å; R269-V272 PolarHBondContact O-N 3.32Å; R269-A273 PolarHBondContact O-N 2.95Å
270D56.8Low55.1Low21 Ų2165.1 Ų65.111%0.11232%0.324CS..Hα-helixtrans-76-29.4179.1-62-45.7000112K260 Y265 S266 G268 A273 S274K260-D270 IonicContact NZ-OD1 2.62Å; K260-D270 PolarHBondContact NZ-OD1 3.26Å; K260-D270 IonicContact NZ-OD2 3.46Å; K260-D270 PolarHBondContact NZ-OD2 2.98Å; Y265-D270 WeakPolarHBondContact CA-OD2 3.3Å; Y265-D270 WeakPolarHBondContact CD2-OD2 3.36Å; Y265-D270 HydrophobicContact CE2-CB 4.11Å; S266-D270 PolarHBondContact N-OD2 3.16Å; G268-D270 PolarHBondContact O-N 3.14Å; D270-A273 PolarHBondContact O-N 3.31Å; D270-S274 WeakPolarHBondContact O-CB 3.36Å; D270-S274 PolarHBondContact O-N 3.38Å; D270-S274 PolarHBondContact O-OG 3.12Å
271Q61Low55.7Low20 Ų2063.2 Ų63.29%0.09332%0.316CS..Hα-helixtrans-68.4-38.9170.8-68.5179-22.100111.9L17 H174 G268 S274 V275L17-Q271 HydrophobicContact CD2-CB 3.78Å; H174-Q271 PolarHBondContact O-NE2 2.96Å; G268-Q271 PolarHBondContact O-N 3.02Å; Q271-S274 WeakPolarHBondContact CA-OG 3.38Å; Q271-S274 PolarHBondContact O-N 3.14Å; Q271-S274 PolarHBondContact O-OG 3.18Å; Q271-V275 WeakPolarHBondContact O-CG2 3.27Å; Q271-V275 PolarHBondContact O-N 3.1Å; Q271-V275 VanDerWaalsContact O-N 3.14Å
272V60.4Low56.4Low85 Ų8559.2 Ų59.252%0.51529%0.289SS..Hα-helixtrans-66.2-43.8173172.20000110.6G268 R269 S274 V275 F276G268-V272 WeakPolarHBondContact O-CG2 3.22Å; G268-V272 PolarHBondContact O-N 3.47Å; R269-V272 PolarHBondContact O-N 3.32Å; V272-S274 PolarHBondContact O-N 3.44Å; V272-V275 WeakPolarHBondContact O-CB 3.35Å; V272-V275 PolarHBondContact O-N 3.34Å; V272-F276 HydrophobicContact CG1-CD2 4.41Å; V272-F276 HydrophobicContact CG1-CE2 3.97Å; V272-F276 VanDerWaalsContact O-CD2 3.24Å; V272-F276 WeakPolarHBondContact O-CD2 3.24Å; V272-F276 PolarHBondContact O-N 3.17Å
273A57.3Low57.1Low19 Ų1951.9 Ų51.916%0.15726%0.264CS..Hα-helixtrans-59.2-35.7174.500000111.9R269 D270 F276 Y277R269-A273 PolarHBondContact O-N 2.95Å; D270-A273 PolarHBondContact O-N 3.31Å; A273-F276 WeakPolarHBondContact O-CB 3.45Å; A273-F276 PolarHBondContact O-N 3.39Å; A273-F276 VanDerWaalsContact O-N 3.14Å; A273-Y277 WeakPolarHBondContact O-CD1 3.37Å; A273-Y277 PolarHBondContact O-N 3.45Å
274S61.3Low58Low1 Ų144.4 Ų44.41%0.00723%0.234CC..Hα-helixtrans-74.5-25.3178.963.80000116.1H175 F176 D270 Q271 V272 F276 Y277 T278H175-S274 PolarHBondContact CE1-OG 3.49Å; H175-S274 PolarHBondContact NE2-OG 3.1Å; F176-S274 WeakPolarHBondContact CE1-OG 3.12Å; D270-S274 WeakPolarHBondContact O-CB 3.36Å; D270-S274 PolarHBondContact O-N 3.38Å; D270-S274 PolarHBondContact O-OG 3.12Å; Q271-S274 WeakPolarHBondContact CA-OG 3.38Å; Q271-S274 PolarHBondContact O-N 3.14Å; Q271-S274 PolarHBondContact O-OG 3.18Å; V272-S274 PolarHBondContact O-N 3.44Å; S274-F276 VanDerWaalsContact C-N 3.3Å; S274-F276 PolarHBondContact O-N 3.19Å; S274-Y277 VanDerWaalsContact CA-CD1 3.49Å; S274-Y277 WeakPolarHBondContact CB-OH 3.16Å; S274-T278 WeakPolarHBondContact O-CB 3.2Å; S274-T278 WeakPolarHBondContact O-CG2 3.24Å; S274-T278 PolarHBondContact O-N 3.13Å; S274-T278 PolarHBondContact O-OG1 3.48Å
275V63.3Low59Low22 Ų2241.9 Ų41.913%0.13322%0.216CC..Hα-helixtrans-60.2-41.2164171.70000111.1L17 F31 F176 Q271 V272 I279 V280L17-V275 HydrophobicContact CD1-CG2 3.9Å; L17-V275 HydrophobicContact CD2-CG2 4.11Å; F31-V275 HydrophobicContact CE1-CG1 3.59Å; F31-V275 HydrophobicContact CE1-CG2 4.32Å; F31-V275 HydrophobicContact CZ-CB 4.46Å; F31-V275 HydrophobicContact CZ-CG1 3.85Å; F31-V275 HydrophobicContact CZ-CG2 3.69Å; F176-V275 HydrophobicContact CE1-CG2 3.83Å; F176-V275 HydrophobicContact CZ-CG2 3.88Å; Q271-V275 WeakPolarHBondContact O-CG2 3.27Å; Q271-V275 PolarHBondContact O-N 3.1Å; Q271-V275 VanDerWaalsContact O-N 3.14Å; V272-V275 WeakPolarHBondContact O-CB 3.35Å; V272-V275 PolarHBondContact O-N 3.34Å; V275-I279 HydrophobicContact CG1-CB 4.4Å; V275-I279 HydrophobicContact CG1-CD1 4.25Å; V275-I279 WeakPolarHBondContact O-CA 3.32Å; V275-I279 VanDerWaalsContact O-CB 3.27Å; V275-I279 WeakPolarHBondContact O-CB 3.36Å; V275-I279 PolarHBondContact O-N 2.93Å; V275-V280 PolarHBondContact O-N 3.44Å
276F61.8Low59.5Low114 Ų11436.7 Ų36.750%0.520%0.197SC..Iπ-helixtrans-64.3-46.6-179-77.5-83.4000112.7V272 A273 S274 V280 I281V272-F276 HydrophobicContact CG1-CD2 4.41Å; V272-F276 HydrophobicContact CG1-CE2 3.97Å; V272-F276 VanDerWaalsContact O-CD2 3.24Å; V272-F276 WeakPolarHBondContact O-CD2 3.24Å; V272-F276 PolarHBondContact O-N 3.17Å; A273-F276 WeakPolarHBondContact O-CB 3.45Å; A273-F276 PolarHBondContact O-N 3.39Å; A273-F276 VanDerWaalsContact O-N 3.14Å; S274-F276 VanDerWaalsContact C-N 3.3Å; S274-F276 PolarHBondContact O-N 3.19Å; F276-V280 HydrophobicContact CD1-CB 4.19Å; F276-V280 HydrophobicContact CD1-CG1 4.36Å; F276-V280 HydrophobicContact CD1-CG2 3.91Å; F276-V280 HydrophobicContact CE1-CG2 4.44Å; F276-V280 HydrophobicContact CG-CG2 4.46Å; F276-V280 WeakPolarHBondContact O-CA 3.45Å; F276-V280 VanDerWaalsContact O-CB 3.24Å; F276-V280 WeakPolarHBondContact O-CB 3.48Å; F276-V280 PolarHBondContact O-N 3.07Å; F276-V280 VanDerWaalsContact O-N 3.12Å; F276-I281 PolarHBondContact O-N 3.34Å; F276-I281 VanDerWaalsContact O-N 3.1Å
277Y63.3Low60.1Low5 Ų537.9 Ų37.92%0.0220%0.199CC..Iπ-helixtrans-79.5-30.3-178.870.2-103.9000114.4F103 F177 T257 A273 S274F103-Y277 HydrophobicContact CE1-CE2 4.37Å; F103-Y277 HydrophobicContact CE2-CE2 4.35Å; F103-Y277 AromaticContact CZ-CD2 3.92Å; F103-Y277 HydrophobicContact CZ-CD2 3.92Å; F103-Y277 AromaticContact CZ-CE2 3.56Å; F103-Y277 HydrophobicContact CZ-CE2 3.56Å; F177-Y277 HydrophobicContact CE1-CE2 4.39Å; F177-Y277 AromaticContact CZ-CE2 3.99Å; F177-Y277 HydrophobicContact CZ-CE2 3.99Å; F177-Y277 WeakPolarHBondContact CZ-OH 3.29Å; T257-Y277 HydrophobicContact CG2-CD1 3.37Å; T257-Y277 HydrophobicContact CG2-CE1 3.1Å; T257-Y277 HydrophobicContact CG2-CG 4.33Å; T257-Y277 VanDerWaalsContact OG1-CD1 3.24Å; T257-Y277 WeakPolarHBondContact OG1-CD1 3.42Å; A273-Y277 WeakPolarHBondContact O-CD1 3.37Å; A273-Y277 PolarHBondContact O-N 3.45Å; S274-Y277 VanDerWaalsContact CA-CD1 3.49Å; S274-Y277 WeakPolarHBondContact CB-OH 3.16Å
278T62.3Low61.1Low0 Ų032.4 Ų32.40%017%0.171CC..Iπ-helixtrans-85.7-30.9-179.459.20000114.1V77 F103 F177 S274V77-T278 HydrophobicContact CG1-CG2 4.45Å; F103-T278 HydrophobicContact CE2-CG2 3.65Å; F103-T278 HydrophobicContact CZ-CG2 3.99Å; F177-T278 HydrophobicContact CD1-CG2 4.24Å; F177-T278 HydrophobicContact CE1-CG2 3.39Å; F177-T278 HydrophobicContact CE2-CG2 4.47Å; F177-T278 HydrophobicContact CZ-CG2 3.57Å; S274-T278 WeakPolarHBondContact O-CB 3.2Å; S274-T278 WeakPolarHBondContact O-CG2 3.24Å; S274-T278 PolarHBondContact O-N 3.13Å; S274-T278 PolarHBondContact O-OG1 3.48Å
279I64Low61.7Low1 Ų131.3 Ų31.31%0.00516%0.158CC..Iπ-helixtrans-116.3-37.3-169.9-65.3167.3000111.3F31 I34 F176 V275 V283F31-I279 HydrophobicContact CD1-CD1 3.99Å; F31-I279 HydrophobicContact CD1-CG2 4.22Å; F31-I279 HydrophobicContact CD2-CD1 4.14Å; F31-I279 HydrophobicContact CE1-CD1 3.91Å; F31-I279 HydrophobicContact CE2-CD1 4.03Å; F31-I279 HydrophobicContact CG-CD1 4.12Å; F31-I279 HydrophobicContact CZ-CD1 3.92Å; I34-I279 HydrophobicContact CB-CG2 4.14Å; I34-I279 HydrophobicContact CD1-CG2 3.97Å; I34-I279 HydrophobicContact CG2-CG2 3.4Å; F176-I279 HydrophobicContact CE2-CD1 4.34Å; V275-I279 HydrophobicContact CG1-CB 4.4Å; V275-I279 HydrophobicContact CG1-CD1 4.25Å; V275-I279 WeakPolarHBondContact O-CA 3.32Å; V275-I279 VanDerWaalsContact O-CB 3.27Å; V275-I279 WeakPolarHBondContact O-CB 3.36Å; V275-I279 PolarHBondContact O-N 2.93Å; I279-V283 WeakPolarHBondContact O-CG2 3.32Å
280V61.8Low62.3Low41 Ų4125.3 Ų25.325%0.24814%0.139CC..Iπ-helixtrans-85.9-37.7-175.7-176.80000112.6V275 F276 V283 L284V275-V280 PolarHBondContact O-N 3.44Å; F276-V280 HydrophobicContact CD1-CB 4.19Å; F276-V280 HydrophobicContact CD1-CG1 4.36Å; F276-V280 HydrophobicContact CD1-CG2 3.91Å; F276-V280 HydrophobicContact CE1-CG2 4.44Å; F276-V280 HydrophobicContact CG-CG2 4.46Å; F276-V280 WeakPolarHBondContact O-CA 3.45Å; F276-V280 VanDerWaalsContact O-CB 3.24Å; F276-V280 WeakPolarHBondContact O-CB 3.48Å; F276-V280 PolarHBondContact O-N 3.07Å; F276-V280 VanDerWaalsContact O-N 3.12Å; V280-V283 WeakPolarHBondContact O-CB 3.42Å; V280-V283 PolarHBondContact O-N 3.15Å; V280-L284 HydrophobicContact CG1-CD1 4.01Å; V280-L284 HydrophobicContact CG1-CG 4.29Å; V280-L284 WeakPolarHBondContact O-CG 3.36Å; V280-L284 PolarHBondContact O-N 2.98Å
281I64.4Low62.4Low6 Ų629.1 Ų29.13%0.03116%0.159CC..Hα-helixtrans-57.6-50179.3-68.7176.4000112.7F250 T253 F276 V283 L284 N285F250-I281 HydrophobicContact CD2-CD1 4.45Å; F250-I281 HydrophobicContact CD2-CG2 3.78Å; F250-I281 HydrophobicContact CE2-CG2 4.36Å; T253-I281 HydrophobicContact CG2-CD1 3.77Å; T253-I281 HydrophobicContact CG2-CG1 4.24Å; F276-I281 PolarHBondContact O-N 3.34Å; F276-I281 VanDerWaalsContact O-N 3.1Å; I281-V283 PolarHBondContact O-N 3.45Å; I281-V283 VanDerWaalsContact O-N 3.1Å; I281-L284 PolarHBondContact O-N 3.25Å; I281-N285 PolarHBondContact O-N 2.94Å
282P60.7Low62.6Low1 Ų136.2 Ų36.21%0.00619%0.185CC..Hα-helixtrans-62.1-22.8-178.8-26.137.4000114T38 D70 Y73 S74 P286T38-P282 HydrophobicContact CG2-CB 3.82Å; D70-P282 HydrophobicContact CB-CB 4.35Å; Y73-P282 HydrophobicContact CD1-CG 3.84Å; S74-P282 WeakPolarHBondContact OG-CB 3.49Å; P282-P286 WeakPolarHBondContact O-CD 3.29Å
283V61.7Low63Low23 Ų2333.3 Ų33.314%0.13917%0.166CC..Hα-helixtrans-73.4-38.1174.1-179.40000111.2I34 I37 T38 I279 V280 I281 P286 L287I34-V283 HydrophobicContact CG2-CG2 3.35Å; I37-V283 HydrophobicContact CG2-CG1 4.34Å; T38-V283 WeakPolarHBondContact OG1-CG2 3.42Å; I279-V283 WeakPolarHBondContact O-CG2 3.32Å; V280-V283 WeakPolarHBondContact O-CB 3.42Å; V280-V283 PolarHBondContact O-N 3.15Å; I281-V283 PolarHBondContact O-N 3.45Å; I281-V283 VanDerWaalsContact O-N 3.1Å; V283-P286 WeakPolarHBondContact O-CD 3.37Å; V283-L287 HydrophobicContact CG1-CD1 3.93Å; V283-L287 WeakPolarHBondContact O-CG 3.26Å
284L63Low63.9Low52 Ų5239.7 Ų39.727%0.27219%0.191SC..Hα-helixtrans-73.4-33.7-173.1-67.7174.8000111.6I249 V280 I281 L287 I288I249-L284 HydrophobicContact CG2-CD1 3.61Å; V280-L284 HydrophobicContact CG1-CD1 4.01Å; V280-L284 HydrophobicContact CG1-CG 4.29Å; V280-L284 WeakPolarHBondContact O-CG 3.36Å; V280-L284 PolarHBondContact O-N 2.98Å; I281-L284 PolarHBondContact O-N 3.25Å; L284-L287 PolarHBondContact O-N 3.38Å; L284-I288 HydrophobicContact CB-CD1 4.01Å; L284-I288 WeakPolarHBondContact O-CB 3.48Å; L284-I288 WeakPolarHBondContact O-CD1 3.38Å; L284-I288 WeakPolarHBondContact O-CG1 3.41Å; L284-I288 PolarHBondContact O-N 3.4Å
285N67.4Low64.5Low4 Ų444.5 Ų44.52%0.02121%0.213CC..Hα-helixtrans-55.2-55.4179.6-79.1-12.1000112.5D70 E110 I281 L287 I288 Y289D70-N285 PolarHBondContact OD1-ND2 2.86Å; D70-N285 WeakPolarHBondContact OD2-CB 3.43Å; D70-N285 PolarHBondContact OD2-ND2 2.98Å; E110-N285 PolarHBondContact OE1-ND2 3.36Å; I281-N285 PolarHBondContact O-N 2.94Å; N285-L287 VanDerWaalsContact C-N 3.34Å; N285-L287 PolarHBondContact O-N 2.83Å; N285-I288 PolarHBondContact O-N 3.32Å; N285-Y289 HydrophobicContact CB-CD2 4.5Å; N285-Y289 WeakPolarHBondContact O-CD2 3.38Å; N285-Y289 PolarHBondContact O-N 3.44Å
286P59.4Low65.1Low7 Ų743.6 Ų43.65%0.04521%0.207CC..Hα-helixtrans-55.8-43.6173.2-26.331.9000113.6N42 P282 V283 I288 Y289 S290N42-P286 VanDerWaalsContact CG-CG 3.48Å; N42-P286 VanDerWaalsContact ND2-CG 3.25Å; N42-P286 WeakPolarHBondContact ND2-CG 3.22Å; N42-P286 WeakPolarHBondContact OD1-CG 3.36Å; P282-P286 WeakPolarHBondContact O-CD 3.29Å; V283-P286 WeakPolarHBondContact O-CD 3.37Å; P286-I288 PolarHBondContact O-N 2.87Å; P286-Y289 PolarHBondContact O-N 3.41Å; P286-S290 WeakPolarHBondContact O-CA 3.31Å; P286-S290 WeakPolarHBondContact O-CB 3.48Å; P286-S290 PolarHBondContact O-N 3Å; P286-S290 PolarHBondContact O-OG 3.38Å
287L61.2Low66Low69 Ų6943.2 Ų43.236%0.36121%0.206SC..Iπ-helixtrans-67.4-39.8-176.3-62172.8000111.3V283 L284 N285 L291V283-L287 HydrophobicContact CG1-CD1 3.93Å; V283-L287 WeakPolarHBondContact O-CG 3.26Å; L284-L287 PolarHBondContact O-N 3.38Å; N285-L287 VanDerWaalsContact C-N 3.34Å; N285-L287 PolarHBondContact O-N 2.83Å; L287-L291 HydrophobicContact CB-CD1 4.3Å; L287-L291 HydrophobicContact CD2-CD1 3.35Å; L287-L291 HydrophobicContact CD2-CG 4.17Å; L287-L291 HydrophobicContact CG-CD1 4.4Å; L287-L291 WeakPolarHBondContact O-CB 3.38Å; L287-L291 PolarHBondContact O-N 2.77Å; L287-L291 VanDerWaalsContact O-N 3.14Å
288I67.9Low66.9Low10 Ų1045.9 Ų45.95%0.05122%0.22CC..Iπ-helixtrans-68.2-45.1178.3-67.6164000110.5S242 L245 I249 L284 N285 P286S242-I288 WeakPolarHBondContact O-CG2 3.3Å; L245-I288 HydrophobicContact CB-CG2 4.35Å; L245-I288 HydrophobicContact CD2-CG1 4.32Å; L245-I288 HydrophobicContact CD2-CG2 4.36Å; L245-I288 HydrophobicContact CG-CD1 4.49Å; L245-I288 HydrophobicContact CG-CG1 4.5Å; L245-I288 HydrophobicContact CG-CG2 4.45Å; I249-I288 HydrophobicContact CD1-CD1 3.56Å; I249-I288 HydrophobicContact CD1-CG1 4.49Å; L284-I288 HydrophobicContact CB-CD1 4.01Å; L284-I288 WeakPolarHBondContact O-CB 3.48Å; L284-I288 WeakPolarHBondContact O-CD1 3.38Å; L284-I288 WeakPolarHBondContact O-CG1 3.41Å; L284-I288 PolarHBondContact O-N 3.4Å; N285-I288 PolarHBondContact O-N 3.32Å; P286-I288 PolarHBondContact O-N 2.87Å
289Y65.5Low67.8Low4 Ų445.9 Ų45.92%0.01622%0.22CC..Iπ-helixtrans-86.4-21.8-174.8-68.2-67.1000114.8M59 L63 L66 M117 H243 N285 P286 N293M59-Y289 HydrophobicContact CE-CE1 4.28Å; L63-Y289 HydrophobicContact CD1-CD1 3.96Å; L63-Y289 HydrophobicContact CD1-CD2 3.67Å; L63-Y289 HydrophobicContact CD1-CE1 4.49Å; L63-Y289 HydrophobicContact CD1-CE2 4.27Å; L63-Y289 HydrophobicContact CD1-CG 3.53Å; L63-Y289 HydrophobicContact CD2-CG 4.42Å; L66-Y289 HydrophobicContact CD2-CD2 4.09Å; L66-Y289 HydrophobicContact CD2-CE2 3.55Å; M117-Y289 HydrophobicContact CE-CE1 3.87Å; H243-Y289 HydrophobicContact CB-CE1 4.34Å; H243-Y289 PolarHBondContact CD2-OH 3.13Å; H243-Y289 VanDerWaalsContact CD2-OH 3.26Å; N285-Y289 HydrophobicContact CB-CD2 4.5Å; N285-Y289 WeakPolarHBondContact O-CD2 3.38Å; N285-Y289 PolarHBondContact O-N 3.44Å; P286-Y289 PolarHBondContact O-N 3.41Å; Y289-N293 WeakPolarHBondContact O-CB 3.39Å
290S63Low68.7Low27 Ų2748.3 Ų48.319%0.18924%0.235CC..Iπ-helixtrans-101.3-53.9179.172.60000113.3P286 R292 N293P286-S290 WeakPolarHBondContact O-CA 3.31Å; P286-S290 WeakPolarHBondContact O-CB 3.48Å; P286-S290 PolarHBondContact O-N 3Å; P286-S290 PolarHBondContact O-OG 3.38Å; S290-R292 VanDerWaalsContact C-N 3.32Å; S290-R292 PolarHBondContact O-N 2.87Å; S290-N293 PolarHBondContact O-N 2.86Å
291L59.1Low69.8Low101 Ų10150.5 Ų50.553%0.52925%0.245SC..Iπ-helixtrans-75.7-18.7-171.5-63.7179.4000113.5L287 K297L287-L291 HydrophobicContact CB-CD1 4.3Å; L287-L291 HydrophobicContact CD2-CD1 3.35Å; L287-L291 HydrophobicContact CD2-CG 4.17Å; L287-L291 HydrophobicContact CG-CD1 4.4Å; L287-L291 WeakPolarHBondContact O-CB 3.38Å; L287-L291 PolarHBondContact O-N 2.77Å; L287-L291 VanDerWaalsContact O-N 3.14Å; L291-K297 WeakPolarHBondContact O-CE 3.09Å; L291-K297 PolarHBondContact O-NZ 3.45Å
292R64.9Low70.9Confident168 Ų16852.8 Ų52.863%0.63425%0.253SS*.SBendtrans-98-15.4172.1-71.6-169166.2-153.9-2.1113.2S290 K294S290-R292 VanDerWaalsContact C-N 3.32Å; S290-R292 PolarHBondContact O-N 2.87Å; R292-K294 PolarHBondContact O-N 2.78Å
293N70.4Confident72Confident24 Ų2454.4 Ų54.413%0.12826%0.262CS..  trans-89.7111.5-175.5-167.7-24.2000111.2Y60 Y289 S290 E295 V296 K297Y60-N293 PolarHBondContact OH-ND2 3.17Å; Y289-N293 WeakPolarHBondContact O-CB 3.39Å; S290-N293 PolarHBondContact O-N 2.86Å; N293-E295 PolarHBondContact O-N 3.42Å; N293-E295 WeakPolarHBondContact OD1-CB 3.44Å; N293-E295 PolarHBondContact OD1-N 2.82Å; N293-V296 HydrophobicContact CB-CB 4.17Å; N293-V296 HydrophobicContact CB-CG2 3.84Å; N293-V296 PolarHBondContact O-N 3.45Å; N293-K297 PolarHBondContact O-N 2.83Å
294K74.7Confident73.1Confident153 Ų15358.7 Ų58.767%0.66528%0.283SS*.Hα-helixtrans-59.6-33.3178.7-170.5176-179.3178.80112.2R292 K297 N298R292-K294 PolarHBondContact O-N 2.78Å; K294-K297 PolarHBondContact O-N 3.01Å; K294-N298 WeakPolarHBondContact O-CB 3.45Å; K294-N298 PolarHBondContact O-N 3.04Å; K294-N298 PolarHBondContact O-ND2 3.42Å; K294-N298 PolarHBondContact O-OD1 2.62Å
295E75.1Confident74.2Confident102 Ų10261 Ų6148%0.47729%0.292SS..Hα-helixtrans-67.7-41.1179.2-61.8177.4175.900111.2L55 Y60 N293 N298 A299L55-E295 HydrophobicContact CD2-CB 4.12Å; Y60-E295 VanDerWaalsContact CE2-OE2 3.27Å; Y60-E295 WeakPolarHBondContact CE2-OE2 3.45Å; Y60-E295 VanDerWaalsContact CZ-OE2 3.31Å; Y60-E295 VanDerWaalsContact OH-CB 3.27Å; Y60-E295 WeakPolarHBondContact OH-CB 3.46Å; Y60-E295 PolarHBondContact OH-OE2 3.06Å; N293-E295 PolarHBondContact O-N 3.42Å; N293-E295 WeakPolarHBondContact OD1-CB 3.44Å; N293-E295 PolarHBondContact OD1-N 2.82Å; E295-N298 PolarHBondContact O-N 3.07Å; E295-A299 WeakPolarHBondContact O-CB 3.24Å; E295-A299 PolarHBondContact O-N 2.88Å
296V75.1Confident74.8Confident3 Ų367 Ų672%0.01831%0.314CS..Hα-helixtrans-66.8-44.1176-179.70000110.8M45 I48 Y60 N293 N298 A299 V300M45-V296 HydrophobicContact CE-CG1 4.22Å; M45-V296 HydrophobicContact CE-CG2 3.59Å; M45-V296 HydrophobicContact SD-CG1 3.96Å; M45-V296 HydrophobicContact SD-CG2 4.35Å; I48-V296 HydrophobicContact CG2-CG1 4.45Å; Y60-V296 HydrophobicContact CE1-CG2 3.84Å; N293-V296 HydrophobicContact CB-CB 4.17Å; N293-V296 HydrophobicContact CB-CG2 3.84Å; N293-V296 PolarHBondContact O-N 3.45Å; V296-N298 VanDerWaalsContact C-N 3.34Å; V296-N298 PolarHBondContact O-N 3.47Å; V296-A299 WeakPolarHBondContact O-CB 3.5Å; V296-A299 PolarHBondContact O-N 3.46Å; V296-A299 VanDerWaalsContact O-N 3.17Å; V296-V300 WeakPolarHBondContact O-CG2 3.47Å; V296-V300 PolarHBondContact O-N 3.27Å
297K81Confident75.5Confident106 Ų10674.7 Ų74.746%0.46134%0.342SS..Hα-helixtrans-58.7-45.7174.9-70.3-176.4-179.1177.10112.5L291 N293 K294 A299 V300 I301L291-K297 WeakPolarHBondContact O-CE 3.09Å; L291-K297 PolarHBondContact O-NZ 3.45Å; N293-K297 PolarHBondContact O-N 2.83Å; K294-K297 PolarHBondContact O-N 3.01Å; K297-A299 VanDerWaalsContact C-N 3.28Å; K297-A299 PolarHBondContact O-N 3.37Å; K297-V300 PolarHBondContact O-N 2.87Å; K297-I301 WeakPolarHBondContact O-CG1 3.35Å; K297-I301 PolarHBondContact O-N 3.26Å; K297-I301 VanDerWaalsContact O-N 3.16Å
298N82.9Confident75.8Confident61 Ų6177.9 Ų77.933%0.32636%0.355SS..Hα-helixtrans-65-36177.9-70.1-11.1000111.3K294 E295 V296 I301 R302K294-N298 WeakPolarHBondContact O-CB 3.45Å; K294-N298 PolarHBondContact O-N 3.04Å; K294-N298 PolarHBondContact O-ND2 3.42Å; K294-N298 PolarHBondContact O-OD1 2.62Å; E295-N298 PolarHBondContact O-N 3.07Å; V296-N298 VanDerWaalsContact C-N 3.34Å; V296-N298 PolarHBondContact O-N 3.47Å; N298-I301 PolarHBondContact O-N 2.86Å; N298-R302 WeakPolarHBondContact O-CG 3.33Å; N298-R302 PolarHBondContact O-N 3.3Å
299A81.3Confident75.6Confident0 Ų083.8 Ų83.80%039%0.387CS..Hα-helixtrans-63.5-42.9175.200000112.3I48 D52 L55 E295 V296 K297 I301 R302 V303I48-A299 HydrophobicContact CG2-CB 3.73Å; D52-A299 HydrophobicContact CB-CB 3.96Å; D52-A299 WeakPolarHBondContact OD2-CA 3.06Å; D52-A299 WeakPolarHBondContact OD2-CB 3.46Å; L55-A299 HydrophobicContact CD1-CB 3.52Å; L55-A299 HydrophobicContact CD2-CB 4.41Å; L55-A299 HydrophobicContact CG-CB 4.03Å; E295-A299 WeakPolarHBondContact O-CB 3.24Å; E295-A299 PolarHBondContact O-N 2.88Å; V296-A299 WeakPolarHBondContact O-CB 3.5Å; V296-A299 PolarHBondContact O-N 3.46Å; V296-A299 VanDerWaalsContact O-N 3.17Å; K297-A299 VanDerWaalsContact C-N 3.28Å; K297-A299 PolarHBondContact O-N 3.37Å; A299-I301 VanDerWaalsContact C-N 3.33Å; A299-I301 PolarHBondContact O-N 3.03Å; A299-R302 PolarHBondContact O-N 3.08Å; A299-V303 WeakPolarHBondContact O-CB 3.03Å; A299-V303 VanDerWaalsContact O-CG2 3.3Å; A299-V303 WeakPolarHBondContact O-CG2 3.45Å; A299-V303 PolarHBondContact O-N 2.88Å
300V82.8Confident75.3Confident52 Ų5288.6 Ų88.632%0.31542%0.421SS..Hα-helixtrans-55.9-49.3173.3173.10000110.8I48 V296 K297 R302 V303 M304I48-V300 HydrophobicContact CD1-CG2 3.43Å; I48-V300 VanDerWaalsContact CD1-CG2 3.43Å; I48-V300 HydrophobicContact CG1-CG2 4.05Å; V296-V300 WeakPolarHBondContact O-CG2 3.47Å; V296-V300 PolarHBondContact O-N 3.27Å; K297-V300 PolarHBondContact O-N 2.87Å; V300-R302 PolarHBondContact O-N 3.44Å; V300-V303 PolarHBondContact O-N 2.83Å; V300-M304 HydrophobicContact CG1-CG 4.36Å; V300-M304 HydrophobicContact CG1-SD 3.76Å; V300-M304 WeakPolarHBondContact O-CB 3.36Å; V300-M304 VanDerWaalsContact O-CG 3.26Å; V300-M304 WeakPolarHBondContact O-CG 3.4Å; V300-M304 PolarHBondContact O-N 2.9Å
301I85Confident74.6Confident88 Ų8899 Ų9945%0.45146%0.457SS..Hα-helixtrans-58.6-47.8179.2-65.2166.9000110.7K297 N298 A299 V303 M304 Q305K297-I301 WeakPolarHBondContact O-CG1 3.35Å; K297-I301 PolarHBondContact O-N 3.26Å; K297-I301 VanDerWaalsContact O-N 3.16Å; N298-I301 PolarHBondContact O-N 2.86Å; A299-I301 VanDerWaalsContact C-N 3.33Å; A299-I301 PolarHBondContact O-N 3.03Å; I301-V303 PolarHBondContact O-N 3.33Å; I301-M304 PolarHBondContact O-N 3.36Å; I301-Q305 HydrophobicContact CG2-CG 4.44Å; I301-Q305 VanDerWaalsContact O-CG 3.31Å; I301-Q305 WeakPolarHBondContact O-CG 3.28Å; I301-Q305 PolarHBondContact O-N 3.49Å
302R85.9Confident75.4Confident53 Ų5399 Ų9920%0.245%0.453CS..Hα-helixtrans-62-42.9179.4-73.9-174.3-64-104.22.8112.8D52 N298 A299 V300 Q305 R306D52-R302 IonicContact OD1-NE 3.95Å; D52-R302 IonicContact OD1-NH2 3.86Å; D52-R302 IonicContact OD2-CZ 3.14Å; D52-R302 IonicContact OD2-NE 2.79Å; D52-R302 PolarHBondContact OD2-NE 3.38Å; D52-R302 IonicContact OD2-NH2 2.67Å; D52-R302 PolarHBondContact OD2-NH2 2.9Å; N298-R302 WeakPolarHBondContact O-CG 3.33Å; N298-R302 PolarHBondContact O-N 3.3Å; A299-R302 PolarHBondContact O-N 3.08Å; V300-R302 PolarHBondContact O-N 3.44Å; R302-Q305 PolarHBondContact O-N 3.31Å; R302-R306 WeakPolarHBondContact O-CG 3.42Å; R302-R306 PolarHBondContact O-N 3.17Å
303V84.2Confident75.9Confident35 Ų3595.3 Ų95.321%0.21244%0.444CS..Hα-helixtrans-65.7-40.7178.4170.80000110.7L51 D52 A299 V300 I301 R307L51-V303 HydrophobicContact CB-CG1 4.41Å; L51-V303 HydrophobicContact CB-CG2 3.9Å; L51-V303 HydrophobicContact CD1-CG1 3.83Å; D52-V303 HydrophobicContact CB-CG2 4.44Å; A299-V303 WeakPolarHBondContact O-CB 3.03Å; A299-V303 VanDerWaalsContact O-CG2 3.3Å; A299-V303 WeakPolarHBondContact O-CG2 3.45Å; A299-V303 PolarHBondContact O-N 2.88Å; V300-V303 PolarHBondContact O-N 2.83Å; I301-V303 PolarHBondContact O-N 3.33Å; V303-R307 PolarHBondContact O-N 3.06Å
304M85.1Confident76.2Confident114 Ų11499.3 Ų99.356%0.56246%0.461SS*.Hα-helixtrans-64.2-42.7176.3-71.4177.970.800112.3V300 I301 R307 Q308V300-M304 HydrophobicContact CG1-CG 4.36Å; V300-M304 HydrophobicContact CG1-SD 3.76Å; V300-M304 WeakPolarHBondContact O-CB 3.36Å; V300-M304 VanDerWaalsContact O-CG 3.26Å; V300-M304 WeakPolarHBondContact O-CG 3.4Å; V300-M304 PolarHBondContact O-N 2.9Å; I301-M304 PolarHBondContact O-N 3.36Å; M304-R307 PolarHBondContact O-N 3.49Å; M304-Q308 PolarHBondContact O-N 3.42Å; M304-Q308 VanDerWaalsContact O-N 3.15Å
305Q86.1Confident76.3Confident100 Ų10096.1 Ų96.147%0.46745%0.449SS..Hα-helixtrans-62-50177-74.3171.2-22.400111.7I301 R302 R307 Q308 D309I301-Q305 HydrophobicContact CG2-CG 4.44Å; I301-Q305 VanDerWaalsContact O-CG 3.31Å; I301-Q305 WeakPolarHBondContact O-CG 3.28Å; I301-Q305 PolarHBondContact O-N 3.49Å; R302-Q305 PolarHBondContact O-N 3.31Å; Q305-R307 PolarHBondContact O-N 3.23Å; Q305-R307 VanDerWaalsContact O-N 3.16Å; Q305-Q308 WeakPolarHBondContact O-CA 3.38Å; Q305-Q308 WeakPolarHBondContact O-CB 3.41Å; Q305-Q308 PolarHBondContact O-N 3.21Å; Q305-D309 PolarHBondContact O-N 3.33Å
306R80.3Confident76.4Confident129 Ų12995.8 Ų95.849%0.48745%0.447SS..Hα-helixtrans-57.4-34.5177.4-73178.2-179.3-179.50113.2R302 S310R302-R306 WeakPolarHBondContact O-CG 3.42Å; R302-R306 PolarHBondContact O-N 3.17Å; R306-S310 WeakPolarHBondContact O-CB 3.33Å; R306-S310 PolarHBondContact O-N 2.93Å; R306-S310 PolarHBondContact O-OG 3.37Å
307R73.8Confident76.5Confident169 Ų169101.9 Ų101.964%0.63848%0.476SS*.Hα-helixtrans-72.9-30177.8-163.3-175.1-173-154.84.5112.4V303 M304 Q305V303-R307 PolarHBondContact O-N 3.06Å; M304-R307 PolarHBondContact O-N 3.49Å; Q305-R307 PolarHBondContact O-N 3.23Å; Q305-R307 VanDerWaalsContact O-N 3.16Å
308Q67.5Low76.2Confident136 Ų136101.6 Ų101.664%0.63648%0.477SS*.Hα-helixtrans-73.5-39.6173.2-74.4176.3-2600111.2M304 Q305 S310 R311M304-Q308 PolarHBondContact O-N 3.42Å; M304-Q308 VanDerWaalsContact O-N 3.15Å; Q305-Q308 WeakPolarHBondContact O-CA 3.38Å; Q305-Q308 WeakPolarHBondContact O-CB 3.41Å; Q305-Q308 PolarHBondContact O-N 3.21Å; Q308-S310 PolarHBondContact O-N 3.16Å; Q308-R311 PolarHBondContact O-N 3.25Å
309D64.4Low75.7Confident135 Ų135104.8 Ų104.872%0.72249%0.489SS*.Hα-helixtrans-71.2-17.3178.4-59.3-27.7000113.6Q305Q305-D309 PolarHBondContact O-N 3.33Å
310S58.9Low75.2Confident105 Ų105113.5 Ų113.573%0.73453%0.529SS*.THydrogen-bonded Turntrans-95.53.9178.5-53.10000113.6R306 Q308R306-S310 WeakPolarHBondContact O-CB 3.33Å; R306-S310 PolarHBondContact O-N 2.93Å; R306-S310 PolarHBondContact O-OG 3.37Å; Q308-S310 PolarHBondContact O-N 3.16Å
311R48.2Very low74.5Confident246 Ų246119.1 Ų119.193%0.92855%0.549SS*.  trans-110.70177.3-82.5-176.5173.5-171.8-3.6110.4Q308Q308-R311 PolarHBondContact O-N 3.25Å

Retrieved 311 of 311 residues in 77.6 ms (Link to these results)

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