A0A3Q0KLB2_SCHMA Loading...

Phosphatidylserine synthase

Catalyzes a base-exchange reaction in which the polar head group of phosphatidylethanolamine (PE) is replaced by L-serine.

AlphaFold DB , UniProt , Accession A0A3Q0KLB2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 495 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
1M41.4Very low60.2Low246 Ų246155.3 Ų155.3100%1.21273%0.733SS**  092.60-156.7179.7-144.500108.6R3M1-R3 PolarHBondContact O-N 3.45Å
2R39.9Very low62.4Low245 Ų245144.4 Ų144.493%0.92568%0.683SS**  trans-66.4112.1179-113.2176.1-168.3170.73.9108R4R2-R4 PolarHBondContact O-N 3.33Å
3R44.6Very low64.1Low243 Ų243139.3 Ų139.392%0.91766%0.657SS**  trans-58.2105.5165.3-80.2-177-168.9173.14.1106.8M1 L5M1-R3 PolarHBondContact O-N 3.45Å; R3-L5 PolarHBondContact O-N 2.79Å; R3-L5 VanDerWaalsContact O-N 3.09Å
4R45.1Very low65.8Low222 Ų222137.4 Ų137.484%0.83865%0.647SS**  trans-58.9115.1163-72.3-178.8-171.6171.32.5105.4R2 L6R2-R4 PolarHBondContact O-N 3.33Å; R4-L6 HydrophobicContact CB-CG 4.4Å; R4-L6 PolarHBondContact O-N 3.06Å
5L51.3Low67.4Low173 Ų173134.1 Ų134.191%0.90663%0.627SS**  trans-6480.4164-69.7163.1000106.2R3 S7R3-L5 PolarHBondContact O-N 2.79Å; R3-L5 VanDerWaalsContact O-N 3.09Å; L5-S7 VanDerWaalsContact C-N 3.29Å; L5-S7 PolarHBondContact O-N 3.26Å
6L57.2Low68.7Low155 Ų155126.2 Ų126.281%0.81259%0.59SS**  trans-66.498.3171.1-81.1159.2000105.9R4 E8R4-L6 HydrophobicContact CB-CG 4.4Å; R4-L6 PolarHBondContact O-N 3.06Å; L6-E8 PolarHBondContact O-N 3.21Å
7S62.4Low69.9Low91 Ų91122.8 Ų122.864%0.63658%0.577SS**  trans-40127.7156.9162.20000107.7L5 S9L5-S7 VanDerWaalsContact C-N 3.29Å; L5-S7 PolarHBondContact O-N 3.26Å; S7-S9 PolarHBondContact O-N 3.05Å
8E69Low70.8Confident51 Ų51118.6 Ų118.624%0.23856%0.563CS.*  trans-43.9132.1169.1-174.6176.4-146.900109.4L6 D12 K13L6-E8 PolarHBondContact O-N 3.21Å; E8-D12 HydrophobicContact CG-CB 3.75Å; E8-K13 HydrophobicContact CB-CG 4.32Å; E8-K13 HydrophobicContact CG-CG 3.88Å; E8-K13 WeakPolarHBondContact O-CE 3.02Å
9S80.9Confident71.6Confident51 Ų51114.4 Ų114.436%0.35754%0.544SS..  trans-62.9149-17675.30000109.4S7 V11 D12 K13S7-S9 PolarHBondContact O-N 3.05Å; S9-V11 PolarHBondContact O-N 3.36Å; S9-D12 PolarHBondContact O-N 2.95Å; S9-D12 VanDerWaalsContact O-N 3.11Å; S9-D12 WeakPolarHBondContact OG-CB 3.49Å; S9-D12 PolarHBondContact OG-N 3.43Å; S9-D12 PolarHBondContact OG-OD2 2.9Å; S9-K13 PolarHBondContact O-N 3.48Å
10Q84.6Confident72.4Confident127 Ų127108.7 Ų108.759%0.59352%0.517SS*.Hα-helixtrans-54-38.4176-174.179.26.200110.9K13 E14Q10-K13 WeakPolarHBondContact O-CB 3.38Å; Q10-K13 PolarHBondContact O-N 3.18Å; Q10-E14 WeakPolarHBondContact CG-OE1 3.49Å; Q10-E14 PolarHBondContact NE2-OE1 3.34Å; Q10-E14 WeakPolarHBondContact O-CG 3.3Å; Q10-E14 PolarHBondContact O-N 2.96Å
11V86.3Confident73.1Confident104 Ų104104.4 Ų104.463%0.6350%0.497SS*.Hα-helixtrans-61.7-47.3176.8-179.10000111.5S9 K13 E14 Y15S9-V11 PolarHBondContact O-N 3.36Å; V11-K13 VanDerWaalsContact C-N 3.29Å; V11-K13 PolarHBondContact O-N 3.33Å; V11-E14 PolarHBondContact O-N 3.26Å; V11-Y15 VanDerWaalsContact O-CB 3.23Å; V11-Y15 WeakPolarHBondContact O-CB 3.33Å; V11-Y15 PolarHBondContact O-N 3.4Å
12D85.7Confident75.2Confident25 Ų2598.4 Ų98.413%0.13447%0.466CS..Hα-helixtrans-63-37.5177.9-63.5-37.4000111.2E8 S9 Y15 F16 H344E8-D12 HydrophobicContact CG-CB 3.75Å; S9-D12 PolarHBondContact O-N 2.95Å; S9-D12 VanDerWaalsContact O-N 3.11Å; S9-D12 WeakPolarHBondContact OG-CB 3.49Å; S9-D12 PolarHBondContact OG-N 3.43Å; S9-D12 PolarHBondContact OG-OD2 2.9Å; D12-Y15 PolarHBondContact O-N 3.05Å; D12-F16 VanDerWaalsContact O-CB 3.29Å; D12-F16 WeakPolarHBondContact O-CB 3.25Å; D12-F16 PolarHBondContact O-N 3.28Å; D12-H344 IonicContact OD1-ND1 3.35Å
13K85.5Confident77.2Confident78 Ų7888.9 Ų88.934%0.33943%0.432SS..Hα-helixtrans-65.8-45.2176.1-69.2177.7-174.2170.20112.4E8 S9 Q10 V11 Y15 F16 N17E8-K13 HydrophobicContact CB-CG 4.32Å; E8-K13 HydrophobicContact CG-CG 3.88Å; E8-K13 WeakPolarHBondContact O-CE 3.02Å; S9-K13 PolarHBondContact O-N 3.48Å; Q10-K13 WeakPolarHBondContact O-CB 3.38Å; Q10-K13 PolarHBondContact O-N 3.18Å; V11-K13 VanDerWaalsContact C-N 3.29Å; V11-K13 PolarHBondContact O-N 3.33Å; K13-Y15 VanDerWaalsContact C-N 3.33Å; K13-F16 PolarHBondContact O-N 3.2Å; K13-N17 WeakPolarHBondContact O-CB 3.45Å; K13-N17 VanDerWaalsContact O-CG 3.29Å; K13-N17 PolarHBondContact O-N 2.83Å; K13-N17 PolarHBondContact O-ND2 3.03Å
14E87.7Confident78.9Confident112 Ų11284.6 Ų84.652%0.52342%0.42SS..Hα-helixtrans-65.9-40.1177.3-74.6172.6-166.200111Q10 V11 N17 S18Q10-E14 WeakPolarHBondContact CG-OE1 3.49Å; Q10-E14 PolarHBondContact NE2-OE1 3.34Å; Q10-E14 WeakPolarHBondContact O-CG 3.3Å; Q10-E14 PolarHBondContact O-N 2.96Å; V11-E14 PolarHBondContact O-N 3.26Å; E14-N17 PolarHBondContact O-N 3.35Å; E14-S18 VanDerWaalsContact O-CB 3.29Å; E14-S18 WeakPolarHBondContact O-CB 3.39Å; E14-S18 PolarHBondContact O-N 3.06Å; E14-S18 PolarHBondContact O-OG 2.98Å
15Y88.7Confident80.4Confident89 Ų8975.3 Ų75.335%0.34939%0.388SS..Hα-helixtrans-59.6-51.9173.4-174.7-107.4000111.5V11 D12 K13 N17 S18 L19 D342 H344 I345V11-Y15 VanDerWaalsContact O-CB 3.23Å; V11-Y15 WeakPolarHBondContact O-CB 3.33Å; V11-Y15 PolarHBondContact O-N 3.4Å; D12-Y15 PolarHBondContact O-N 3.05Å; K13-Y15 VanDerWaalsContact C-N 3.33Å; Y15-N17 PolarHBondContact O-N 3.43Å; Y15-S18 PolarHBondContact O-N 3.06Å; Y15-S18 PolarHBondContact O-OG 3.05Å; Y15-L19 HydrophobicContact CE1-CD2 4.21Å; Y15-L19 PolarHBondContact O-N 2.04Å; Y15-L19 VanDerWaalsContact O-N 3.08Å; Y15-D342 VanDerWaalsContact CE1-OD2 3.32Å; Y15-D342 WeakPolarHBondContact CE1-OD2 3.35Å; Y15-D342 PolarHBondContact OH-OD2 2.95Å; Y15-H344 HydrophobicContact CD1-CB 4.03Å; Y15-H344 HydrophobicContact CE1-CB 4.09Å; Y15-I345 HydrophobicContact CD1-CG1 4.3Å; Y15-I345 HydrophobicContact CE1-CD1 4.17Å; Y15-I345 HydrophobicContact CE1-CG1 4.1Å
16F89.5Confident81.3Confident7 Ų772.1 Ų72.13%0.03137%0.371CS..Hα-helixtrans-53.7-51.1174.6175.6-94.3000111.6D12 K13 S18 L19 I20 E21 I345 R347D12-F16 VanDerWaalsContact O-CB 3.29Å; D12-F16 WeakPolarHBondContact O-CB 3.25Å; D12-F16 PolarHBondContact O-N 3.28Å; K13-F16 PolarHBondContact O-N 3.2Å; F16-S18 VanDerWaalsContact C-N 3.34Å; F16-S18 PolarHBondContact O-N 3.21Å; F16-L19 PolarHBondContact O-N 2.98Å; F16-I20 HydrophobicContact CD2-CB 4.24Å; F16-I20 HydrophobicContact CD2-CD1 3.68Å; F16-I20 HydrophobicContact CD2-CG1 4.42Å; F16-I20 HydrophobicContact CD2-CG2 4.41Å; F16-I20 HydrophobicContact CE1-CG2 4.42Å; F16-I20 HydrophobicContact CE2-CB 4.04Å; F16-I20 HydrophobicContact CE2-CD1 3.57Å; F16-I20 HydrophobicContact CE2-CG1 4.37Å; F16-I20 HydrophobicContact CE2-CG2 3.71Å; F16-I20 HydrophobicContact CZ-CB 4.33Å; F16-I20 HydrophobicContact CZ-CG2 3.72Å; F16-I20 WeakPolarHBondContact O-CB 3.06Å; F16-I20 PolarHBondContact O-N 3.37Å; F16-E21 HydrophobicContact CD1-CG 4.2Å; F16-E21 HydrophobicContact CE1-CG 3.46Å; F16-E21 VanDerWaalsContact CE1-CG 3.46Å; F16-E21 HydrophobicContact CZ-CG 4.01Å; F16-I345 HydrophobicContact CD2-CG2 4.13Å; F16-I345 HydrophobicContact CE2-CG2 4.43Å; F16-R347 HydrophobicContact CD2-CB 4.38Å; F16-R347 HydrophobicContact CE2-CB 3.95Å; F16-R347 HydrophobicContact CE2-CG 4.28Å; F16-R347 VanDerWaalsContact CE2-O 3.28Å; F16-R347 WeakPolarHBondContact CE2-O 3.42Å; F16-R347 HydrophobicContact CZ-CB 4.24Å; F16-R347 HydrophobicContact CZ-CG 4.09Å
17N89Confident81.6Confident68 Ų6869.2 Ų69.236%0.36436%0.357SS..Iπ-helixtrans-61.1-43.8179.3-74.5-25.9000111.5K13 E14 Y15 L19 E21 Q22K13-N17 WeakPolarHBondContact O-CB 3.45Å; K13-N17 VanDerWaalsContact O-CG 3.29Å; K13-N17 PolarHBondContact O-N 2.83Å; K13-N17 PolarHBondContact O-ND2 3.03Å; E14-N17 PolarHBondContact O-N 3.35Å; Y15-N17 PolarHBondContact O-N 3.43Å; N17-L19 VanDerWaalsContact C-N 3.29Å; N17-L19 PolarHBondContact O-N 2.74Å; N17-E21 PolarHBondContact O-N 3.29Å; N17-Q22 CarbonylContact O-C 3.38Å; N17-Q22 VanDerWaalsContact O-CA 3.32Å; N17-Q22 WeakPolarHBondContact O-CA 3.37Å; N17-Q22 WeakPolarHBondContact O-CB 3.47Å; N17-Q22 PolarHBondContact O-N 2.82Å
18S86.6Confident81.9Confident48 Ų4868.7 Ų68.734%0.33635%0.346SS..Iπ-helixtrans-66.9-27.6-177.374.90000114E14 Y15 F16 Q23E14-S18 VanDerWaalsContact O-CB 3.29Å; E14-S18 WeakPolarHBondContact O-CB 3.39Å; E14-S18 PolarHBondContact O-N 3.06Å; E14-S18 PolarHBondContact O-OG 2.98Å; Y15-S18 PolarHBondContact O-N 3.06Å; Y15-S18 PolarHBondContact O-OG 3.05Å; F16-S18 VanDerWaalsContact C-N 3.34Å; F16-S18 PolarHBondContact O-N 3.21Å; S18-Q23 VanDerWaalsContact O-CA 3.32Å; S18-Q23 WeakPolarHBondContact O-CA 3.13Å
19L85.9Confident81.5Confident39 Ų3967.2 Ų67.220%0.20434%0.341CS..Iπ-helixtrans-106.1-34-173.1-167.764.7000113.7Y15 F16 N17 L338 I345Y15-L19 HydrophobicContact CE1-CD2 4.21Å; Y15-L19 PolarHBondContact O-N 2.04Å; Y15-L19 VanDerWaalsContact O-N 3.08Å; F16-L19 PolarHBondContact O-N 2.98Å; N17-L19 VanDerWaalsContact C-N 3.29Å; N17-L19 PolarHBondContact O-N 2.74Å; L19-L338 HydrophobicContact CD2-CD1 3.94Å; L19-L338 HydrophobicContact CD2-CD2 3.8Å; L19-L338 HydrophobicContact CD2-CG 4.47Å; L19-L338 HydrophobicContact CG-CD1 3.81Å; L19-L338 HydrophobicContact CG-CD2 4.48Å; L19-I345 HydrophobicContact CD2-CD1 4.14Å
20I86.7Confident80.7Confident0 Ų067.8 Ų67.80%034%0.339CS..Iπ-helixtrans-105.1-46-171-74.4-178.8000113.2F16 G88 Q335 L338 I345F16-I20 HydrophobicContact CD2-CB 4.24Å; F16-I20 HydrophobicContact CD2-CD1 3.68Å; F16-I20 HydrophobicContact CD2-CG1 4.42Å; F16-I20 HydrophobicContact CD2-CG2 4.41Å; F16-I20 HydrophobicContact CE1-CG2 4.42Å; F16-I20 HydrophobicContact CE2-CB 4.04Å; F16-I20 HydrophobicContact CE2-CD1 3.57Å; F16-I20 HydrophobicContact CE2-CG1 4.37Å; F16-I20 HydrophobicContact CE2-CG2 3.71Å; F16-I20 HydrophobicContact CZ-CB 4.33Å; F16-I20 HydrophobicContact CZ-CG2 3.72Å; F16-I20 WeakPolarHBondContact O-CB 3.06Å; F16-I20 PolarHBondContact O-N 3.37Å; I20-G88 CarbonylContact O-C 3.57Å; I20-G88 VanDerWaalsContact O-C 3.3Å; I20-Q335 HydrophobicContact CG2-CG 3.9Å; I20-Q335 PolarHBondContact O-NE2 2.69Å; I20-Q335 VanDerWaalsContact O-NE2 3.09Å; I20-L338 HydrophobicContact CD1-CB 4.15Å; I20-L338 HydrophobicContact CD1-CD1 4.41Å; I20-L338 HydrophobicContact CG1-CB 4.4Å; I20-L338 HydrophobicContact CG1-CD1 3.76Å; I20-I345 HydrophobicContact CD1-CB 4.48Å; I20-I345 HydrophobicContact CD1-CD1 3.73Å; I20-I345 HydrophobicContact CD1-CG1 4.3Å; I20-I345 HydrophobicContact CD1-CG2 3.43Å; I20-I345 VanDerWaalsContact CD1-CG2 3.43Å; I20-I345 HydrophobicContact CG1-CD1 4.36Å
21E87.8Confident79.8Confident19 Ų1963 Ų639%0.08932%0.323CS..Iπ-helixtrans-102.8-42.2-169.6-66.7-60.7150.700113.4F16 N17 P86 N87 G88 G349 S350F16-E21 HydrophobicContact CD1-CG 4.2Å; F16-E21 HydrophobicContact CE1-CG 3.46Å; F16-E21 VanDerWaalsContact CE1-CG 3.46Å; F16-E21 HydrophobicContact CZ-CG 4.01Å; N17-E21 PolarHBondContact O-N 3.29Å; E21-P86 VanDerWaalsContact O-CB 3.27Å; E21-P86 WeakPolarHBondContact O-CB 3.39Å; E21-N87 PolarHBondContact O-N 3.13Å; E21-N87 VanDerWaalsContact O-N 3.11Å; E21-G88 PolarHBondContact O-N 3.45Å; E21-G349 VanDerWaalsContact OE1-CA 3.27Å; E21-G349 WeakPolarHBondContact OE1-CA 3.48Å; E21-S350 VanDerWaalsContact CD-OG 3.27Å; E21-S350 WeakPolarHBondContact OE1-CB 3.39Å; E21-S350 PolarHBondContact OE1-N 3.49Å; E21-S350 PolarHBondContact OE1-OG 3.01Å; E21-S350 WeakPolarHBondContact OE2-CB 3.3Å; E21-S350 PolarHBondContact OE2-OG 3.25Å
22Q84.8Confident78.8Confident119 Ų11962.2 Ų62.256%0.55632%0.319SS*.BIsolated β-bridgetrans-132.958.2-169.2-64.6-168.6-18.600110.2N17 K24N17-Q22 CarbonylContact O-C 3.38Å; N17-Q22 VanDerWaalsContact O-CA 3.32Å; N17-Q22 WeakPolarHBondContact O-CA 3.37Å; N17-Q22 WeakPolarHBondContact O-CB 3.47Å; N17-Q22 PolarHBondContact O-N 2.82Å; Q22-K24 PolarHBondContact O-N 3.41Å
23Q82.5Confident77.8Confident46 Ų4667.8 Ų67.822%0.21534%0.342CS..  trans-56.4120.9174.6-162.2179.613.100110.1S18 N87 P89 I91S18-Q23 VanDerWaalsContact O-CA 3.32Å; S18-Q23 WeakPolarHBondContact O-CA 3.13Å; Q23-N87 PolarHBondContact O-ND2 3.06Å; Q23-P89 PolarHBondContact OE1-O 3.24Å; Q23-I91 HydrophobicContact CB-CG1 4.35Å; Q23-I91 HydrophobicContact CG-CD1 3.92Å; Q23-I91 HydrophobicContact CG-CG1 3.88Å
24K79.1Confident77Confident153 Ų15366.9 Ų66.967%0.66534%0.337SS*.  trans-66.8143178.7-69-176.6-179.81770109.2Q22 I91Q22-K24 PolarHBondContact O-N 3.41Å; K24-I91 VanDerWaalsContact O-CD1 3.22Å; K24-I91 WeakPolarHBondContact O-CD1 3.25Å
25V77.8Confident76.3Confident27 Ų2768.2 Ų68.216%0.16434%0.343CS..  trans-101.4104.2175.5-174.60000108.4I28 Y34 I91 P95V25-I28 HydrophobicContact CG1-CG1 4.09Å; V25-Y34 HydrophobicContact CB-CD1 4.4Å; V25-Y34 HydrophobicContact CB-CE1 4.1Å; V25-Y34 HydrophobicContact CG1-CD1 4.25Å; V25-Y34 HydrophobicContact CG1-CE1 3.61Å; V25-Y34 HydrophobicContact CG2-CD1 4.44Å; V25-Y34 HydrophobicContact CG2-CE1 4.03Å; V25-I91 HydrophobicContact CB-CG2 4.38Å; V25-I91 HydrophobicContact CG1-CG2 3.84Å; V25-I91 HydrophobicContact CG2-CG1 4.35Å; V25-I91 HydrophobicContact CG2-CG2 3.97Å; V25-P95 HydrophobicContact CG2-CG 3.62Å
26D68.7Low75.5Confident105 Ų10569 Ų6956%0.56136%0.361SS*.  trans-79.9158.2171.9-51.3-39.2000110
27D64.6Low75.1Confident94 Ų9475.3 Ų75.350%0.50339%0.385SS..  trans59.151.3173.2-47.5-42.2000115.3T29 R268D27-T29 WeakPolarHBondContact O-CG2 3.47Å; D27-T29 PolarHBondContact O-N 3.17Å; D27-R268 IonicContact OD2-CZ 3.12Å; D27-R268 IonicContact OD2-NH2 2.84Å; D27-R268 PolarHBondContact OD2-NH2 3.17Å
28I69Low74.9Confident81 Ų8175.7 Ų75.742%0.41539%0.39SS..  trans-67.6102.5177.6-63.1166.7000110.7V25 Y34V25-I28 HydrophobicContact CG1-CG1 4.09Å; I28-Y34 HydrophobicContact CB-CD2 4.35Å; I28-Y34 HydrophobicContact CD1-CD1 4.17Å; I28-Y34 HydrophobicContact CD1-CG 3.94Å; I28-Y34 HydrophobicContact CG1-CD1 4.18Å; I28-Y34 HydrophobicContact CG1-CD2 4.19Å; I28-Y34 HydrophobicContact CG1-CG 3.97Å; I28-Y34 HydrophobicContact CG2-CD2 3.36Å; I28-Y34 HydrophobicContact CG2-CE2 4.01Å; I28-Y34 HydrophobicContact CG2-CG 3.78Å
29T61Low75Confident20 Ų2079.4 Ų79.412%0.12341%0.405CS..SBendtrans-78.9-25.5-178.464.50000113.5D27D27-T29 WeakPolarHBondContact O-CG2 3.47Å; D27-T29 PolarHBondContact O-N 3.17Å
30I63.7Low75Confident63 Ų6381.2 Ų81.232%0.32342%0.418SS..  trans-130.887.5178.4-53.2172.3000108.4V32 F33 Y34 I248I30-V32 HydrophobicContact CG2-CB 4.31Å; I30-V32 PolarHBondContact O-N 3.18Å; I30-V32 VanDerWaalsContact O-N 3.08Å; I30-F33 HydrophobicContact CB-CD2 3.86Å; I30-F33 HydrophobicContact CB-CE2 4.36Å; I30-F33 HydrophobicContact CD1-CD2 4.25Å; I30-F33 HydrophobicContact CD1-CE2 4.05Å; I30-F33 HydrophobicContact CG2-CD2 3.44Å; I30-F33 VanDerWaalsContact CG2-CD2 3.44Å; I30-F33 HydrophobicContact CG2-CE2 3.7Å; I30-F33 HydrophobicContact CG2-CG 4.45Å; I30-F33 PolarHBondContact O-N 3.45Å; I30-Y34 WeakPolarHBondContact O-CD2 3.48Å; I30-I248 HydrophobicContact CD1-CD1 4.31Å
31G65.7Low75Confident26 Ų2683.8 Ų83.827%0.26843%0.433SS..G310 helixtrans-55.2-28.7-177.200000114.5F33 Y34 H35G31-F33 PolarHBondContact O-N 3.46Å; G31-Y34 PolarHBondContact O-N 3.05Å; G31-H35 PolarHBondContact O-CD2 3.47Å; G31-H35 PolarHBondContact O-N 3.2Å
32V65.8Low75.1Confident87 Ų8787.8 Ų87.853%0.52746%0.455SS..G310 helixtrans-56.5-35.9-179.6178.50000112.7I30I30-V32 HydrophobicContact CG2-CB 4.31Å; I30-V32 PolarHBondContact O-N 3.18Å; I30-V32 VanDerWaalsContact O-N 3.08Å
33F64.7Low75.5Confident142 Ų14285.5 Ų85.562%0.62345%0.449SS*.G310 helixtrans-81-16.6-179.4-67.3-60.5000114I30 G31I30-F33 HydrophobicContact CB-CD2 3.86Å; I30-F33 HydrophobicContact CB-CE2 4.36Å; I30-F33 HydrophobicContact CD1-CD2 4.25Å; I30-F33 HydrophobicContact CD1-CE2 4.05Å; I30-F33 HydrophobicContact CG2-CD2 3.44Å; I30-F33 VanDerWaalsContact CG2-CD2 3.44Å; I30-F33 HydrophobicContact CG2-CE2 3.7Å; I30-F33 HydrophobicContact CG2-CG 4.45Å; I30-F33 PolarHBondContact O-N 3.45Å; G31-F33 PolarHBondContact O-N 3.46Å
34Y68.7Low76Confident59 Ų5987.2 Ų87.223%0.23146%0.462CS..THydrogen-bonded Turntrans-107.1-17.5-176.8-67.5-93000112.9V25 I28 I30 G31 S36 H94 P95V25-Y34 HydrophobicContact CB-CD1 4.4Å; V25-Y34 HydrophobicContact CB-CE1 4.1Å; V25-Y34 HydrophobicContact CG1-CD1 4.25Å; V25-Y34 HydrophobicContact CG1-CE1 3.61Å; V25-Y34 HydrophobicContact CG2-CD1 4.44Å; V25-Y34 HydrophobicContact CG2-CE1 4.03Å; I28-Y34 HydrophobicContact CB-CD2 4.35Å; I28-Y34 HydrophobicContact CD1-CD1 4.17Å; I28-Y34 HydrophobicContact CD1-CG 3.94Å; I28-Y34 HydrophobicContact CG1-CD1 4.18Å; I28-Y34 HydrophobicContact CG1-CD2 4.19Å; I28-Y34 HydrophobicContact CG1-CG 3.97Å; I28-Y34 HydrophobicContact CG2-CD2 3.36Å; I28-Y34 HydrophobicContact CG2-CE2 4.01Å; I28-Y34 HydrophobicContact CG2-CG 3.78Å; I30-Y34 WeakPolarHBondContact O-CD2 3.48Å; G31-Y34 PolarHBondContact O-N 3.05Å; Y34-S36 PolarHBondContact O-N 3.04Å; Y34-H94 AromaticContact CE1-NE2 3.82Å; Y34-H94 AromaticContact CE2-NE2 3.92Å; Y34-H94 AromaticContact CZ-CD2 3.85Å; Y34-H94 AromaticContact CZ-NE2 3.61Å; Y34-P95 HydrophobicContact CE1-CG 4.18Å
35H71.3Confident76.6Confident140 Ų14081 Ų8165%0.64844%0.436SS*.SBendtrans-71.5122.1170.7-81.8-64.9000111.1G31 R37G31-H35 PolarHBondContact O-CD2 3.47Å; G31-H35 PolarHBondContact O-N 3.2Å; H35-R37 PolarHBondContact O-N 2.79Å; H35-R37 VanDerWaalsContact O-N 3.14Å
36S73.1Confident77.4Confident105 Ų10587.8 Ų87.873%0.73446%0.459SS*.  trans-67.3108.8174.856.50000110.8Y34 T38Y34-S36 PolarHBondContact O-N 3.04Å; S36-T38 PolarHBondContact O-N 3.02Å
37R79.9Confident78.6Confident140 Ų14087.5 Ų87.553%0.52846%0.457SS..  trans-99.156.2173.5-60.6-173.9-178.7-148.9-2.9111H35 L39 T40 V41H35-R37 PolarHBondContact O-N 2.79Å; H35-R37 VanDerWaalsContact O-N 3.14Å; R37-L39 VanDerWaalsContact C-N 3.33Å; R37-L39 PolarHBondContact O-N 3.09Å; R37-T40 PolarHBondContact O-N 3.1Å; R37-T40 VanDerWaalsContact O-N 3.17Å; R37-V41 WeakPolarHBondContact O-CG2 3.44Å; R37-V41 PolarHBondContact O-N 3.3Å
38T84.8Confident79.9Confident77 Ų7786 Ų8647%0.47245%0.453SS..Hα-helixtrans-57.6-44.4-170.258.10000112.5S36 V41 L42 M83S36-T38 PolarHBondContact O-N 3.02Å; T38-V41 PolarHBondContact O-N 3.41Å; T38-L42 WeakPolarHBondContact O-CB 3.22Å; T38-L42 PolarHBondContact O-N 3.41Å; T38-M83 HydrophobicContact CG2-CE 3.72Å
39L88.3Confident81.1Confident125 Ų12585.7 Ų85.765%0.65445%0.452SS*.Hα-helixtrans-65.7-42.7177.8-173.266.3000112.3R37 L42 V43R37-L39 VanDerWaalsContact C-N 3.33Å; R37-L39 PolarHBondContact O-N 3.09Å; L39-L42 PolarHBondContact O-N 3.31Å; L39-V43 WeakPolarHBondContact O-CG2 3.32Å; L39-V43 PolarHBondContact O-N 2.82Å
40T87Confident82.6Confident78 Ų7885.7 Ų85.748%0.47945%0.454SS..Hα-helixtrans-62.8-45.1177.3-49.90000111.1R37 L42 V43 V44R37-T40 PolarHBondContact O-N 3.1Å; R37-T40 VanDerWaalsContact O-N 3.17Å; T40-L42 VanDerWaalsContact C-N 3.33Å; T40-L42 PolarHBondContact O-N 3.38Å; T40-V43 PolarHBondContact O-N 3.2Å; T40-V44 WeakPolarHBondContact O-CG2 3.46Å; T40-V44 PolarHBondContact O-N 3.28Å
41V86.7Confident84Confident53 Ų5390 Ų9032%0.32147%0.468SS..Hα-helixtrans-62.5-42.6177.5174.80000110.5R37 T38 V43 V44 I45 M83R37-V41 WeakPolarHBondContact O-CG2 3.44Å; R37-V41 PolarHBondContact O-N 3.3Å; T38-V41 PolarHBondContact O-N 3.41Å; V41-V43 PolarHBondContact O-N 2.77Å; V41-V44 PolarHBondContact O-N 3.05Å; V41-I45 HydrophobicContact CG1-CD1 3.7Å; V41-I45 HydrophobicContact CG1-CG1 4.27Å; V41-I45 WeakPolarHBondContact O-CB 3.47Å; V41-I45 VanDerWaalsContact O-CG1 3.27Å; V41-I45 WeakPolarHBondContact O-CG1 3.34Å; V41-I45 PolarHBondContact O-N 3.42Å; V41-M83 HydrophobicContact CB-SD 3.95Å; V41-M83 HydrophobicContact CG1-SD 3.53Å; V41-M83 VanDerWaalsContact CG1-SD 3.53Å
42L90.7Very high85.2Confident103 Ų10394.9 Ų94.954%0.53948%0.481SS..Hα-helixtrans-58.5-48.2175.4177.763.4000112.2T38 L39 T40 V44 I45 W46T38-L42 WeakPolarHBondContact O-CB 3.22Å; T38-L42 PolarHBondContact O-N 3.41Å; L39-L42 PolarHBondContact O-N 3.31Å; T40-L42 VanDerWaalsContact C-N 3.33Å; T40-L42 PolarHBondContact O-N 3.38Å; L42-V44 VanDerWaalsContact C-N 3.34Å; L42-V44 PolarHBondContact O-N 2.78Å; L42-I45 PolarHBondContact O-N 3.23Å; L42-W46 WeakPolarHBondContact O-CB 3.38Å; L42-W46 PolarHBondContact O-N 2.94Å
43V93.1Very high86.3Confident72 Ų7294 Ų9444%0.43648%0.483SS..Hα-helixtrans-60.7-44.1178170.90000110.9L39 T40 V41 W46 L47L39-V43 WeakPolarHBondContact O-CG2 3.32Å; L39-V43 PolarHBondContact O-N 2.82Å; T40-V43 PolarHBondContact O-N 3.2Å; V41-V43 PolarHBondContact O-N 2.77Å; V43-W46 PolarHBondContact O-N 3.21Å; V43-L47 HydrophobicContact CG1-CD1 3.8Å; V43-L47 HydrophobicContact CG1-CG 4.25Å; V43-L47 WeakPolarHBondContact O-CB 3.48Å; V43-L47 VanDerWaalsContact O-CG 3.29Å; V43-L47 WeakPolarHBondContact O-CG 3.27Å; V43-L47 PolarHBondContact O-N 3.32Å
44V91.8Very high87.6Confident81 Ų8196 Ų9649%0.49149%0.492SS..Hα-helixtrans-62.7-47.6177.4171.50000111.2T40 V41 L42 W46 L47 C48T40-V44 WeakPolarHBondContact O-CG2 3.46Å; T40-V44 PolarHBondContact O-N 3.28Å; V41-V44 PolarHBondContact O-N 3.05Å; L42-V44 VanDerWaalsContact C-N 3.34Å; L42-V44 PolarHBondContact O-N 2.78Å; V44-W46 VanDerWaalsContact C-N 3.3Å; V44-W46 PolarHBondContact O-N 3.4Å; V44-L47 PolarHBondContact O-N 3.14Å; V44-C48 WeakPolarHBondContact O-CB 3.39Å; V44-C48 PolarHBondContact O-N 3.35Å; V44-C48 PolarHBondContact O-SG 2.7Å
45I91.9Very high88.6Confident22 Ų2296.1 Ų96.111%0.11350%0.502CS..Hα-helixtrans-56.4-47.4176.7-71.6169.3000110.3V41 L42 C48 L49 I76 L79V41-I45 HydrophobicContact CG1-CD1 3.7Å; V41-I45 HydrophobicContact CG1-CG1 4.27Å; V41-I45 WeakPolarHBondContact O-CB 3.47Å; V41-I45 VanDerWaalsContact O-CG1 3.27Å; V41-I45 WeakPolarHBondContact O-CG1 3.34Å; V41-I45 PolarHBondContact O-N 3.42Å; L42-I45 PolarHBondContact O-N 3.23Å; I45-C48 PolarHBondContact O-N 3.33Å; I45-L49 HydrophobicContact CG2-CD1 4.01Å; I45-L49 WeakPolarHBondContact O-CB 3.33Å; I45-L49 WeakPolarHBondContact O-CG 3.42Å; I45-L49 PolarHBondContact O-N 3.44Å; I45-I76 HydrophobicContact CG2-CG1 4.26Å; I45-I76 HydrophobicContact CG2-CG2 4.36Å; I45-L79 HydrophobicContact CD1-CB 4.04Å; I45-L79 HydrophobicContact CD1-CD1 4.2Å; I45-L79 HydrophobicContact CG1-CD1 3.93Å
46W93.9Very high89.3Confident170 Ų17093.3 Ų93.364%0.64449%0.486SS*.Hα-helixtrans-66.9-43.4-177.8-168.290.3000112.5L42 V43 V44 L49 A50L42-W46 WeakPolarHBondContact O-CB 3.38Å; L42-W46 PolarHBondContact O-N 2.94Å; V43-W46 PolarHBondContact O-N 3.21Å; V44-W46 VanDerWaalsContact C-N 3.3Å; V44-W46 PolarHBondContact O-N 3.4Å; W46-L49 WeakPolarHBondContact O-CB 3.46Å; W46-L49 PolarHBondContact O-N 2.59Å; W46-A50 HydrophobicContact CE3-CB 4.4Å; W46-A50 HydrophobicContact CZ3-CB 4.25Å; W46-A50 WeakPolarHBondContact O-CB 3.42Å; W46-A50 PolarHBondContact O-N 3.14Å
47L95Very high89.7Confident99 Ų9991.3 Ų91.352%0.51847%0.471SS..Hα-helixtrans-64.5-41.4176.5-71.8175.3000112V43 V44 A50 Y51V43-L47 HydrophobicContact CG1-CD1 3.8Å; V43-L47 HydrophobicContact CG1-CG 4.25Å; V43-L47 WeakPolarHBondContact O-CB 3.48Å; V43-L47 VanDerWaalsContact O-CG 3.29Å; V43-L47 WeakPolarHBondContact O-CG 3.27Å; V43-L47 PolarHBondContact O-N 3.32Å; V44-L47 PolarHBondContact O-N 3.14Å; L47-A50 PolarHBondContact O-N 3.38Å; L47-Y51 WeakPolarHBondContact O-CB 3.3Å; L47-Y51 PolarHBondContact O-N 3.45Å
48C92.4Very high89.8Confident64 Ų6490.7 Ų90.743%0.43249%0.488SS..Hα-helixtrans-62.5-46174.1-71.90000111.2V44 I45 Y51 F52V44-C48 WeakPolarHBondContact O-CB 3.39Å; V44-C48 PolarHBondContact O-N 3.35Å; V44-C48 PolarHBondContact O-SG 2.7Å; I45-C48 PolarHBondContact O-N 3.33Å; C48-Y51 PolarHBondContact O-N 3.29Å; C48-F52 WeakPolarHBondContact O-CD2 3.37Å; C48-F52 PolarHBondContact O-N 2.84Å
49L92.8Very high89.9Confident74 Ų7492.9 Ų92.939%0.38750%0.502SS..Hα-helixtrans-57.9-48174.8-87.5174.1000112.1I45 W46 F52 A53 I76I45-L49 HydrophobicContact CG2-CD1 4.01Å; I45-L49 WeakPolarHBondContact O-CB 3.33Å; I45-L49 WeakPolarHBondContact O-CG 3.42Å; I45-L49 PolarHBondContact O-N 3.44Å; W46-L49 WeakPolarHBondContact O-CB 3.46Å; W46-L49 PolarHBondContact O-N 2.59Å; L49-F52 PolarHBondContact O-N 2.93Å; L49-A53 VanDerWaalsContact O-CB 3.22Å; L49-A53 WeakPolarHBondContact O-CB 3.23Å; L49-A53 PolarHBondContact O-N 3.23Å; L49-I76 HydrophobicContact CD1-CD1 3.7Å; L49-I76 HydrophobicContact CD2-CD1 3.43Å; L49-I76 VanDerWaalsContact CD2-CD1 3.43Å; L49-I76 HydrophobicContact CG-CD1 3.71Å
50A93.6Very high89.8Confident20 Ų2089.8 Ų89.817%0.16548%0.484CS..Hα-helixtrans-60.5-47.2177.900000110.8W46 L47 F52 A53 F54W46-A50 HydrophobicContact CE3-CB 4.4Å; W46-A50 HydrophobicContact CZ3-CB 4.25Å; W46-A50 WeakPolarHBondContact O-CB 3.42Å; W46-A50 PolarHBondContact O-N 3.14Å; L47-A50 PolarHBondContact O-N 3.38Å; A50-F52 PolarHBondContact O-N 3.47Å; A50-A53 PolarHBondContact O-N 2.72Å; A50-F54 HydrophobicContact CB-CD2 4.37Å; A50-F54 HydrophobicContact CB-CE2 4.43Å; A50-F54 WeakPolarHBondContact O-CD2 3.38Å; A50-F54 PolarHBondContact O-N 3.39Å
51Y93.7Very high90Very high154 Ų15488.7 Ų88.760%0.60448%0.48SS*.Hα-helixtrans-55.7-50.3176.2175.9-97.9000111.8L47 C48 F54 S55L47-Y51 WeakPolarHBondContact O-CB 3.3Å; L47-Y51 PolarHBondContact O-N 3.45Å; C48-Y51 PolarHBondContact O-N 3.29Å; Y51-F54 PolarHBondContact O-N 3.3Å; Y51-S55 WeakPolarHBondContact O-CB 3.36Å; Y51-S55 PolarHBondContact O-N 3.4Å; Y51-S55 PolarHBondContact O-OG 2.84Å
52F90.9Very high90.2Very high127 Ų12792.1 Ų92.156%0.55750%0.496SS*.Hα-helixtrans-69.5-31.9179-76.1-65.2000113.2C48 L49 A50 S55 R56C48-F52 WeakPolarHBondContact O-CD2 3.37Å; C48-F52 PolarHBondContact O-N 2.84Å; L49-F52 PolarHBondContact O-N 2.93Å; A50-F52 PolarHBondContact O-N 3.47Å; F52-S55 WeakPolarHBondContact CA-OG 3.22Å; F52-R56 VanDerWaalsContact O-CD 3.29Å; F52-R56 WeakPolarHBondContact O-CD 3.47Å; F52-R56 WeakPolarHBondContact O-CG 3.04Å
53A88.9Confident90.1Very high69 Ų6993.5 Ų93.557%0.5750%0.499SS*.Hα-helixtrans-67.3-39.8176.100000111.8L49 A50L49-A53 VanDerWaalsContact O-CB 3.22Å; L49-A53 WeakPolarHBondContact O-CB 3.23Å; L49-A53 PolarHBondContact O-N 3.23Å; A50-A53 PolarHBondContact O-N 2.72Å
54F90.7Very high89.9Confident183 Ų18394.7 Ų94.780%0.80350%0.5SS*.Hα-helixtrans-92.6-16-176.7-67.6-66.1000114.9A50 Y51A50-F54 HydrophobicContact CB-CD2 4.37Å; A50-F54 HydrophobicContact CB-CE2 4.43Å; A50-F54 WeakPolarHBondContact O-CD2 3.38Å; A50-F54 PolarHBondContact O-N 3.39Å; Y51-F54 PolarHBondContact O-N 3.3Å
55S89.4Confident89.9Confident63 Ų6393.5 Ų93.544%0.44149%0.491SS..Hα-helixtrans-88.7-8.8178.757.30000114.5Y51 F52Y51-S55 WeakPolarHBondContact O-CB 3.36Å; Y51-S55 PolarHBondContact O-N 3.4Å; Y51-S55 PolarHBondContact O-OG 2.84Å; F52-S55 WeakPolarHBondContact CA-OG 3.22Å
56R86.3Confident89.9Confident81 Ų8197 Ų9731%0.30651%0.509SS..SBendtrans-80.6137.5-177.9-74.8172.976.397.4-1111.9F52 N65 H68F52-R56 VanDerWaalsContact O-CD 3.29Å; F52-R56 WeakPolarHBondContact O-CD 3.47Å; F52-R56 WeakPolarHBondContact O-CG 3.04Å; R56-N65 PolarHBondContact NH2-OD1 3.37Å; R56-H68 PolarHBondContact NH1-CD2 3.2Å; R56-H68 VanDerWaalsContact NH1-CD2 3.28Å; R56-H68 PolarHBondContact NH2-CD2 3.01Å; R56-H68 VanDerWaalsContact NH2-CD2 3.33Å
57S82.7Confident89.8Confident62 Ų6293 Ų9343%0.43450%0.495SS..  trans-70.3141.2174.369.50000111.1T59S57-T59 PolarHBondContact O-N 3.47Å; S57-T59 VanDerWaalsContact O-N 3.15Å; S57-T59 PolarHBondContact OG-OG1 2.93Å
58S81.7Confident89.6Confident127 Ų12792.1 Ų92.189%0.88849%0.488SS*.THydrogen-bonded Turntrans-68.9-6175.952.80000113.9
59T87.2Confident89.6Confident124 Ų12491.5 Ų91.576%0.76149%0.487SS*.THydrogen-bonded Turntrans-94.1-0.1-174.754.30000114.3S57S57-T59 PolarHBondContact O-N 3.47Å; S57-T59 VanDerWaalsContact O-N 3.15Å; S57-T59 PolarHBondContact OG-OG1 2.93Å
60Q85.1Confident89.6Confident59 Ų5992.6 Ų92.628%0.27649%0.489SS..  trans-71.9144.6-179.3-67.7-173-31.100112.2N65Q60-N65 WeakPolarHBondContact CB-OD1 3.49Å; Q60-N65 PolarHBondContact O-ND2 3.4Å; Q60-N65 PolarHBondContact OE1-OD1 3.41Å
61S91.3Very high89.5Confident55 Ų5595.2 Ų95.239%0.38550%0.499SS..  trans-63.6152.417766.10000111.9Q63 Q64 N65S61-Q63 PolarHBondContact O-N 3.46Å; S61-Q64 PolarHBondContact O-N 2.93Å; S61-Q64 WeakPolarHBondContact OG-CB 3.18Å; S61-Q64 VanDerWaalsContact OG-CD 3.3Å; S61-Q64 VanDerWaalsContact OG-CG 3.3Å; S61-Q64 WeakPolarHBondContact OG-CG 3.34Å; S61-Q64 PolarHBondContact OG-N 3.24Å; S61-Q64 PolarHBondContact OG-OE1 2.95Å; S61-N65 PolarHBondContact O-N 3.25Å; S61-N65 PolarHBondContact O-ND2 3.19Å
62L90.9Very high89.5Confident126 Ų12689.7 Ų89.766%0.6649%0.486SS*.Hα-helixtrans-53.7-43.3175.817762000111.9Q64 N65 L66L62-Q64 PolarHBondContact O-N 3.49Å; L62-N65 PolarHBondContact O-N 3.16Å; L62-L66 HydrophobicContact CD1-CD1 4.1Å; L62-L66 HydrophobicContact CD1-CG 4.04Å; L62-L66 HydrophobicContact CG-CD1 4.02Å; L62-L66 HydrophobicContact CG-CG 4.36Å; L62-L66 WeakPolarHBondContact O-CG 3.42Å; L62-L66 PolarHBondContact O-N 3.48Å
63Q89.7Confident89.7Confident131 Ų13188.1 Ų88.161%0.61249%0.486SS*.Hα-helixtrans-60.5-44.4179.7-70.4-179.7-7.600112.1S61 L66 Y67 W129S61-Q63 PolarHBondContact O-N 3.46Å; Q63-L66 PolarHBondContact O-N 3.17Å; Q63-Y67 WeakPolarHBondContact O-CB 3.46Å; Q63-Y67 PolarHBondContact O-N 3.36Å; Q63-W129 WeakPolarHBondContact O-CZ2 3.45Å
64Q88.7Confident90Very high97 Ų9785.8 Ų85.845%0.45347%0.466SS..Hα-helixtrans-66.9-39.4176.3-72.6166.7-29.200111.5S61 L62 Y67 H68S61-Q64 PolarHBondContact O-N 2.93Å; S61-Q64 WeakPolarHBondContact OG-CB 3.18Å; S61-Q64 VanDerWaalsContact OG-CD 3.3Å; S61-Q64 VanDerWaalsContact OG-CG 3.3Å; S61-Q64 WeakPolarHBondContact OG-CG 3.34Å; S61-Q64 PolarHBondContact OG-N 3.24Å; S61-Q64 PolarHBondContact OG-OE1 2.95Å; L62-Q64 PolarHBondContact O-N 3.49Å; Q64-Y67 PolarHBondContact O-N 3.17Å; Q64-H68 PolarHBondContact O-CD2 2.9Å; Q64-H68 PolarHBondContact O-N 3.33Å
65N91.5Very high90.2Very high57 Ų5780.9 Ų80.931%0.30545%0.45SS..Hα-helixtrans-60.4-46.4175.8-71.7-29.5000112R56 Q60 S61 L62 A69R56-N65 PolarHBondContact NH2-OD1 3.37Å; Q60-N65 WeakPolarHBondContact CB-OD1 3.49Å; Q60-N65 PolarHBondContact O-ND2 3.4Å; Q60-N65 PolarHBondContact OE1-OD1 3.41Å; S61-N65 PolarHBondContact O-N 3.25Å; S61-N65 PolarHBondContact O-ND2 3.19Å; L62-N65 PolarHBondContact O-N 3.16Å; N65-A69 VanDerWaalsContact O-CB 3.28Å; N65-A69 WeakPolarHBondContact O-CB 3.41Å; N65-A69 PolarHBondContact O-N 3.12Å
66L92Very high90.4Very high94 Ų9479.7 Ų79.749%0.49244%0.439SS..Hα-helixtrans-65-40176.4-68.9176.4000112.4L62 Q63 A69 F70 W129L62-L66 HydrophobicContact CD1-CD1 4.1Å; L62-L66 HydrophobicContact CD1-CG 4.04Å; L62-L66 HydrophobicContact CG-CD1 4.02Å; L62-L66 HydrophobicContact CG-CG 4.36Å; L62-L66 WeakPolarHBondContact O-CG 3.42Å; L62-L66 PolarHBondContact O-N 3.48Å; Q63-L66 PolarHBondContact O-N 3.17Å; L66-A69 PolarHBondContact O-N 2.8Å; L66-F70 WeakPolarHBondContact O-CB 3.4Å; L66-F70 PolarHBondContact O-N 3.29Å; L66-W129 HydrophobicContact CB-CH2 4.23Å; L66-W129 HydrophobicContact CB-CZ2 4.05Å
67Y90.9Very high90.8Very high88 Ų8878.4 Ų78.435%0.34544%0.435SS..Hα-helixtrans-59.8-51.4178177.7-98.7000110.8Q63 Q64 A69 F70 I71 W129Q63-Y67 WeakPolarHBondContact O-CB 3.46Å; Q63-Y67 PolarHBondContact O-N 3.36Å; Q64-Y67 PolarHBondContact O-N 3.17Å; Y67-A69 VanDerWaalsContact C-N 3.35Å; Y67-A69 PolarHBondContact O-N 3Å; Y67-F70 PolarHBondContact O-N 3Å; Y67-I71 HydrophobicContact CD1-CG1 4.48Å; Y67-I71 HydrophobicContact CE1-CG1 4.12Å; Y67-I71 WeakPolarHBondContact O-CG1 3.41Å; Y67-I71 PolarHBondContact O-N 2.99Å; Y67-W129 HydrophobicContact CD2-CZ2 4.45Å
68H90.8Very high91.3Very high80 Ų8077.9 Ų77.937%0.3743%0.427SS..Hα-helixtrans-67-35.4178.9-72-65.8000113R56 Q64 I71 A72R56-H68 PolarHBondContact NH1-CD2 3.2Å; R56-H68 VanDerWaalsContact NH1-CD2 3.28Å; R56-H68 PolarHBondContact NH2-CD2 3.01Å; R56-H68 VanDerWaalsContact NH2-CD2 3.33Å; Q64-H68 PolarHBondContact O-CD2 2.9Å; Q64-H68 PolarHBondContact O-N 3.33Å; H68-I71 PolarHBondContact O-N 2.99Å; H68-A72 WeakPolarHBondContact O-CB 3.41Å; H68-A72 PolarHBondContact O-N 2.92Å
69A92.5Very high91.8Very high51 Ų5175.4 Ų75.442%0.42140%0.404SS..Hα-helixtrans-61.5-45.4173.600000111.2N65 L66 Y67 I71 A72 V73N65-A69 VanDerWaalsContact O-CB 3.28Å; N65-A69 WeakPolarHBondContact O-CB 3.41Å; N65-A69 PolarHBondContact O-N 3.12Å; L66-A69 PolarHBondContact O-N 2.8Å; Y67-A69 VanDerWaalsContact C-N 3.35Å; Y67-A69 PolarHBondContact O-N 3Å; A69-I71 PolarHBondContact O-N 3.45Å; A69-A72 PolarHBondContact O-N 2.93Å; A69-V73 WeakPolarHBondContact O-CG2 3.45Å; A69-V73 PolarHBondContact O-N 3.27Å
70F92.5Very high92Very high97 Ų9773 Ų7343%0.42539%0.386SS..Hα-helixtrans-60.8-46177.5-177.7-100.6000112L66 Y67 A72 V73 C74L66-F70 WeakPolarHBondContact O-CB 3.4Å; L66-F70 PolarHBondContact O-N 3.29Å; Y67-F70 PolarHBondContact O-N 3Å; F70-A72 PolarHBondContact O-N 3.2Å; F70-V73 PolarHBondContact O-N 3.43Å; F70-C74 PolarHBondContact O-N 3.05Å; F70-C74 PolarHBondContact O-SG 2.78Å
71I92.9Very high92.3Very high74 Ų7470.2 Ų70.238%0.37937%0.373SS..Hα-helixtrans-59.9-46.2175.4-64.4-61.9000111.1Y67 H68 A69 V73 C74 V75Y67-I71 HydrophobicContact CD1-CG1 4.48Å; Y67-I71 HydrophobicContact CE1-CG1 4.12Å; Y67-I71 WeakPolarHBondContact O-CG1 3.41Å; Y67-I71 PolarHBondContact O-N 2.99Å; H68-I71 PolarHBondContact O-N 2.99Å; A69-I71 PolarHBondContact O-N 3.45Å; I71-V73 PolarHBondContact O-N 2.77Å; I71-C74 PolarHBondContact O-N 2.86Å; I71-V75 HydrophobicContact CG2-CG2 4.34Å; I71-V75 WeakPolarHBondContact O-CG2 3.43Å; I71-V75 PolarHBondContact O-N 2.94Å
72A93.2Very high92.2Very high38 Ų3869.5 Ų69.531%0.31437%0.366SS..Hα-helixtrans-60.2-45.517900000111.9H68 A69 F70 C74 V75 I76H68-A72 WeakPolarHBondContact O-CB 3.41Å; H68-A72 PolarHBondContact O-N 2.92Å; A69-A72 PolarHBondContact O-N 2.93Å; F70-A72 PolarHBondContact O-N 3.2Å; A72-C74 PolarHBondContact O-N 3.49Å; A72-V75 PolarHBondContact O-N 3.49Å; A72-I76 WeakPolarHBondContact O-CB 3.47Å; A72-I76 WeakPolarHBondContact O-CD1 3.06Å; A72-I76 VanDerWaalsContact O-CG1 3.31Å; A72-I76 WeakPolarHBondContact O-CG1 3.48Å; A72-I76 PolarHBondContact O-N 3.3Å
73V95Very high92Very high95 Ų9566.7 Ų66.758%0.57635%0.35SS*.Hα-helixtrans-59.4-46.2176.1170.70000110.9A69 F70 I71 V75 I76 F77A69-V73 WeakPolarHBondContact O-CG2 3.45Å; A69-V73 PolarHBondContact O-N 3.27Å; F70-V73 PolarHBondContact O-N 3.43Å; I71-V73 PolarHBondContact O-N 2.77Å; V73-V75 PolarHBondContact O-N 3.25Å; V73-I76 PolarHBondContact O-N 2.88Å; V73-F77 WeakPolarHBondContact O-CB 3.48Å; V73-F77 PolarHBondContact O-N 2.94Å
74C95.4Very high92Very high20 Ų2066.4 Ų66.414%0.13535%0.352CS..Hα-helixtrans-61.5-45.5178.4-66.70000112.1F70 I71 A72 F77 L78 L107F70-C74 PolarHBondContact O-N 3.05Å; F70-C74 PolarHBondContact O-SG 2.78Å; I71-C74 PolarHBondContact O-N 2.86Å; A72-C74 PolarHBondContact O-N 3.49Å; C74-F77 PolarHBondContact O-N 2.99Å; C74-L78 WeakPolarHBondContact O-CG 3.46Å; C74-L78 PolarHBondContact O-N 3.41Å; C74-L107 HydrophobicContact CB-CD2 4.02Å
75V93.8Very high92.1Very high79 Ų7963.3 Ų63.348%0.47934%0.338SS..Hα-helixtrans-62.4-47.7179.1170.60000111I71 A72 V73 F77 L78 L79I71-V75 HydrophobicContact CG2-CG2 4.34Å; I71-V75 WeakPolarHBondContact O-CG2 3.43Å; I71-V75 PolarHBondContact O-N 2.94Å; A72-V75 PolarHBondContact O-N 3.49Å; V73-V75 PolarHBondContact O-N 3.25Å; V75-F77 VanDerWaalsContact C-N 3.34Å; V75-F77 PolarHBondContact O-N 3.42Å; V75-L78 PolarHBondContact O-N 2.8Å; V75-L79 HydrophobicContact CG1-CD1 4.18Å; V75-L79 WeakPolarHBondContact O-CG 3.5Å; V75-L79 PolarHBondContact O-N 2.91Å
76I93.6Very high91.9Very high38 Ų3862 Ų6220%0.19533%0.332CS..Hα-helixtrans-64.7-41.3179.8-69160000110.9I45 L49 A72 V73 L78 L79 I80I45-I76 HydrophobicContact CG2-CG1 4.26Å; I45-I76 HydrophobicContact CG2-CG2 4.36Å; L49-I76 HydrophobicContact CD1-CD1 3.7Å; L49-I76 HydrophobicContact CD2-CD1 3.43Å; L49-I76 VanDerWaalsContact CD2-CD1 3.43Å; L49-I76 HydrophobicContact CG-CD1 3.71Å; A72-I76 WeakPolarHBondContact O-CB 3.47Å; A72-I76 WeakPolarHBondContact O-CD1 3.06Å; A72-I76 VanDerWaalsContact O-CG1 3.31Å; A72-I76 WeakPolarHBondContact O-CG1 3.48Å; A72-I76 PolarHBondContact O-N 3.3Å; V73-I76 PolarHBondContact O-N 2.88Å; I76-L78 VanDerWaalsContact C-N 3.32Å; I76-L78 PolarHBondContact O-N 3.3Å; I76-L79 PolarHBondContact O-N 3.28Å; I76-I80 HydrophobicContact CG2-CD1 3.71Å; I76-I80 HydrophobicContact CG2-CG1 4.27Å; I76-I80 WeakPolarHBondContact O-CB 3.42Å; I76-I80 VanDerWaalsContact O-CG1 3.31Å; I76-I80 WeakPolarHBondContact O-CG1 3.07Å; I76-I80 PolarHBondContact O-N 3.3Å
77F95.4Very high91.7Very high54 Ų5458.7 Ų58.724%0.23732%0.315CS..Hα-helixtrans-57.4-44.6175.3-179.7-83.4000111.7V73 C74 V75 I80 S81 G103 L106 L107V73-F77 WeakPolarHBondContact O-CB 3.48Å; V73-F77 PolarHBondContact O-N 2.94Å; C74-F77 PolarHBondContact O-N 2.99Å; V75-F77 VanDerWaalsContact C-N 3.34Å; V75-F77 PolarHBondContact O-N 3.42Å; F77-I80 PolarHBondContact O-N 3.02Å; F77-S81 WeakPolarHBondContact O-CB 3.47Å; F77-S81 PolarHBondContact O-N 3.09Å; F77-S81 PolarHBondContact O-OG 3.28Å; F77-G103 VanDerWaalsContact CE1-O 3.3Å; F77-G103 WeakPolarHBondContact CE1-O 3.29Å; F77-L106 HydrophobicContact CZ-CB 4.3Å; F77-L106 HydrophobicContact CZ-CD2 3.95Å; F77-L106 HydrophobicContact CZ-CG 4.06Å; F77-L107 HydrophobicContact CD1-CB 4.16Å; F77-L107 HydrophobicContact CD1-CD1 4.47Å; F77-L107 HydrophobicContact CE1-CB 3.94Å
78L94.1Very high91.7Very high51 Ų5155 Ų5527%0.26730%0.303SS..Hα-helixtrans-67.5-37.8177.1-68176.3000112.4C74 V75 I76 S81 V82 I100 A104C74-L78 WeakPolarHBondContact O-CG 3.46Å; C74-L78 PolarHBondContact O-N 3.41Å; V75-L78 PolarHBondContact O-N 2.8Å; I76-L78 VanDerWaalsContact C-N 3.32Å; I76-L78 PolarHBondContact O-N 3.3Å; L78-S81 WeakPolarHBondContact O-CB 3.31Å; L78-S81 PolarHBondContact O-N 3.3Å; L78-V82 PolarHBondContact O-N 2.99Å; L78-I100 HydrophobicContact CD2-CG2 4.49Å; L78-A104 HydrophobicContact CD2-CB 4.01Å
79L91.8Very high91.6Very high76 Ų7651.4 Ų51.440%0.39829%0.287SS..Hα-helixtrans-64-44.5174.4-70.7173.9000112I45 V75 I76 S81 V82I45-L79 HydrophobicContact CD1-CB 4.04Å; I45-L79 HydrophobicContact CD1-CD1 4.2Å; I45-L79 HydrophobicContact CG1-CD1 3.93Å; V75-L79 HydrophobicContact CG1-CD1 4.18Å; V75-L79 WeakPolarHBondContact O-CG 3.5Å; V75-L79 PolarHBondContact O-N 2.91Å; I76-L79 PolarHBondContact O-N 3.28Å; L79-S81 VanDerWaalsContact C-N 3.26Å; L79-S81 PolarHBondContact O-N 3.31Å; L79-V82 WeakPolarHBondContact O-CB 3.42Å; L79-V82 PolarHBondContact O-N 3.27Å
80I91Very high91.4Very high73 Ų7351.1 Ų51.137%0.37428%0.276SS..Hα-helixtrans-62.6-38174.3-68.4171000110.2I76 F77 V82 M83 I84I76-I80 HydrophobicContact CG2-CD1 3.71Å; I76-I80 HydrophobicContact CG2-CG1 4.27Å; I76-I80 WeakPolarHBondContact O-CB 3.42Å; I76-I80 VanDerWaalsContact O-CG1 3.31Å; I76-I80 WeakPolarHBondContact O-CG1 3.07Å; I76-I80 PolarHBondContact O-N 3.3Å; F77-I80 PolarHBondContact O-N 3.02Å; I80-V82 VanDerWaalsContact C-N 3.29Å; I80-V82 PolarHBondContact O-N 3.18Å; I80-M83 WeakPolarHBondContact O-CB 3.07Å; I80-M83 PolarHBondContact O-N 3.06Å; I80-I84 HydrophobicContact CG2-CD1 3.49Å; I80-I84 VanDerWaalsContact CG2-CD1 3.49Å; I80-I84 HydrophobicContact CG2-CG1 4.11Å; I80-I84 PolarHBondContact O-N 3.11Å
81S91.9Very high91Very high1 Ų147.2 Ų47.21%0.00726%0.26CS..Hα-helixtrans-59.3-39.3178.6-62.90000112F77 L78 L79 M83 I84 M85 G103F77-S81 WeakPolarHBondContact O-CB 3.47Å; F77-S81 PolarHBondContact O-N 3.09Å; F77-S81 PolarHBondContact O-OG 3.28Å; L78-S81 WeakPolarHBondContact O-CB 3.31Å; L78-S81 PolarHBondContact O-N 3.3Å; L79-S81 VanDerWaalsContact C-N 3.26Å; L79-S81 PolarHBondContact O-N 3.31Å; S81-M83 PolarHBondContact O-N 3.11Å; S81-M83 VanDerWaalsContact O-N 3.17Å; S81-I84 PolarHBondContact O-N 3.3Å; S81-M85 WeakPolarHBondContact O-CB 3.33Å; S81-M85 WeakPolarHBondContact O-CG 3.44Å; S81-M85 PolarHBondContact O-N 3.1Å; S81-G103 WeakPolarHBondContact OG-CA 3.19Å
82V89.7Confident90.5Very high40 Ų4045 Ų4524%0.24225%0.247CC..Hα-helixtrans-56.8-31.4173.6175.50000112.3L78 L79 I80 A96 R99 I100L78-V82 PolarHBondContact O-N 2.99Å; L79-V82 WeakPolarHBondContact O-CB 3.42Å; L79-V82 PolarHBondContact O-N 3.27Å; I80-V82 VanDerWaalsContact C-N 3.29Å; I80-V82 PolarHBondContact O-N 3.18Å; V82-A96 HydrophobicContact CG1-CB 3.95Å; V82-R99 WeakPolarHBondContact O-CD 3.39Å; V82-R99 PolarHBondContact O-NH1 3.24Å; V82-I100 HydrophobicContact CG2-CD1 3.75Å; V82-I100 HydrophobicContact CG2-CG1 3.34Å
83M86Confident90Very high66 Ų6645.1 Ų45.133%0.32524%0.244SC..Hα-helixtrans-87.7-40.3-174.8-64174.451.800112.9T38 V41 I80 S81T38-M83 HydrophobicContact CG2-CE 3.72Å; V41-M83 HydrophobicContact CB-SD 3.95Å; V41-M83 HydrophobicContact CG1-SD 3.53Å; V41-M83 VanDerWaalsContact CG1-SD 3.53Å; I80-M83 WeakPolarHBondContact O-CB 3.07Å; I80-M83 PolarHBondContact O-N 3.06Å; S81-M83 PolarHBondContact O-N 3.11Å; S81-M83 VanDerWaalsContact O-N 3.17Å
84I88.7Confident89.5Confident126 Ų12643 Ų4365%0.64623%0.228SC*.Hα-helixtrans-101.3-33.7-167.4-57.7-177.9000112.5I80 S81I80-I84 HydrophobicContact CG2-CD1 3.49Å; I80-I84 VanDerWaalsContact CG2-CD1 3.49Å; I80-I84 HydrophobicContact CG2-CG1 4.11Å; I80-I84 PolarHBondContact O-N 3.11Å; S81-I84 PolarHBondContact O-N 3.3Å
85M90.5Very high89.1Confident32 Ų3242.3 Ų42.316%0.15822%0.223CC..SBendtrans-71.9153.2-169.8-60.4-59.6177.500112.3S81 R99 F102 L106S81-M85 WeakPolarHBondContact O-CB 3.33Å; S81-M85 WeakPolarHBondContact O-CG 3.44Å; S81-M85 PolarHBondContact O-N 3.1Å; M85-R99 HydrophobicContact CB-CB 4.24Å; M85-R99 HydrophobicContact CB-CG 4.36Å; M85-R99 WeakPolarHBondContact O-CD 3.31Å; M85-R99 WeakPolarHBondContact O-CG 3.16Å; M85-R99 PolarHBondContact O-NE 3.4Å; M85-F102 HydrophobicContact CB-CB 4.47Å; M85-F102 HydrophobicContact CB-CD1 4Å; M85-F102 HydrophobicContact CB-CG 4.4Å; M85-F102 HydrophobicContact CE-CD1 4.46Å; M85-F102 HydrophobicContact CE-CE1 4.49Å; M85-F102 HydrophobicContact CG-CD1 3.78Å; M85-F102 HydrophobicContact CG-CE1 4.41Å; M85-F102 HydrophobicContact SD-CD1 3.53Å; M85-F102 VanDerWaalsContact SD-CD1 3.53Å; M85-F102 HydrophobicContact SD-CE1 3.56Å; M85-F102 VanDerWaalsContact SD-CE1 3.56Å; M85-L106 HydrophobicContact CE-CD2 4.01Å
86P89.1Confident88.9Confident28 Ų2839.7 Ų39.718%0.18221%0.21CC..  trans-59.9152.7176.324.7-34.6000112E21 G88 R99 F102E21-P86 VanDerWaalsContact O-CB 3.27Å; E21-P86 WeakPolarHBondContact O-CB 3.39Å; P86-G88 PolarHBondContact O-N 3.41Å; P86-R99 VanDerWaalsContact O-CG 3.29Å; P86-R99 WeakPolarHBondContact O-CG 3.42Å; P86-F102 HydrophobicContact CG-CD2 4.2Å; P86-F102 HydrophobicContact CG-CE2 4.21Å
87N86.9Confident88.8Confident26 Ų2641.6 Ų41.614%0.13922%0.22CC..  trans-64.6-29.4175.2-72.4-17.4000112.1E21 Q23 P95 W98 R99E21-N87 PolarHBondContact O-N 3.13Å; E21-N87 VanDerWaalsContact O-N 3.11Å; Q23-N87 PolarHBondContact O-ND2 3.06Å; N87-P95 HydrophobicContact CB-CB 4.33Å; N87-W98 WeakPolarHBondContact O-CB 3.48Å; N87-R99 PolarHBondContact OD1-NE 2.9Å; N87-R99 PolarHBondContact OD1-NH2 2.92Å
88G90.5Very high88.7Confident9 Ų940.6 Ų40.69%0.09322%0.215CC..BIsolated β-bridgetrans74.7-168.4-167.900000112.5I20 E21 P86 F90I20-G88 CarbonylContact O-C 3.57Å; I20-G88 VanDerWaalsContact O-C 3.3Å; E21-G88 PolarHBondContact O-N 3.45Å; P86-G88 PolarHBondContact O-N 3.41Å; G88-F90 VanDerWaalsContact C-N 3.3Å; G88-F90 PolarHBondContact O-N 3.1Å
89P90Very high88.7Confident6 Ų641.4 Ų41.44%0.03921%0.214CC..SBendtrans-87.99.3-171.737.9-40.8000113.8Q23 P331 R334 Q335Q23-P89 PolarHBondContact OE1-O 3.24Å; P89-P331 HydrophobicContact CG-CB 3.81Å; P89-R334 HydrophobicContact CB-CB 4.45Å; P89-R334 HydrophobicContact CB-CG 3.76Å; P89-R334 HydrophobicContact CG-CB 4.12Å; P89-R334 HydrophobicContact CG-CG 3.98Å; P89-Q335 HydrophobicContact CB-CG 4.42Å; P89-Q335 HydrophobicContact CG-CG 4.03Å
90F87.8Confident88.8Confident44 Ų4440.9 Ų40.919%0.19321%0.211CC..  trans-128.8131.1-177-64.4-42.4000111.8G88 W98 A330 P331 R334G88-F90 VanDerWaalsContact C-N 3.3Å; G88-F90 PolarHBondContact O-N 3.1Å; F90-W98 HydrophobicContact CB-CD2 4.15Å; F90-W98 HydrophobicContact CB-CG 4.27Å; F90-W98 HydrophobicContact CB-CZ2 3.98Å; F90-W98 VanDerWaalsContact CB-NE1 3.29Å; F90-W98 HydrophobicContact CD2-CD2 4.11Å; F90-W98 AromaticContact CD2-CE2 3.76Å; F90-W98 HydrophobicContact CD2-CE3 4.22Å; F90-W98 AromaticContact CD2-CH2 3.7Å; F90-W98 HydrophobicContact CD2-CH2 3.7Å; F90-W98 AromaticContact CD2-CZ2 3.55Å; F90-W98 HydrophobicContact CD2-CZ2 3.55Å; F90-W98 HydrophobicContact CD2-CZ3 4.04Å; F90-W98 HydrophobicContact CE2-CH2 4.14Å; F90-W98 HydrophobicContact CE2-CZ2 4.35Å; F90-W98 HydrophobicContact CE2-CZ3 4.48Å; F90-W98 HydrophobicContact CG-CZ2 4.09Å; F90-A330 VanDerWaalsContact CE2-C 3.45Å; F90-A330 HydrophobicContact CE2-CB 3.93Å; F90-P331 HydrophobicContact CD2-CB 4.19Å; F90-P331 HydrophobicContact CE2-CB 4.14Å; F90-R334 HydrophobicContact CE1-CB 4.05Å; F90-R334 HydrophobicContact CE1-CG 3.97Å; F90-R334 HydrophobicContact CZ-CB 3.79Å; F90-R334 HydrophobicContact CZ-CG 4.24Å
91I83.6Confident89.1Confident16 Ų1637.9 Ų37.98%0.08220%0.196CC..  trans-85.6-36.4174.8-65.2161.5000111.9Q23 K24 V25 H94 P95 R268Q23-I91 HydrophobicContact CB-CG1 4.35Å; Q23-I91 HydrophobicContact CG-CD1 3.92Å; Q23-I91 HydrophobicContact CG-CG1 3.88Å; K24-I91 VanDerWaalsContact O-CD1 3.22Å; K24-I91 WeakPolarHBondContact O-CD1 3.25Å; V25-I91 HydrophobicContact CB-CG2 4.38Å; V25-I91 HydrophobicContact CG1-CG2 3.84Å; V25-I91 HydrophobicContact CG2-CG1 4.35Å; V25-I91 HydrophobicContact CG2-CG2 3.97Å; I91-H94 CarbonylContact O-C 3.53Å; I91-H94 WeakPolarHBondContact O-CA 3.4Å; I91-P95 VanDerWaalsContact O-CD 3.27Å; I91-P95 WeakPolarHBondContact O-CD 3.26Å; I91-R268 HydrophobicContact CD1-CG 4.49Å
92R83Confident89.3Confident28 Ų2839 Ų3911%0.10620%0.201CC..SBendtrans-107.5149.1-173.1-69.7-66.4-161.2-126.4-3.1111.3W98 R268R92-W98 WeakPolarHBondContact O-CZ2 3.21Å; R92-W98 PolarHBondContact O-NE1 3.49Å; R92-R268 HydrophobicContact CG-CB 3.96Å
93P82Confident89.7Confident39 Ų3937.1 Ų37.125%0.25319%0.19SC..SBendcis-70.7-30.1428.9-35.7000113.4L97 Q264 F265P93-L97 HydrophobicContact CG-CD2 3.34Å; P93-Q264 PolarHBondContact O-NE2 3.27Å; P93-F265 HydrophobicContact CB-CD1 4.14Å
94H84.8Confident90.2Very high51 Ų5135 Ų3524%0.23618%0.182CC..  trans-159.4145.5170.9-165.6-95.3000110.8Y34 I91 A96 L97Y34-H94 AromaticContact CE1-NE2 3.82Å; Y34-H94 AromaticContact CE2-NE2 3.92Å; Y34-H94 AromaticContact CZ-CD2 3.85Å; Y34-H94 AromaticContact CZ-NE2 3.61Å; I91-H94 CarbonylContact O-C 3.53Å; I91-H94 WeakPolarHBondContact O-CA 3.4Å; H94-A96 VanDerWaalsContact C-N 3.25Å; H94-A96 WeakPolarHBondContact ND1-CB 3.29Å; H94-A96 PolarHBondContact ND1-N 3.01Å; H94-A96 PolarHBondContact O-N 2.93Å; H94-L97 WeakPolarHBondContact O-CB 3.29Å; H94-L97 PolarHBondContact O-N 3.08Å
95P87Confident90.7Very high6 Ų629 Ų294%0.03915%0.151CC..Hα-helixtrans-58.8-35.4176.9-23.132.8000113.4V25 Y34 N87 I91 L97 W98 R99V25-P95 HydrophobicContact CG2-CG 3.62Å; Y34-P95 HydrophobicContact CE1-CG 4.18Å; N87-P95 HydrophobicContact CB-CB 4.33Å; I91-P95 VanDerWaalsContact O-CD 3.27Å; I91-P95 WeakPolarHBondContact O-CD 3.26Å; P95-L97 PolarHBondContact O-N 3.3Å; P95-W98 PolarHBondContact O-N 2.92Å; P95-W98 VanDerWaalsContact O-N 3.09Å; P95-R99 WeakPolarHBondContact O-CG 3.27Å; P95-R99 PolarHBondContact O-N 3.03Å
96A88.9Confident91Very high24 Ų2429.7 Ų29.720%0.19816%0.156CC..Hα-helixtrans-58.3-34.3176.300000112.9V82 H94 R99 I100V82-A96 HydrophobicContact CG1-CB 3.95Å; H94-A96 VanDerWaalsContact C-N 3.25Å; H94-A96 WeakPolarHBondContact ND1-CB 3.29Å; H94-A96 PolarHBondContact ND1-N 3.01Å; H94-A96 PolarHBondContact O-N 2.93Å; A96-R99 PolarHBondContact O-N 2.89Å; A96-I100 VanDerWaalsContact O-CG1 3.28Å; A96-I100 WeakPolarHBondContact O-CG1 3.17Å; A96-I100 PolarHBondContact O-N 3.06Å
97L91.4Very high91.4Very high77 Ų7730 Ų3040%0.40316%0.155SC..Hα-helixtrans-62.9-47.8175.3-178.773.9000110.2P93 H94 P95 R99 I100 V101P93-L97 HydrophobicContact CG-CD2 3.34Å; H94-L97 WeakPolarHBondContact O-CB 3.29Å; H94-L97 PolarHBondContact O-N 3.08Å; P95-L97 PolarHBondContact O-N 3.3Å; L97-R99 VanDerWaalsContact C-N 3.31Å; L97-R99 PolarHBondContact O-N 3.44Å; L97-I100 CarbonylContact O-C 3.3Å; L97-I100 WeakPolarHBondContact O-CA 3.49Å; L97-I100 WeakPolarHBondContact O-CB 3.01Å; L97-I100 PolarHBondContact O-N 2.97Å; L97-I100 VanDerWaalsContact O-N 3.08Å; L97-V101 WeakPolarHBondContact O-CG2 3.33Å; L97-V101 PolarHBondContact O-N 2.86Å
98W93.1Very high91.9Very high34 Ų3430.7 Ų30.713%0.12916%0.156CC..Hα-helixtrans-66.7-33.3-179-59.4117.3000112.5N87 F90 R92 P95 V101 F102 A330 P331N87-W98 WeakPolarHBondContact O-CB 3.48Å; F90-W98 HydrophobicContact CB-CD2 4.15Å; F90-W98 HydrophobicContact CB-CG 4.27Å; F90-W98 HydrophobicContact CB-CZ2 3.98Å; F90-W98 VanDerWaalsContact CB-NE1 3.29Å; F90-W98 HydrophobicContact CD2-CD2 4.11Å; F90-W98 AromaticContact CD2-CE2 3.76Å; F90-W98 HydrophobicContact CD2-CE3 4.22Å; F90-W98 AromaticContact CD2-CH2 3.7Å; F90-W98 HydrophobicContact CD2-CH2 3.7Å; F90-W98 AromaticContact CD2-CZ2 3.55Å; F90-W98 HydrophobicContact CD2-CZ2 3.55Å; F90-W98 HydrophobicContact CD2-CZ3 4.04Å; F90-W98 HydrophobicContact CE2-CH2 4.14Å; F90-W98 HydrophobicContact CE2-CZ2 4.35Å; F90-W98 HydrophobicContact CE2-CZ3 4.48Å; F90-W98 HydrophobicContact CG-CZ2 4.09Å; R92-W98 WeakPolarHBondContact O-CZ2 3.21Å; R92-W98 PolarHBondContact O-NE1 3.49Å; P95-W98 PolarHBondContact O-N 2.92Å; P95-W98 VanDerWaalsContact O-N 3.09Å; W98-V101 HydrophobicContact CE3-CB 4.49Å; W98-V101 HydrophobicContact CE3-CG2 4.34Å; W98-V101 PolarHBondContact O-N 3.48Å; W98-F102 WeakPolarHBondContact O-CB 3.34Å; W98-F102 PolarHBondContact O-N 3.39Å; W98-A330 HydrophobicContact CH2-CB 4.42Å; W98-A330 HydrophobicContact CZ3-CB 4.46Å; W98-P331 HydrophobicContact CE3-CG 4.18Å; W98-P331 HydrophobicContact CZ3-CG 4.27Å
99R94.3Very high92.3Very high67 Ų6732 Ų3225%0.25316%0.16SC..Hα-helixtrans-64-39.1169.3-67.2-179.5-170.4-165.3-6.2112.7V82 M85 P86 N87 P95 A96 L97 F102 G103V82-R99 WeakPolarHBondContact O-CD 3.39Å; V82-R99 PolarHBondContact O-NH1 3.24Å; M85-R99 HydrophobicContact CB-CB 4.24Å; M85-R99 HydrophobicContact CB-CG 4.36Å; M85-R99 WeakPolarHBondContact O-CD 3.31Å; M85-R99 WeakPolarHBondContact O-CG 3.16Å; M85-R99 PolarHBondContact O-NE 3.4Å; P86-R99 VanDerWaalsContact O-CG 3.29Å; P86-R99 WeakPolarHBondContact O-CG 3.42Å; N87-R99 PolarHBondContact OD1-NE 2.9Å; N87-R99 PolarHBondContact OD1-NH2 2.92Å; P95-R99 WeakPolarHBondContact O-CG 3.27Å; P95-R99 PolarHBondContact O-N 3.03Å; A96-R99 PolarHBondContact O-N 2.89Å; L97-R99 VanDerWaalsContact C-N 3.31Å; L97-R99 PolarHBondContact O-N 3.44Å; R99-F102 PolarHBondContact O-N 3.36Å; R99-G103 PolarHBondContact O-N 2.98Å
100I94.7Very high92.7Very high65 Ų6535.9 Ų35.933%0.33318%0.18SC..Hα-helixtrans-65.2-43.5172.8-68.5164.5000110.3L78 V82 A96 L97 F102 G103 A104L78-I100 HydrophobicContact CD2-CG2 4.49Å; V82-I100 HydrophobicContact CG2-CD1 3.75Å; V82-I100 HydrophobicContact CG2-CG1 3.34Å; A96-I100 VanDerWaalsContact O-CG1 3.28Å; A96-I100 WeakPolarHBondContact O-CG1 3.17Å; A96-I100 PolarHBondContact O-N 3.06Å; L97-I100 CarbonylContact O-C 3.3Å; L97-I100 WeakPolarHBondContact O-CA 3.49Å; L97-I100 WeakPolarHBondContact O-CB 3.01Å; L97-I100 PolarHBondContact O-N 2.97Å; L97-I100 VanDerWaalsContact O-N 3.08Å; I100-F102 VanDerWaalsContact C-N 3.34Å; I100-F102 PolarHBondContact O-N 2.72Å; I100-G103 PolarHBondContact O-N 3.02Å; I100-A104 VanDerWaalsContact O-CB 3.31Å; I100-A104 WeakPolarHBondContact O-CB 3.43Å; I100-A104 PolarHBondContact O-N 2.93Å
101V96.4Very high93.1Very high11 Ų1136 Ų367%0.06719%0.186CC..Hα-helixtrans-60.4-44.8176.6171.80000110.6L97 W98 A104 S105 C327 I328L97-V101 WeakPolarHBondContact O-CG2 3.33Å; L97-V101 PolarHBondContact O-N 2.86Å; W98-V101 HydrophobicContact CE3-CB 4.49Å; W98-V101 HydrophobicContact CE3-CG2 4.34Å; W98-V101 PolarHBondContact O-N 3.48Å; V101-A104 PolarHBondContact O-N 3.44Å; V101-S105 WeakPolarHBondContact O-CB 3.34Å; V101-S105 PolarHBondContact O-N 2.9Å; V101-S105 PolarHBondContact O-OG 3.05Å; V101-C327 HydrophobicContact CG1-CB 4.16Å; V101-C327 HydrophobicContact CG2-CB 4.07Å; V101-I328 HydrophobicContact CG1-CG1 3.99Å
102F97.1Very high93.8Very high25 Ų2535.8 Ų35.811%0.1118%0.184CC..Hα-helixtrans-59-50173.9-171.4-77.7000111M85 P86 W98 R99 I100 A104 S105 L106 S350 Q351 L354M85-F102 HydrophobicContact CB-CB 4.47Å; M85-F102 HydrophobicContact CB-CD1 4Å; M85-F102 HydrophobicContact CB-CG 4.4Å; M85-F102 HydrophobicContact CE-CD1 4.46Å; M85-F102 HydrophobicContact CE-CE1 4.49Å; M85-F102 HydrophobicContact CG-CD1 3.78Å; M85-F102 HydrophobicContact CG-CE1 4.41Å; M85-F102 HydrophobicContact SD-CD1 3.53Å; M85-F102 VanDerWaalsContact SD-CD1 3.53Å; M85-F102 HydrophobicContact SD-CE1 3.56Å; M85-F102 VanDerWaalsContact SD-CE1 3.56Å; P86-F102 HydrophobicContact CG-CD2 4.2Å; P86-F102 HydrophobicContact CG-CE2 4.21Å; W98-F102 WeakPolarHBondContact O-CB 3.34Å; W98-F102 PolarHBondContact O-N 3.39Å; R99-F102 PolarHBondContact O-N 3.36Å; I100-F102 VanDerWaalsContact C-N 3.34Å; I100-F102 PolarHBondContact O-N 2.72Å; F102-A104 PolarHBondContact O-N 3.36Å; F102-S105 WeakPolarHBondContact CA-OG 3.43Å; F102-S105 PolarHBondContact O-N 3.2Å; F102-S105 PolarHBondContact O-OG 2.99Å; F102-L106 PolarHBondContact O-N 3.15Å; F102-S350 WeakPolarHBondContact CE2-OG 3.38Å; F102-Q351 VanDerWaalsContact CA-OE1 3.3Å; F102-Q351 HydrophobicContact CD2-CB 4.29Å; F102-L354 HydrophobicContact CE1-CD2 4.25Å; F102-L354 HydrophobicContact CE2-CD2 4.3Å; F102-L354 HydrophobicContact CZ-CD2 4.05Å
103G97.2Very high94.5Very high0 Ų037 Ų370%020%0.195CC..Hα-helixtrans-56.9-51.1175.800000112.7F77 S81 R99 I100 S105 L106 L107F77-G103 VanDerWaalsContact CE1-O 3.3Å; F77-G103 WeakPolarHBondContact CE1-O 3.29Å; S81-G103 WeakPolarHBondContact OG-CA 3.19Å; R99-G103 PolarHBondContact O-N 2.98Å; I100-G103 PolarHBondContact O-N 3.02Å; G103-S105 PolarHBondContact O-N 2.65Å; G103-L106 PolarHBondContact O-N 3.38Å; G103-L106 VanDerWaalsContact O-N 3.08Å; G103-L107 PolarHBondContact O-N 3.24Å
104A97.7Very high95.2Very high20 Ų2037.8 Ų37.817%0.16521%0.205CC..Hα-helixtrans-59.1-37.2178.200000111.9L78 I100 V101 F102 Y108 L324L78-A104 HydrophobicContact CD2-CB 4.01Å; I100-A104 VanDerWaalsContact O-CB 3.31Å; I100-A104 WeakPolarHBondContact O-CB 3.43Å; I100-A104 PolarHBondContact O-N 2.93Å; V101-A104 PolarHBondContact O-N 3.44Å; F102-A104 PolarHBondContact O-N 3.36Å; A104-Y108 VanDerWaalsContact O-CB 3.29Å; A104-Y108 WeakPolarHBondContact O-CB 3.45Å; A104-Y108 PolarHBondContact O-N 3.34Å; A104-L324 HydrophobicContact CB-CD1 3.71Å
105S97.9Very high95.8Very high0 Ų036.9 Ų36.90%020%0.203CC..Hα-helixtrans-65.9-40.6174.773.40000112.8V101 F102 G103 Y108 F109 Q351 L354 I358V101-S105 WeakPolarHBondContact O-CB 3.34Å; V101-S105 PolarHBondContact O-N 2.9Å; V101-S105 PolarHBondContact O-OG 3.05Å; F102-S105 WeakPolarHBondContact CA-OG 3.43Å; F102-S105 PolarHBondContact O-N 3.2Å; F102-S105 PolarHBondContact O-OG 2.99Å; G103-S105 PolarHBondContact O-N 2.65Å; S105-Y108 PolarHBondContact O-N 3.21Å; S105-F109 WeakPolarHBondContact O-CB 3.33Å; S105-F109 PolarHBondContact O-N 3.26Å; S105-Q351 PolarHBondContact OG-NE2 2.83Å; S105-L354 WeakPolarHBondContact OG-CD2 3.19Å; S105-I358 WeakPolarHBondContact O-CD1 3.48Å
106L97.7Very high96.2Very high47 Ų4738.2 Ų38.225%0.24621%0.21CC..Hα-helixtrans-67.8-43.4176.8179.657000111.2F77 M85 F102 G103 Y108 F109 L110 L354F77-L106 HydrophobicContact CZ-CB 4.3Å; F77-L106 HydrophobicContact CZ-CD2 3.95Å; F77-L106 HydrophobicContact CZ-CG 4.06Å; M85-L106 HydrophobicContact CE-CD2 4.01Å; F102-L106 PolarHBondContact O-N 3.15Å; G103-L106 PolarHBondContact O-N 3.38Å; G103-L106 VanDerWaalsContact O-N 3.08Å; L106-Y108 VanDerWaalsContact C-N 3.34Å; L106-Y108 PolarHBondContact O-N 2.85Å; L106-F109 HydrophobicContact CD1-CD1 4.4Å; L106-F109 WeakPolarHBondContact O-CB 3.46Å; L106-F109 PolarHBondContact O-N 3.38Å; L106-L110 HydrophobicContact CD1-CG 4.43Å; L106-L110 HydrophobicContact CG-CD1 4.46Å; L106-L110 WeakPolarHBondContact O-CG 3.21Å; L106-L110 PolarHBondContact O-N 2.95Å; L106-L354 HydrophobicContact CB-CD2 3.94Å; L106-L354 HydrophobicContact CD1-CD1 4.28Å
107L97.3Very high96.6Very high34 Ų3444.9 Ų44.918%0.17824%0.235CC..Hα-helixtrans-59.9-46.1175.3-176.464.5000111C74 F77 G103 F109 L110 C111C74-L107 HydrophobicContact CB-CD2 4.02Å; F77-L107 HydrophobicContact CD1-CB 4.16Å; F77-L107 HydrophobicContact CD1-CD1 4.47Å; F77-L107 HydrophobicContact CE1-CB 3.94Å; G103-L107 PolarHBondContact O-N 3.24Å; L107-F109 PolarHBondContact O-N 2.99Å; L107-L110 PolarHBondContact O-N 3Å; L107-C111 PolarHBondContact O-N 2.96Å; L107-C111 PolarHBondContact O-SG 3.19Å; L107-C111 VanDerWaalsContact O-SG 3.34Å
108Y97.8Very high96.9Very high41 Ų4143.2 Ų43.216%0.16123%0.227CC..Hα-helixtrans-60.9-45176.7-179-120.4000112.2A104 S105 L106 L110 C111 L112 R321 L324 I325 I358 E362A104-Y108 VanDerWaalsContact O-CB 3.29Å; A104-Y108 WeakPolarHBondContact O-CB 3.45Å; A104-Y108 PolarHBondContact O-N 3.34Å; S105-Y108 PolarHBondContact O-N 3.21Å; L106-Y108 VanDerWaalsContact C-N 3.34Å; L106-Y108 PolarHBondContact O-N 2.85Å; Y108-L110 VanDerWaalsContact C-N 3.35Å; Y108-L110 PolarHBondContact O-N 2.98Å; Y108-C111 WeakPolarHBondContact O-CB 3.36Å; Y108-C111 PolarHBondContact O-N 2.94Å; Y108-L112 HydrophobicContact CD1-CD1 3.97Å; Y108-L112 HydrophobicContact CE1-CD1 3.51Å; Y108-L112 HydrophobicContact CE1-CG 4.15Å; Y108-L112 HydrophobicContact CE2-CD1 4.38Å; Y108-L112 HydrophobicContact CE2-CD2 4.27Å; Y108-L112 HydrophobicContact CE2-CG 4.12Å; Y108-L112 WeakPolarHBondContact O-CG 3.25Å; Y108-L112 PolarHBondContact O-N 3.22Å; Y108-R321 WeakPolarHBondContact OH-CD 3.42Å; Y108-R321 PolarHBondContact OH-NE 2.94Å; Y108-L324 HydrophobicContact CD1-CD2 4.37Å; Y108-L324 HydrophobicContact CD2-CD2 4.46Å; Y108-L324 HydrophobicContact CG-CD2 4Å; Y108-I325 HydrophobicContact CE1-CD1 4.24Å; Y108-I358 HydrophobicContact CD1-CD1 4.28Å; Y108-I358 HydrophobicContact CD1-CG1 4.38Å; Y108-I358 HydrophobicContact CD1-CG2 3.86Å; Y108-I358 HydrophobicContact CE1-CG2 3.66Å; Y108-E362 WeakPolarHBondContact CE1-OE1 3.49Å; Y108-E362 PolarHBondContact OH-OE1 3.45Å
109F98.3Very high97Very high37 Ų3748.1 Ų48.116%0.16225%0.245CC..Hα-helixtrans-57-46.1174.2175.3-109.3000112S105 L106 L107 C111 L112 V113 L354 A357 I358 T361S105-F109 WeakPolarHBondContact O-CB 3.33Å; S105-F109 PolarHBondContact O-N 3.26Å; L106-F109 HydrophobicContact CD1-CD1 4.4Å; L106-F109 WeakPolarHBondContact O-CB 3.46Å; L106-F109 PolarHBondContact O-N 3.38Å; L107-F109 PolarHBondContact O-N 2.99Å; F109-C111 VanDerWaalsContact C-N 3.34Å; F109-C111 PolarHBondContact O-N 3.45Å; F109-L112 WeakPolarHBondContact O-CB 3.46Å; F109-L112 PolarHBondContact O-N 3.1Å; F109-V113 HydrophobicContact CD1-CG2 4.4Å; F109-V113 HydrophobicContact CD2-CG2 4.5Å; F109-V113 HydrophobicContact CE1-CG2 3.98Å; F109-V113 HydrophobicContact CE2-CG2 4.09Å; F109-V113 HydrophobicContact CZ-CG2 3.81Å; F109-V113 WeakPolarHBondContact O-CG2 3.15Å; F109-V113 PolarHBondContact O-N 3.37Å; F109-L354 HydrophobicContact CB-CD1 3.89Å; F109-L354 HydrophobicContact CD1-CD1 4.13Å; F109-L354 HydrophobicContact CG-CD1 3.96Å; F109-A357 HydrophobicContact CD2-CB 4.09Å; F109-A357 HydrophobicContact CE2-CB 3.64Å; F109-A357 HydrophobicContact CZ-CB 4.12Å; F109-I358 HydrophobicContact CB-CD1 4.44Å; F109-I358 HydrophobicContact CB-CG1 3.81Å; F109-I358 HydrophobicContact CD2-CG1 4.15Å; F109-I358 HydrophobicContact CG-CG1 4.41Å; F109-T361 WeakPolarHBondContact CE2-OG1 2.91Å
110L97.8Very high97.1Very high88 Ų8847.4 Ų47.446%0.46125%0.246SC..Hα-helixtrans-63.7-37.7177.2-67.5174.4000112.4L106 L107 Y108 V113 A114L106-L110 HydrophobicContact CD1-CG 4.43Å; L106-L110 HydrophobicContact CG-CD1 4.46Å; L106-L110 WeakPolarHBondContact O-CG 3.21Å; L106-L110 PolarHBondContact O-N 2.95Å; L107-L110 PolarHBondContact O-N 3Å; Y108-L110 VanDerWaalsContact C-N 3.35Å; Y108-L110 PolarHBondContact O-N 2.98Å; L110-V113 PolarHBondContact O-N 3.09Å; L110-A114 PolarHBondContact O-N 3.3Å
111C96.7Very high97.1Very high47 Ų4748.2 Ų48.232%0.31825%0.251SS..Hα-helixtrans-62-44.5172.1-68.80000111.6L107 Y108 F109 V113 A114 V115L107-C111 PolarHBondContact O-N 2.96Å; L107-C111 PolarHBondContact O-SG 3.19Å; L107-C111 VanDerWaalsContact O-SG 3.34Å; Y108-C111 WeakPolarHBondContact O-CB 3.36Å; Y108-C111 PolarHBondContact O-N 2.94Å; F109-C111 VanDerWaalsContact C-N 3.34Å; F109-C111 PolarHBondContact O-N 3.45Å; C111-V113 VanDerWaalsContact C-N 3.35Å; C111-V113 PolarHBondContact O-N 3.36Å; C111-A114 PolarHBondContact O-N 3.47Å; C111-V115 VanDerWaalsContact O-CG2 3.31Å; C111-V115 WeakPolarHBondContact O-CG2 3.46Å; C111-V115 PolarHBondContact O-N 2.83Å
112L97.8Very high97.2Very high10 Ų1051 Ų515%0.05226%0.263CS..Hα-helixtrans-61.4-43.3175.7-71.7172.4000111.6Y108 F109 A114 V115 V116 I358 T361 E362 V365Y108-L112 HydrophobicContact CD1-CD1 3.97Å; Y108-L112 HydrophobicContact CE1-CD1 3.51Å; Y108-L112 HydrophobicContact CE1-CG 4.15Å; Y108-L112 HydrophobicContact CE2-CD1 4.38Å; Y108-L112 HydrophobicContact CE2-CD2 4.27Å; Y108-L112 HydrophobicContact CE2-CG 4.12Å; Y108-L112 WeakPolarHBondContact O-CG 3.25Å; Y108-L112 PolarHBondContact O-N 3.22Å; F109-L112 WeakPolarHBondContact O-CB 3.46Å; F109-L112 PolarHBondContact O-N 3.1Å; L112-A114 VanDerWaalsContact C-N 3.29Å; L112-A114 PolarHBondContact O-N 3.37Å; L112-V115 PolarHBondContact O-N 3.4Å; L112-V115 VanDerWaalsContact O-N 3.13Å; L112-V116 WeakPolarHBondContact O-CG2 3.04Å; L112-V116 PolarHBondContact O-N 3.31Å; L112-I358 HydrophobicContact CD1-CG2 4.01Å; L112-T361 HydrophobicContact CB-CG2 3.76Å; L112-E362 HydrophobicContact CD1-CG 3.54Å; L112-E362 HydrophobicContact CD2-CG 4.13Å; L112-V365 HydrophobicContact CD2-CG2 4.29Å
113V98Very high97.1Very high53 Ų5350 Ų5032%0.32126%0.26SS..Hα-helixtrans-56.3-44.6174.9170.70000110.7F109 L110 C111 V116 F117 T361F109-V113 HydrophobicContact CD1-CG2 4.4Å; F109-V113 HydrophobicContact CD2-CG2 4.5Å; F109-V113 HydrophobicContact CE1-CG2 3.98Å; F109-V113 HydrophobicContact CE2-CG2 4.09Å; F109-V113 HydrophobicContact CZ-CG2 3.81Å; F109-V113 WeakPolarHBondContact O-CG2 3.15Å; F109-V113 PolarHBondContact O-N 3.37Å; L110-V113 PolarHBondContact O-N 3.09Å; C111-V113 VanDerWaalsContact C-N 3.35Å; C111-V113 PolarHBondContact O-N 3.36Å; V113-V116 PolarHBondContact O-N 2.84Å; V113-F117 HydrophobicContact CG1-CE2 4.29Å; V113-F117 WeakPolarHBondContact O-CD2 3.28Å; V113-F117 WeakPolarHBondContact O-CE2 3.43Å; V113-T361 HydrophobicContact CG2-CG2 4.49Å
114A97.1Very high97.1Very high56 Ų5651.9 Ų51.946%0.46327%0.267SS..Hα-helixtrans-63.4-45.3175.400000112.2L110 C111 L112 V116 F117L110-A114 PolarHBondContact O-N 3.3Å; C111-A114 PolarHBondContact O-N 3.47Å; L112-A114 VanDerWaalsContact C-N 3.29Å; L112-A114 PolarHBondContact O-N 3.37Å; A114-V116 VanDerWaalsContact C-N 3.28Å; A114-V116 PolarHBondContact O-N 3Å; A114-F117 PolarHBondContact O-N 3.37Å
115V97.3Very high97Very high33 Ų3353.6 Ų53.620%0.228%0.281CS..Hα-helixtrans-60.6-35.2179.9169.80000112.2C111 L112 F117 L118 F309 V365 L369C111-V115 VanDerWaalsContact O-CG2 3.31Å; C111-V115 WeakPolarHBondContact O-CG2 3.46Å; C111-V115 PolarHBondContact O-N 2.83Å; L112-V115 PolarHBondContact O-N 3.4Å; L112-V115 VanDerWaalsContact O-N 3.13Å; V115-F117 PolarHBondContact O-N 3.38Å; V115-F117 VanDerWaalsContact O-N 3.11Å; V115-L118 PolarHBondContact O-N 3.04Å; V115-F309 HydrophobicContact CG1-CZ 3.91Å; V115-V365 HydrophobicContact CG1-CG1 3.88Å; V115-V365 HydrophobicContact CG1-CG2 4.17Å; V115-L369 HydrophobicContact CG1-CD1 3.79Å
116V96.7Very high96.8Very high33 Ų3357.5 Ų57.520%0.230%0.301CS..Hα-helixtrans-56.2-28.1175.5169.20000112.2L112 V113 A114 T361 V365 K368L112-V116 WeakPolarHBondContact O-CG2 3.04Å; L112-V116 PolarHBondContact O-N 3.31Å; V113-V116 PolarHBondContact O-N 2.84Å; A114-V116 VanDerWaalsContact C-N 3.28Å; A114-V116 PolarHBondContact O-N 3Å; V116-T361 HydrophobicContact CG2-CG2 3.89Å; V116-V365 HydrophobicContact CG2-CG2 3.39Å; V116-K368 WeakPolarHBondContact O-CD 3.33Å; V116-K368 WeakPolarHBondContact O-CE 3.27Å; V116-K368 PolarHBondContact O-NZ 2.88Å
117F97.1Very high96.7Very high165 Ų16556.9 Ų56.972%0.72430%0.298SS*.Hα-helixtrans-87-15.7179-67.3-80.8000114.1V113 A114 V115V113-F117 HydrophobicContact CG1-CE2 4.29Å; V113-F117 WeakPolarHBondContact O-CD2 3.28Å; V113-F117 WeakPolarHBondContact O-CE2 3.43Å; A114-F117 PolarHBondContact O-N 3.37Å; V115-F117 PolarHBondContact O-N 3.38Å; V115-F117 VanDerWaalsContact O-N 3.11Å
118L96.8Very high96.6Very high42 Ų4257.3 Ų57.322%0.2230%0.3CS..SBendtrans-80.4159.3-177.8-58.6179.4000112.3V115 E122 A123 I126 K368 L369V115-L118 PolarHBondContact O-N 3.04Å; L118-E122 HydrophobicContact CB-CB 4.27Å; L118-A123 HydrophobicContact CB-CB 4.29Å; L118-A123 HydrophobicContact CD1-CB 4.25Å; L118-I126 HydrophobicContact CD1-CD1 3.48Å; L118-I126 VanDerWaalsContact CD1-CD1 3.48Å; L118-K368 PolarHBondContact O-NZ 2.87Å; L118-L369 WeakPolarHBondContact O-CD2 3.36Å
119R96.3Very high96.4Very high136 Ų13659.4 Ų59.451%0.51331%0.307SS..  trans-80.5160.4161.9-60.5-177-64.3120.311.3110.1D121 E122 A123R119-D121 VanDerWaalsContact C-N 3.31Å; R119-D121 WeakPolarHBondContact CB-OD1 3.31Å; R119-D121 IonicContact CZ-OD1 3.88Å; R119-D121 IonicContact CZ-OD2 3.46Å; R119-D121 IonicContact NE-OD1 2.99Å; R119-D121 IonicContact NH1-OD1 3.4Å; R119-D121 PolarHBondContact NH1-OD1 3.48Å; R119-D121 IonicContact NH1-OD2 3.05Å; R119-D121 PolarHBondContact NH1-OD2 3.36Å; R119-D121 IonicContact NH2-OD1 2.82Å; R119-D121 IonicContact NH2-OD2 3.9Å; R119-D121 PolarHBondContact NH2-OD2 3.42Å; R119-D121 PolarHBondContact O-N 2.88Å; R119-E122 HydrophobicContact CB-CG 4.27Å; R119-E122 IonicContact CZ-OE1 2.85Å; R119-E122 VanDerWaalsContact CZ-OE1 3.29Å; R119-E122 PolarHBondContact N-OE2 2.9Å; R119-E122 IonicContact NE-OE1 2.94Å; R119-E122 PolarHBondContact NE-OE1 3.26Å; R119-E122 IonicContact NE-OE2 3.86Å; R119-E122 IonicContact NH2-OE1 3.17Å; R119-E122 PolarHBondContact NH2-OE1 3.45Å; R119-E122 PolarHBondContact O-N 2.96Å; R119-A123 PolarHBondContact O-N 3.47Å
120L95.6Very high96.2Very high52 Ų5259.6 Ų59.627%0.27231%0.312SS..Hα-helixtrans-60.1-42-177.8176.962.3000111.7E122 A123 R124 I308 F309 L369L120-E122 VanDerWaalsContact C-N 3.34Å; L120-E122 PolarHBondContact O-N 3.36Å; L120-A123 PolarHBondContact O-N 2.88Å; L120-R124 HydrophobicContact CD1-CG 4.27Å; L120-R124 WeakPolarHBondContact O-CB 3.36Å; L120-R124 VanDerWaalsContact O-CG 3.31Å; L120-R124 WeakPolarHBondContact O-CG 3.34Å; L120-R124 PolarHBondContact O-N 2.89Å; L120-I308 HydrophobicContact CD1-CG2 3.76Å; L120-F309 HydrophobicContact CD1-CD1 4.28Å; L120-F309 HydrophobicContact CD1-CE1 4.3Å; L120-L369 HydrophobicContact CD1-CB 4.28Å
121D95.4Very high96Very high82 Ų8257.9 Ų57.944%0.43930%0.3SS..Hα-helixtrans-61.3-40176.359.1-44.6000112.3R119 A125R119-D121 VanDerWaalsContact C-N 3.31Å; R119-D121 WeakPolarHBondContact CB-OD1 3.31Å; R119-D121 IonicContact CZ-OD1 3.88Å; R119-D121 IonicContact CZ-OD2 3.46Å; R119-D121 IonicContact NE-OD1 2.99Å; R119-D121 IonicContact NH1-OD1 3.4Å; R119-D121 PolarHBondContact NH1-OD1 3.48Å; R119-D121 IonicContact NH1-OD2 3.05Å; R119-D121 PolarHBondContact NH1-OD2 3.36Å; R119-D121 IonicContact NH2-OD1 2.82Å; R119-D121 IonicContact NH2-OD2 3.9Å; R119-D121 PolarHBondContact NH2-OD2 3.42Å; R119-D121 PolarHBondContact O-N 2.88Å; D121-A125 VanDerWaalsContact O-CB 3.31Å; D121-A125 WeakPolarHBondContact O-CB 3.25Å; D121-A125 PolarHBondContact O-N 2.88Å
122E96.9Very high95.8Very high69 Ų6959.7 Ų59.732%0.32231%0.311SS..Hα-helixtrans-69-45.9176.9-67.1164.9174.400111.8L118 R119 L120 R124 A125 I126L118-E122 HydrophobicContact CB-CB 4.27Å; R119-E122 HydrophobicContact CB-CG 4.27Å; R119-E122 IonicContact CZ-OE1 2.85Å; R119-E122 VanDerWaalsContact CZ-OE1 3.29Å; R119-E122 PolarHBondContact N-OE2 2.9Å; R119-E122 IonicContact NE-OE1 2.94Å; R119-E122 PolarHBondContact NE-OE1 3.26Å; R119-E122 IonicContact NE-OE2 3.86Å; R119-E122 IonicContact NH2-OE1 3.17Å; R119-E122 PolarHBondContact NH2-OE1 3.45Å; R119-E122 PolarHBondContact O-N 2.96Å; L120-E122 VanDerWaalsContact C-N 3.34Å; L120-E122 PolarHBondContact O-N 3.36Å; E122-R124 VanDerWaalsContact C-N 3.31Å; E122-R124 PolarHBondContact O-N 3.4Å; E122-A125 WeakPolarHBondContact O-CB 3.42Å; E122-A125 PolarHBondContact O-N 2.86Å; E122-A125 VanDerWaalsContact O-N 3.17Å; E122-I126 WeakPolarHBondContact O-CG1 3.47Å; E122-I126 PolarHBondContact O-N 3.12Å
123A96.5Very high95.6Very high4 Ų464.1 Ų64.13%0.03333%0.331CS..Hα-helixtrans-61.2-42176.400000111.2L118 R119 L120 I126 L127 F309 L369L118-A123 HydrophobicContact CB-CB 4.29Å; L118-A123 HydrophobicContact CD1-CB 4.25Å; R119-A123 PolarHBondContact O-N 3.47Å; L120-A123 PolarHBondContact O-N 2.88Å; A123-I126 PolarHBondContact O-N 3Å; A123-L127 WeakPolarHBondContact O-CG 3.2Å; A123-L127 PolarHBondContact O-N 3.44Å; A123-F309 HydrophobicContact CB-CE1 3.77Å; A123-L369 HydrophobicContact CB-CD1 4.26Å
124R95.7Very high95.4Very high40 Ų4061.7 Ų61.715%0.15132%0.316CS..Hα-helixtrans-63.2-42172.3-75.6-170.971.873.97.2112.4L120 E122 I126 L127 I128 F309 I310L120-R124 HydrophobicContact CD1-CG 4.27Å; L120-R124 WeakPolarHBondContact O-CB 3.36Å; L120-R124 VanDerWaalsContact O-CG 3.31Å; L120-R124 WeakPolarHBondContact O-CG 3.34Å; L120-R124 PolarHBondContact O-N 2.89Å; E122-R124 VanDerWaalsContact C-N 3.31Å; E122-R124 PolarHBondContact O-N 3.4Å; R124-I126 VanDerWaalsContact C-N 3.28Å; R124-I126 PolarHBondContact O-N 3.27Å; R124-L127 PolarHBondContact O-N 2.8Å; R124-L127 VanDerWaalsContact O-N 3.16Å; R124-I128 WeakPolarHBondContact O-CB 3.36Å; R124-I128 VanDerWaalsContact O-CG1 3.26Å; R124-I128 WeakPolarHBondContact O-CG1 3.39Å; R124-I128 PolarHBondContact O-N 3.4Å; R124-F309 PolarHBondContact NH1-O 3.27Å; R124-I310 VanDerWaalsContact NH1-CD1 3.27Å
125A96Very high95.2Very high56 Ų5665.4 Ų65.446%0.46332%0.322SS..Hα-helixtrans-61-39.3178.100000111.6D121 E122 I128 W129D121-A125 VanDerWaalsContact O-CB 3.31Å; D121-A125 WeakPolarHBondContact O-CB 3.25Å; D121-A125 PolarHBondContact O-N 2.88Å; E122-A125 WeakPolarHBondContact O-CB 3.42Å; E122-A125 PolarHBondContact O-N 2.86Å; E122-A125 VanDerWaalsContact O-N 3.17Å; A125-I128 PolarHBondContact O-N 2.71Å; A125-W129 WeakPolarHBondContact O-CB 3.38Å; A125-W129 PolarHBondContact O-N 2.81Å
126I94.8Very high94.9Very high82 Ų8272.4 Ų72.442%0.42135%0.346SS..Hα-helixtrans-64.6-45.8173.3-64.9172.9000110.7L118 E122 A123 R124 I128 W129 V130L118-I126 HydrophobicContact CD1-CD1 3.48Å; L118-I126 VanDerWaalsContact CD1-CD1 3.48Å; E122-I126 WeakPolarHBondContact O-CG1 3.47Å; E122-I126 PolarHBondContact O-N 3.12Å; A123-I126 PolarHBondContact O-N 3Å; R124-I126 VanDerWaalsContact C-N 3.28Å; R124-I126 PolarHBondContact O-N 3.27Å; I126-I128 VanDerWaalsContact C-N 3.32Å; I126-I128 PolarHBondContact O-N 3.02Å; I126-W129 HydrophobicContact CG2-CE3 4.5Å; I126-W129 WeakPolarHBondContact O-CB 3.39Å; I126-W129 PolarHBondContact O-N 3.33Å; I126-V130 WeakPolarHBondContact O-CG2 3.26Å; I126-V130 PolarHBondContact O-N 3.08Å
127L94.7Very high94.7Very high34 Ų3472.6 Ų72.618%0.17835%0.345CS..Hα-helixtrans-60.5-41.4177-72.4175.7000112.3A123 R124 W129 V130 Y131 L134 F309 L317A123-L127 WeakPolarHBondContact O-CG 3.2Å; A123-L127 PolarHBondContact O-N 3.44Å; R124-L127 PolarHBondContact O-N 2.8Å; R124-L127 VanDerWaalsContact O-N 3.16Å; L127-W129 VanDerWaalsContact C-N 3.33Å; L127-V130 PolarHBondContact O-N 3Å; L127-Y131 PolarHBondContact O-N 3.46Å; L127-L134 HydrophobicContact CB-CD1 4.29Å; L127-F309 HydrophobicContact CD1-CB 3.74Å; L127-F309 HydrophobicContact CD1-CD1 3.69Å; L127-F309 HydrophobicContact CD1-CE1 4.47Å; L127-F309 HydrophobicContact CD1-CG 3.76Å; L127-L317 HydrophobicContact CD2-CD2 3.81Å
128I95.6Very high94.4Very high44 Ų4472.2 Ų72.223%0.22634%0.339CS..Hα-helixtrans-67.7-34.6176.7-67.7163.6000111.1R124 A125 I126 V130 Y131 P132 L134 K135R124-I128 WeakPolarHBondContact O-CB 3.36Å; R124-I128 VanDerWaalsContact O-CG1 3.26Å; R124-I128 WeakPolarHBondContact O-CG1 3.39Å; R124-I128 PolarHBondContact O-N 3.4Å; A125-I128 PolarHBondContact O-N 2.71Å; I126-I128 VanDerWaalsContact C-N 3.32Å; I126-I128 PolarHBondContact O-N 3.02Å; I128-V130 VanDerWaalsContact C-N 3.32Å; I128-Y131 WeakPolarHBondContact CA-O 3.44Å; I128-Y131 CarbonylContact O-C 3.59Å; I128-P132 WeakPolarHBondContact O-CA 3.31Å; I128-P132 VanDerWaalsContact O-N 3.09Å; I128-L134 HydrophobicContact CG1-CB 4.15Å; I128-K135 HydrophobicContact CG2-CB 3.88Å; I128-K135 HydrophobicContact CG2-CG 4.37Å
129W93.7Very high94Very high84 Ų8474.6 Ų74.632%0.31835%0.349SS..Hα-helixtrans-64.9-37.6174170.362.8000112.1Q63 L66 Y67 A125 I126 L127Q63-W129 WeakPolarHBondContact O-CZ2 3.45Å; L66-W129 HydrophobicContact CB-CH2 4.23Å; L66-W129 HydrophobicContact CB-CZ2 4.05Å; Y67-W129 HydrophobicContact CD2-CZ2 4.45Å; A125-W129 WeakPolarHBondContact O-CB 3.38Å; A125-W129 PolarHBondContact O-N 2.81Å; I126-W129 HydrophobicContact CG2-CE3 4.5Å; I126-W129 WeakPolarHBondContact O-CB 3.39Å; I126-W129 PolarHBondContact O-N 3.33Å; L127-W129 VanDerWaalsContact C-N 3.33Å
130V93.1Very high93.5Very high42 Ų4271.3 Ų71.326%0.25535%0.347SS..Hα-helixtrans-76.4-40175.4-179.10000111.8I126 L127 I128I126-V130 WeakPolarHBondContact O-CG2 3.26Å; I126-V130 PolarHBondContact O-N 3.08Å; L127-V130 PolarHBondContact O-N 3Å; I128-V130 VanDerWaalsContact C-N 3.32Å
131Y93.9Very high93Very high52 Ų5271.4 Ų71.420%0.20435%0.347CS..  trans-128.485.4-177.9-61.4-77.7000110.3L127 I128 E133 L134 H315 I316 L317L127-Y131 PolarHBondContact O-N 3.46Å; I128-Y131 WeakPolarHBondContact CA-O 3.44Å; I128-Y131 CarbonylContact O-C 3.59Å; Y131-E133 WeakPolarHBondContact CA-OE2 3.47Å; Y131-E133 PolarHBondContact O-N 3.16Å; Y131-E133 VanDerWaalsContact O-N 3.1Å; Y131-L134 HydrophobicContact CD2-CD1 4.45Å; Y131-L134 HydrophobicContact CG-CD1 4.45Å; Y131-L134 WeakPolarHBondContact O-CB 3.48Å; Y131-L134 PolarHBondContact O-N 2.83Å; Y131-H315 AromaticContact CD1-CE1 3.74Å; Y131-H315 AromaticContact CG-CE1 3.82Å; Y131-I316 HydrophobicContact CE1-CG2 3.86Å; Y131-L317 HydrophobicContact CE2-CB 4.29Å; Y131-L317 HydrophobicContact CE2-CD1 4.11Å; Y131-L317 HydrophobicContact CE2-CD2 4.33Å; Y131-L317 HydrophobicContact CE2-CG 4.48Å
132P93.6Very high92.5Very high85 Ų8567.6 Ų67.655%0.55233%0.327SS*.G310 helixtrans-56.2-27.6-176.1-27.936.6000115I128 L134 K135I128-P132 WeakPolarHBondContact O-CA 3.31Å; I128-P132 VanDerWaalsContact O-N 3.09Å; P132-L134 PolarHBondContact O-N 3.4Å; P132-K135 VanDerWaalsContact O-CB 3.27Å; P132-K135 WeakPolarHBondContact O-CB 3.4Å; P132-K135 PolarHBondContact O-N 3.15Å
133E92.2Very high91.8Very high102 Ų10267.3 Ų67.348%0.47733%0.328SS..G310 helixtrans-60.5-24.4177.164.1-89.1-147.500113.5Y131 K135 H315Y131-E133 WeakPolarHBondContact CA-OE2 3.47Å; Y131-E133 PolarHBondContact O-N 3.16Å; Y131-E133 VanDerWaalsContact O-N 3.1Å; E133-K135 PolarHBondContact O-N 3.34Å; E133-H315 IonicContact OE1-NE2 3.18Å; E133-H315 PolarHBondContact OE1-NE2 3.49Å
134L94.2Very high90.6Very high3 Ų370.6 Ų70.62%0.01635%0.345CS..G310 helixtrans-72.8-10.6179.1-62-179.6000113.2L127 I128 Y131 P132 Y136 M137 V311L127-L134 HydrophobicContact CB-CD1 4.29Å; I128-L134 HydrophobicContact CG1-CB 4.15Å; Y131-L134 HydrophobicContact CD2-CD1 4.45Å; Y131-L134 HydrophobicContact CG-CD1 4.45Å; Y131-L134 WeakPolarHBondContact O-CB 3.48Å; Y131-L134 PolarHBondContact O-N 2.83Å; P132-L134 PolarHBondContact O-N 3.4Å; L134-Y136 VanDerWaalsContact C-N 3.26Å; L134-Y136 PolarHBondContact O-N 3.11Å; L134-M137 HydrophobicContact CD2-CG 4.1Å; L134-M137 PolarHBondContact O-N 2.77Å; L134-V311 HydrophobicContact CD1-CG2 4.21Å; L134-V311 HydrophobicContact CD2-CG1 4.46Å; L134-V311 HydrophobicContact CD2-CG2 4.48Å
135K93.4Very high89.7Confident134 Ų13471.2 Ų71.258%0.58335%0.348SS*.G310 helixtrans-59.3-35.6-177.4-174.2176.4179.6-179.60113.3I128 P132 E133I128-K135 HydrophobicContact CG2-CB 3.88Å; I128-K135 HydrophobicContact CG2-CG 4.37Å; P132-K135 VanDerWaalsContact O-CB 3.27Å; P132-K135 WeakPolarHBondContact O-CB 3.4Å; P132-K135 PolarHBondContact O-N 3.15Å; E133-K135 PolarHBondContact O-N 3.34Å
136Y91.4Very high88.7Confident180 Ų18075.9 Ų75.971%0.70636%0.361SS*.G310 helixtrans-100.6-1.1-175.2-55.1-72.5000113.2L134L134-Y136 VanDerWaalsContact C-N 3.26Å; L134-Y136 PolarHBondContact O-N 3.11Å
137M91.9Very high88Confident36 Ų3674 Ų7418%0.17735%0.348CS..  trans-70.5131.4-179.7-71.9-69.5-67.900110.9L134 D141 I310 K312L134-M137 HydrophobicContact CD2-CG 4.1Å; L134-M137 PolarHBondContact O-N 2.77Å; M137-D141 HydrophobicContact CE-CB 4.04Å; M137-D141 HydrophobicContact SD-CB 4.19Å; M137-I310 HydrophobicContact CB-CG2 4.19Å; M137-K312 HydrophobicContact CE-CB 3.78Å; M137-K312 HydrophobicContact CE-CD 4.21Å; M137-K312 HydrophobicContact CE-CG 4.06Å
138R90.5Very high87.4Confident157 Ų15774 Ų7459%0.59235%0.354SS*.  trans-117.7166.3173.5-57.3169.2-62.1167.58.7109.9S140 D141 I310R138-S140 PolarHBondContact O-N 3.23Å; R138-D141 WeakPolarHBondContact CB-OD2 3.19Å; R138-D141 IonicContact CZ-OD1 3.83Å; R138-D141 PolarHBondContact N-OD2 2.87Å; R138-D141 IonicContact NE-OD1 3.96Å; R138-D141 IonicContact NE-OD2 3.97Å; R138-D141 PolarHBondContact NE-OD2 3.42Å; R138-D141 IonicContact NH2-OD1 3.37Å; R138-D141 PolarHBondContact NH2-OD1 3.45Å; R138-D141 IonicContact NH2-OD2 3.26Å; R138-D141 WeakPolarHBondContact O-CB 3.25Å; R138-D141 PolarHBondContact O-N 3.41Å; R138-I310 VanDerWaalsContact C-CG2 3.4Å
139H88Confident86.7Confident92 Ų9275.1 Ų75.143%0.42636%0.362SS..G310 helixtrans-57.3-33.2177.8-66.198.9000113.3D141 I142 H307 I310H139-D141 PolarHBondContact O-N 3.5Å; H139-I142 WeakPolarHBondContact O-CB 3.28Å; H139-I142 PolarHBondContact O-N 3.45Å; H139-H307 AromaticContact CD2-CE1 3.89Å; H139-I310 WeakPolarHBondContact CE1-CD1 3.37Å; H139-I310 WeakPolarHBondContact NE2-CG1 3.3Å
140S85.6Confident86.2Confident67 Ų6775.1 Ų75.147%0.46937%0.368SS..G310 helixtrans-60-33.7174.255.90000112.7R138 I142 L143R138-S140 PolarHBondContact O-N 3.23Å; S140-I142 VanDerWaalsContact C-N 3.25Å; S140-I142 PolarHBondContact O-N 2.91Å; S140-L143 PolarHBondContact O-N 3.19Å
141D86.5Confident85.8Confident54 Ų5474.4 Ų74.429%0.28937%0.365SS..G310 helixtrans-83.3-5.7-174.5-43-38.8000111.6M137 R138 H139M137-D141 HydrophobicContact CE-CB 4.04Å; M137-D141 HydrophobicContact SD-CB 4.19Å; R138-D141 WeakPolarHBondContact CB-OD2 3.19Å; R138-D141 IonicContact CZ-OD1 3.83Å; R138-D141 PolarHBondContact N-OD2 2.87Å; R138-D141 IonicContact NE-OD1 3.96Å; R138-D141 IonicContact NE-OD2 3.97Å; R138-D141 PolarHBondContact NE-OD2 3.42Å; R138-D141 IonicContact NH2-OD1 3.37Å; R138-D141 PolarHBondContact NH2-OD1 3.45Å; R138-D141 IonicContact NH2-OD2 3.26Å; R138-D141 WeakPolarHBondContact O-CB 3.25Å; R138-D141 PolarHBondContact O-N 3.41Å; H139-D141 PolarHBondContact O-N 3.5Å
142I85.3Confident85.5Confident3 Ų377 Ų772%0.01539%0.391CS..G310 helixtrans-78.6-29.8170.6-51.8174.2000110.5H139 S140 D144 I310H139-I142 WeakPolarHBondContact O-CB 3.28Å; H139-I142 PolarHBondContact O-N 3.45Å; S140-I142 VanDerWaalsContact C-N 3.25Å; S140-I142 PolarHBondContact O-N 2.91Å; I142-D144 PolarHBondContact O-N 3.41Å; I142-D144 VanDerWaalsContact O-N 3.14Å; I142-I310 HydrophobicContact CD1-CB 4.2Å; I142-I310 HydrophobicContact CD1-CG2 3.82Å; I142-I310 HydrophobicContact CG1-CG2 4Å
143L81.7Confident85.1Confident63 Ų6378.1 Ų78.133%0.3339%0.388SS..  trans-81.192.4179.5-58177.3000108.4S140 K145 Y147 P206 N207S140-L143 PolarHBondContact O-N 3.19Å; L143-K145 PolarHBondContact O-N 2.64Å; L143-K145 VanDerWaalsContact O-N 3.17Å; L143-Y147 HydrophobicContact CB-CD2 4.4Å; L143-Y147 HydrophobicContact CB-CE2 4.22Å; L143-Y147 HydrophobicContact CD2-CD2 3.96Å; L143-Y147 HydrophobicContact CD2-CE2 3.92Å; L143-P206 HydrophobicContact CD1-CB 4.19Å; L143-P206 HydrophobicContact CD2-CB 4.18Å; L143-N207 HydrophobicContact CD2-CB 3.81Å
144D71.5Confident84.7Confident73 Ų7377.5 Ų77.539%0.3939%0.388SS..SBendtrans-66-13.8-179.1-67.1-40.2000113I142 F166I142-D144 PolarHBondContact O-N 3.41Å; I142-D144 VanDerWaalsContact O-N 3.14Å; D144-F166 HydrophobicContact CB-CE2 4.37Å; D144-F166 HydrophobicContact CB-CZ 4.28Å
145K75.3Confident84.4Confident52 Ų5280.2 Ų80.223%0.22641%0.407CS..SBendtrans-148.8166.5178.657.8-176.1173.1-176.30111.4L143 Y147 D164L143-K145 PolarHBondContact O-N 2.64Å; L143-K145 VanDerWaalsContact O-N 3.17Å; K145-Y147 HydrophobicContact CD-CE1 4.5Å; K145-Y147 HydrophobicContact CG-CD2 4.31Å; K145-Y147 HydrophobicContact CG-CE1 4.09Å; K145-Y147 HydrophobicContact CG-CE2 3.75Å; K145-Y147 WeakPolarHBondContact O-CD2 3.08Å; K145-Y147 WeakPolarHBondContact O-CE2 3.28Å; K145-D164 IonicContact NZ-OD2 3.96Å; K145-D164 PolarHBondContact NZ-OD2 3.49Å
146E76.1Confident84.1Confident155 Ų15581.4 Ų81.472%0.72442%0.419SS*.  trans-73129.9167.9-66.3-178.7172.900109.5V149E146-V149 HydrophobicContact CB-CG2 4.05Å
147Y79.1Confident83.9Confident41 Ų4176.4 Ų76.416%0.16142%0.415CS..  trans-108.5136.2-178-72.3-87.6000109.6L143 K145 V149 N207 N209 E210L143-Y147 HydrophobicContact CB-CD2 4.4Å; L143-Y147 HydrophobicContact CB-CE2 4.22Å; L143-Y147 HydrophobicContact CD2-CD2 3.96Å; L143-Y147 HydrophobicContact CD2-CE2 3.92Å; K145-Y147 HydrophobicContact CD-CE1 4.5Å; K145-Y147 HydrophobicContact CG-CD2 4.31Å; K145-Y147 HydrophobicContact CG-CE1 4.09Å; K145-Y147 HydrophobicContact CG-CE2 3.75Å; K145-Y147 WeakPolarHBondContact O-CD2 3.08Å; K145-Y147 WeakPolarHBondContact O-CE2 3.28Å; Y147-V149 PolarHBondContact O-N 2.88Å; Y147-N207 HydrophobicContact CE1-CB 4.34Å; Y147-N207 WeakPolarHBondContact CE1-O 3.48Å; Y147-N207 HydrophobicContact CE2-CB 4.17Å; Y147-N209 CarbonylContact C-O 3.17Å; Y147-N209 WeakPolarHBondContact CB-O 3.43Å; Y147-E210 HydrophobicContact CD1-CG 4.29Å
148A82.9Confident83.5Confident35 Ų3577.6 Ų77.629%0.28942%0.417SS..SBendtrans57.234.1179.800000117.5N209A148-N209 HydrophobicContact CB-CB 4.17Å; A148-N209 VanDerWaalsContact CB-CG 3.42Å; A148-N209 WeakPolarHBondContact CB-ND2 3.25Å; A148-N209 WeakPolarHBondContact CB-O 3.31Å; A148-N209 WeakPolarHBondContact CB-OD1 3.42Å; A148-N209 PolarHBondContact N-O 3.06Å
149V81.5Confident83.2Confident67 Ų6772.1 Ų72.141%0.40640%0.401SS..SBendtrans-98.2128.1175.7-176.40000110.9E146 Y147 C151E146-V149 HydrophobicContact CB-CG2 4.05Å; Y147-V149 PolarHBondContact O-N 2.88Å; V149-C151 PolarHBondContact O-N 3.04Å
150N83.3Confident83.1Confident84 Ų8476.8 Ų76.845%0.44942%0.416SS..SBendtrans54.242175.5-61.8-33.3000115S152 E153 R158N150-S152 PolarHBondContact O-N 3.42Å; N150-E153 PolarHBondContact O-N 2.92Å; N150-R158 PolarHBondContact O-NH1 3.41Å
151C84.4Confident83Confident28 Ų2877 Ų7719%0.18942%0.418CS..THydrogen-bonded Turntrans-63.1-13.8-175.6-63.60000116V149 C211 W213V149-C151 PolarHBondContact O-N 3.04Å; C151-C211 WeakPolarHBondContact CA-SG 3.5Å; C151-C211 HydrophobicContact CB-CB 3.6Å; C151-C211 WeakPolarHBondContact CB-SG 3.42Å; C151-C211 WeakPolarHBondContact SG-CA 3.44Å; C151-C211 WeakPolarHBondContact SG-CB 3.48Å; C151-C211 CovalentContact SG-SG 2.04Å; C151-C211 PolarHBondContact SG-SG 3.01Å; C151-W213 PolarHBondContact O-NE1 3.24Å
152S87.3Confident82.8Confident105 Ų10575.9 Ų75.973%0.73441%0.411SS*.THydrogen-bonded Turntrans-79.3-23.3174.9490000113.2N150 I154N150-S152 PolarHBondContact O-N 3.42Å; S152-I154 PolarHBondContact O-N 3.06Å
153E84.9Confident82.8Confident109 Ų10980.4 Ų80.451%0.50943%0.433SS..  trans-93.287.3-176.1-73.1174.4-176.800110.4N150 S155 R158N150-E153 PolarHBondContact O-N 2.92Å; E153-S155 PolarHBondContact O-N 2.76Å; E153-R158 WeakPolarHBondContact O-CD 3.26Å; E153-R158 PolarHBondContact O-NH1 3.42Å; E153-R158 IonicContact OE2-NH1 3.29Å; E153-R158 PolarHBondContact OE2-NH1 3.41Å; E153-R158 IonicContact OE2-NH2 3.67Å
154I84.5Confident82.8Confident89 Ų8979.5 Ų79.546%0.45643%0.429SS..  trans-89.2105.1178-54.9175.5000108.8S152 V159 W212 W213S152-I154 PolarHBondContact O-N 3.06Å; I154-V159 HydrophobicContact CG2-CG2 3.92Å; I154-W212 HydrophobicContact CD1-CH2 4.22Å; I154-W212 HydrophobicContact CD1-CZ2 3.79Å; I154-W213 HydrophobicContact CD1-CB 4.1Å; I154-W213 HydrophobicContact CD1-CG 3.85Å; I154-W213 HydrophobicContact CG1-CG 4.18Å
155S87.6Confident83.4Confident60 Ų6081.7 Ų81.742%0.4244%0.439SS..  trans-113.2152.2171.1730000110.6E153 A157 R158 V159E153-S155 PolarHBondContact O-N 2.76Å; S155-A157 PolarHBondContact O-N 2.84Å; S155-R158 PolarHBondContact O-N 3.12Å; S155-R158 WeakPolarHBondContact OG-CB 3.21Å; S155-R158 PolarHBondContact OG-N 2.89Å; S155-V159 PolarHBondContact O-N 3.44Å
156L87.4Confident83.8Confident159 Ų15981.8 Ų81.883%0.83244%0.44SS*.Hα-helixtrans-58.7-36.6177.4-73.9173.5000112.3R158 V159 Y160L156-R158 VanDerWaalsContact C-N 3.32Å; L156-R158 PolarHBondContact O-N 2.71Å; L156-V159 PolarHBondContact O-N 3.42Å; L156-Y160 VanDerWaalsContact O-CB 3.3Å; L156-Y160 WeakPolarHBondContact O-CB 3.36Å; L156-Y160 PolarHBondContact O-N 3.02Å
157A86.4Confident84.4Confident76 Ų7674.7 Ų74.763%0.62841%0.407SS*.Hα-helixtrans-63.4-38.9175.900000111.8S155 S161S155-A157 PolarHBondContact O-N 2.84Å; A157-S161 PolarHBondContact O-N 3.43Å
158R83.8Confident84.9Confident61 Ų6176.9 Ų76.923%0.2342%0.421CS..Hα-helixtrans-70-44.5176.1-177.6169.7-79.1151.7-4111.5N150 E153 S155 L156 Y160 S161 H162 W213N150-R158 PolarHBondContact O-NH1 3.41Å; E153-R158 WeakPolarHBondContact O-CD 3.26Å; E153-R158 PolarHBondContact O-NH1 3.42Å; E153-R158 IonicContact OE2-NH1 3.29Å; E153-R158 PolarHBondContact OE2-NH1 3.41Å; E153-R158 IonicContact OE2-NH2 3.67Å; S155-R158 PolarHBondContact O-N 3.12Å; S155-R158 WeakPolarHBondContact OG-CB 3.21Å; S155-R158 PolarHBondContact OG-N 2.89Å; L156-R158 VanDerWaalsContact C-N 3.32Å; L156-R158 PolarHBondContact O-N 2.71Å; R158-Y160 VanDerWaalsContact C-N 3.32Å; R158-Y160 PolarHBondContact O-N 2.9Å; R158-S161 PolarHBondContact O-N 3.44Å; R158-S161 PolarHBondContact O-OG 3.49Å; R158-H162 PolarHBondContact O-N 3.31Å; R158-H162 PolarHBondContact O-ND1 2.93Å; R158-W213 HydrophobicContact CG-CH2 4.47Å; R158-W213 HydrophobicContact CG-CZ2 4.19Å
159V84.5Confident85.3Confident42 Ų4277.8 Ų77.826%0.25543%0.429SS..Hα-helixtrans-60.6-44.9175.5177.60000110.3I154 S155 L156 S161 H162 M163 W213I154-V159 HydrophobicContact CG2-CG2 3.92Å; S155-V159 PolarHBondContact O-N 3.44Å; L156-V159 PolarHBondContact O-N 3.42Å; V159-S161 VanDerWaalsContact C-N 3.29Å; V159-S161 PolarHBondContact O-N 3.31Å; V159-H162 PolarHBondContact O-N 2.89Å; V159-M163 PolarHBondContact O-N 3.1Å; V159-M163 VanDerWaalsContact O-N 3.13Å; V159-W213 HydrophobicContact CG2-CH2 4.34Å; V159-W213 HydrophobicContact CG2-CZ3 4.11Å
160Y86Confident85.8Confident189 Ų18976.2 Ų76.274%0.74142%0.417SS*.Hα-helixtrans-62.1-34.3176.7-173.8-97.6000112.8L156 R158 H162 M163L156-Y160 VanDerWaalsContact O-CB 3.3Å; L156-Y160 WeakPolarHBondContact O-CB 3.36Å; L156-Y160 PolarHBondContact O-N 3.02Å; R158-Y160 VanDerWaalsContact C-N 3.32Å; R158-Y160 PolarHBondContact O-N 2.9Å; Y160-H162 VanDerWaalsContact C-N 3.26Å; Y160-H162 PolarHBondContact O-N 3.21Å; Y160-M163 PolarHBondContact O-N 3.43Å
161S83.5Confident86.4Confident71 Ų7174.8 Ų74.850%0.49741%0.407SS..Hα-helixtrans-69.5-23.2175.477.80000113.5A157 R158 V159A157-S161 PolarHBondContact O-N 3.43Å; R158-S161 PolarHBondContact O-N 3.44Å; R158-S161 PolarHBondContact O-OG 3.49Å; V159-S161 VanDerWaalsContact C-N 3.29Å; V159-S161 PolarHBondContact O-N 3.31Å
162H82.6Confident86.9Confident31 Ų3177.2 Ų77.214%0.14442%0.418CS..Hα-helixtrans-88.8-14175.5-68.469.4000112.6R158 V159 Y160 D164 W213 D214 L218R158-H162 PolarHBondContact O-N 3.31Å; R158-H162 PolarHBondContact O-ND1 2.93Å; V159-H162 PolarHBondContact O-N 2.89Å; Y160-H162 VanDerWaalsContact C-N 3.26Å; Y160-H162 PolarHBondContact O-N 3.21Å; H162-D164 PolarHBondContact O-N 3.35Å; H162-W213 HydrophobicContact CB-CH2 4.21Å; H162-W213 AromaticContact CG-CH2 3.78Å; H162-W213 AromaticContact ND1-CH2 3.83Å; H162-D214 IonicContact CD2-OD2 2.81Å; H162-D214 PolarHBondContact CD2-OD2 3.46Å; H162-L218 HydrophobicContact CB-CD2 4.12Å
163M83.5Confident87.3Confident98 Ų9873.3 Ų73.348%0.48339%0.394SS..SBendtrans-7455167.7-65.6-60.6-59.200111.3V159 Y160 A167 L218V159-M163 PolarHBondContact O-N 3.1Å; V159-M163 VanDerWaalsContact O-N 3.13Å; Y160-M163 PolarHBondContact O-N 3.43Å; M163-A167 HydrophobicContact CE-CB 4.39Å; M163-A167 HydrophobicContact SD-CB 4.37Å; M163-L218 HydrophobicContact SD-CD1 3.3Å; M163-L218 WeakPolarHBondContact SD-CD1 3.17Å; M163-L218 HydrophobicContact SD-CD2 4.23Å; M163-L218 HydrophobicContact SD-CG 4.3Å
164D82.8Confident87.9Confident45 Ų4568.3 Ų68.324%0.24137%0.371CS..SBendtrans-97.3-164.3-174.263.121.8000111.4K145 H162 F166 A167 L168K145-D164 IonicContact NZ-OD2 3.96Å; K145-D164 PolarHBondContact NZ-OD2 3.49Å; H162-D164 PolarHBondContact O-N 3.35Å; D164-F166 PolarHBondContact O-N 2.92Å; D164-F166 WeakPolarHBondContact OD1-CA 3.19Å; D164-F166 WeakPolarHBondContact OD1-CB 3.31Å; D164-F166 WeakPolarHBondContact OD1-CD2 3.44Å; D164-F166 PolarHBondContact OD1-N 3.36Å; D164-F166 WeakPolarHBondContact OD2-CD2 3.38Å; D164-A167 PolarHBondContact O-N 3.39Å; D164-A167 PolarHBondContact OD1-N 2.82Å; D164-L168 PolarHBondContact O-N 2.88Å
165I84.2Confident88.5Confident119 Ų11965.8 Ų65.861%0.6136%0.358SS*.Hα-helixtrans-62-25.7176.4-169.460.2000112.6L168 A169I165-L168 HydrophobicContact CD1-CD2 4.24Å; I165-A169 WeakPolarHBondContact O-CB 3.35Å; I165-A169 PolarHBondContact O-N 2.95Å
166F83.8Confident88.8Confident53 Ų5366.4 Ų66.423%0.23236%0.355CS..Hα-helixtrans-72.7-43.6177.3-60.9-77.8000110.7D144 D164 L168 A169 H170 P313D144-F166 HydrophobicContact CB-CE2 4.37Å; D144-F166 HydrophobicContact CB-CZ 4.28Å; D164-F166 PolarHBondContact O-N 2.92Å; D164-F166 WeakPolarHBondContact OD1-CA 3.19Å; D164-F166 WeakPolarHBondContact OD1-CB 3.31Å; D164-F166 WeakPolarHBondContact OD1-CD2 3.44Å; D164-F166 PolarHBondContact OD1-N 3.36Å; D164-F166 WeakPolarHBondContact OD2-CD2 3.38Å; F166-L168 VanDerWaalsContact C-N 3.27Å; F166-L168 PolarHBondContact O-N 3.39Å; F166-A169 CarbonylContact O-C 3.59Å; F166-A169 WeakPolarHBondContact O-CA 3.41Å; F166-A169 WeakPolarHBondContact O-CB 3.24Å; F166-A169 PolarHBondContact O-N 2.88Å; F166-H170 PolarHBondContact O-CD2 3.45Å; F166-H170 PolarHBondContact O-N 3.33Å; F166-P313 HydrophobicContact CE1-CB 4.23Å
167A87.6Confident89.2Confident6 Ų660.4 Ų60.45%0.0532%0.323CS..Hα-helixtrans-56.8-42.4173.200000111.9M163 D164 H170 F171M163-A167 HydrophobicContact CE-CB 4.39Å; M163-A167 HydrophobicContact SD-CB 4.37Å; D164-A167 PolarHBondContact O-N 3.39Å; D164-A167 PolarHBondContact OD1-N 2.82Å; A167-H170 PolarHBondContact O-N 3.34Å; A167-F171 PolarHBondContact O-N 2.88Å
168L91Very high89.7Confident87 Ų8756.8 Ų56.846%0.45529%0.293SS..Hα-helixtrans-65.1-40.4173.7-17962.2000112.2D164 I165 F166 H170 F171 L172D164-L168 PolarHBondContact O-N 2.88Å; I165-L168 HydrophobicContact CD1-CD2 4.24Å; F166-L168 VanDerWaalsContact C-N 3.27Å; F166-L168 PolarHBondContact O-N 3.39Å; L168-H170 VanDerWaalsContact C-N 3.34Å; L168-F171 HydrophobicContact CD1-CD1 4.49Å; L168-F171 PolarHBondContact O-N 2.64Å; L168-L172 HydrophobicContact CD1-CD1 3.95Å; L168-L172 HydrophobicContact CD1-CG 3.96Å; L168-L172 HydrophobicContact CD2-CD1 4.43Å; L168-L172 HydrophobicContact CG-CD1 3.9Å; L168-L172 HydrophobicContact CG-CG 4.29Å; L168-L172 WeakPolarHBondContact O-CB 3.41Å; L168-L172 WeakPolarHBondContact O-CG 3.3Å; L168-L172 PolarHBondContact O-N 2.75Å
169A90.4Very high90.1Very high54 Ų5455.4 Ų55.445%0.44629%0.29SS..Hα-helixtrans-65-37.3177.200000112.1I165 F166 G173I165-A169 WeakPolarHBondContact O-CB 3.35Å; I165-A169 PolarHBondContact O-N 2.95Å; F166-A169 CarbonylContact O-C 3.59Å; F166-A169 WeakPolarHBondContact O-CA 3.41Å; F166-A169 WeakPolarHBondContact O-CB 3.24Å; F166-A169 PolarHBondContact O-N 2.88Å; A169-G173 WeakPolarHBondContact O-CA 3.33Å; A169-G173 PolarHBondContact O-N 3.03Å
170H92.5Very high90.6Very high34 Ų3455 Ų5516%0.15729%0.286CS..Hα-helixtrans-62.7-54.4173.1-78.2-132.7000109.2F166 A167 L168 L172 G173 W174 D219 C223F166-H170 PolarHBondContact O-CD2 3.45Å; F166-H170 PolarHBondContact O-N 3.33Å; A167-H170 PolarHBondContact O-N 3.34Å; L168-H170 VanDerWaalsContact C-N 3.34Å; H170-L172 PolarHBondContact O-N 2.68Å; H170-G173 PolarHBondContact O-N 2.85Å; H170-W174 PolarHBondContact O-N 3.22Å; H170-D219 IonicContact CE1-OD1 3.55Å; H170-D219 IonicContact CE1-OD2 2.94Å; H170-D219 PolarHBondContact CE1-OD2 3.21Å; H170-D219 VanDerWaalsContact ND1-CG 3.28Å; H170-D219 IonicContact ND1-OD1 3.01Å; H170-D219 PolarHBondContact ND1-OD1 3.47Å; H170-D219 IonicContact ND1-OD2 3.47Å; H170-D219 PolarHBondContact ND1-OD2 2.95Å; H170-C223 HydrophobicContact CB-CB 3.78Å
171F96Very high90.9Very high55 Ų5546 Ų4624%0.24125%0.251CS..Hα-helixtrans-54.3-53.3177.6172.7-98.7000113.3A167 L168 W174 L175 C223 L226 G227 C230A167-F171 PolarHBondContact O-N 2.88Å; L168-F171 HydrophobicContact CD1-CD1 4.49Å; L168-F171 PolarHBondContact O-N 2.64Å; F171-W174 PolarHBondContact O-N 2.94Å; F171-L175 HydrophobicContact CE1-CD1 4.25Å; F171-L175 HydrophobicContact CZ-CD1 4.18Å; F171-L175 WeakPolarHBondContact O-CB 3.25Å; F171-L175 PolarHBondContact O-N 3.39Å; F171-C223 WeakPolarHBondContact CA-O 3.3Å; F171-L226 HydrophobicContact CD2-CB 4.06Å; F171-L226 HydrophobicContact CE2-CB 3.98Å; F171-G227 WeakPolarHBondContact O-CA 3.31Å; F171-C230 HydrophobicContact CE2-CB 4.38Å; F171-C230 HydrophobicContact CZ-CB 4.24Å
172L95.3Very high91.3Very high78 Ų7844.4 Ų44.441%0.40823%0.234SC..Hα-helixtrans-66.9-38.7-179.1-70.7178000111.9L168 H170 L175 I176L168-L172 HydrophobicContact CD1-CD1 3.95Å; L168-L172 HydrophobicContact CD1-CG 3.96Å; L168-L172 HydrophobicContact CD2-CD1 4.43Å; L168-L172 HydrophobicContact CG-CD1 3.9Å; L168-L172 HydrophobicContact CG-CG 4.29Å; L168-L172 WeakPolarHBondContact O-CB 3.41Å; L168-L172 WeakPolarHBondContact O-CG 3.3Å; L168-L172 PolarHBondContact O-N 2.75Å; H170-L172 PolarHBondContact O-N 2.68Å; L172-L175 PolarHBondContact O-N 3.36Å; L172-I176 WeakPolarHBondContact O-CG1 3.32Å; L172-I176 PolarHBondContact O-N 2.97Å
173G94.6Very high91.7Very high23 Ų2344.7 Ų44.724%0.23724%0.235CC..Hα-helixtrans-56.3-57.1174.600000110.2A169 H170 L175 I176 K177A169-G173 WeakPolarHBondContact O-CA 3.33Å; A169-G173 PolarHBondContact O-N 3.03Å; H170-G173 PolarHBondContact O-N 2.85Å; G173-L175 VanDerWaalsContact C-N 3.31Å; G173-L175 PolarHBondContact O-N 3.15Å; G173-I176 PolarHBondContact O-N 2.85Å; G173-K177 VanDerWaalsContact O-CG 3.28Å; G173-K177 WeakPolarHBondContact O-CG 3Å; G173-K177 PolarHBondContact O-N 3.17Å
174W96.8Very high92Very high5 Ų541.6 Ų41.62%0.01922%0.219CC..Hα-helixtrans-65.2-31.3-179.2-74.6102.8000114H170 F171 K177 A178 A187 L190 S191 W194 N224 I228H170-W174 PolarHBondContact O-N 3.22Å; F171-W174 PolarHBondContact O-N 2.94Å; W174-K177 HydrophobicContact CD2-CD 4.14Å; W174-K177 HydrophobicContact CE3-CB 4.36Å; W174-K177 HydrophobicContact CE3-CD 3.91Å; W174-K177 HydrophobicContact CH2-CD 4.09Å; W174-K177 HydrophobicContact CZ2-CD 4.39Å; W174-K177 HydrophobicContact CZ3-CD 3.89Å; W174-A178 WeakPolarHBondContact O-CB 3.18Å; W174-A178 PolarHBondContact O-N 3.48Å; W174-A187 VanDerWaalsContact CZ3-O 3.31Å; W174-A187 WeakPolarHBondContact CZ3-O 3.22Å; W174-L190 VanDerWaalsContact CH2-C 3.42Å; W174-L190 HydrophobicContact CH2-CB 3.89Å; W174-L190 HydrophobicContact CZ3-CB 3.95Å; W174-S191 VanDerWaalsContact CZ2-CA 3.41Å; W174-W194 HydrophobicContact CZ2-CB 4.32Å; W174-N224 HydrophobicContact CB-CB 4.44Å; W174-N224 VanDerWaalsContact CD1-CB 3.44Å; W174-N224 HydrophobicContact CD2-CB 4.01Å; W174-N224 HydrophobicContact CG-CB 3.71Å; W174-N224 PolarHBondContact NE1-ND2 2.72Å; W174-N224 PolarHBondContact NE1-OD1 3.41Å; W174-I228 HydrophobicContact CB-CG1 4.25Å; W174-I228 HydrophobicContact CE3-CD1 3.99Å; W174-I228 HydrophobicContact CE3-CG1 4.03Å
175L97.1Very high92.4Very high35 Ų3541.2 Ų41.218%0.18322%0.217CC..Hα-helixtrans-59.5-48.8168.6179.1152.2000111.3F171 L172 G173 A178 I179 G227 C230F171-L175 HydrophobicContact CE1-CD1 4.25Å; F171-L175 HydrophobicContact CZ-CD1 4.18Å; F171-L175 WeakPolarHBondContact O-CB 3.25Å; F171-L175 PolarHBondContact O-N 3.39Å; L172-L175 PolarHBondContact O-N 3.36Å; G173-L175 VanDerWaalsContact C-N 3.31Å; G173-L175 PolarHBondContact O-N 3.15Å; L175-A178 PolarHBondContact O-N 2.92Å; L175-I179 HydrophobicContact CD2-CD1 3.47Å; L175-I179 VanDerWaalsContact CD2-CD1 3.47Å; L175-I179 HydrophobicContact CG-CD1 4.23Å; L175-I179 WeakPolarHBondContact O-CD1 3.2Å; L175-I179 WeakPolarHBondContact O-CG1 3.22Å; L175-I179 PolarHBondContact O-N 2.91Å; L175-G227 VanDerWaalsContact CA-O 3.25Å; L175-G227 WeakPolarHBondContact CA-O 3.34Å; L175-C230 HydrophobicContact CD1-CB 3.99Å
176I95.3Very high92.8Very high73 Ų7335.7 Ų35.737%0.37419%0.189SC..Hα-helixtrans-65.7-46.3178.2-67168.1000110.6L172 G173 A178 I179 L180 T326L172-I176 WeakPolarHBondContact O-CG1 3.32Å; L172-I176 PolarHBondContact O-N 2.97Å; G173-I176 PolarHBondContact O-N 2.85Å; I176-A178 VanDerWaalsContact C-N 3.29Å; I176-A178 PolarHBondContact O-N 3.36Å; I176-I179 WeakPolarHBondContact O-CB 3.45Å; I176-I179 PolarHBondContact O-N 3.01Å; I176-L180 HydrophobicContact CG2-CD1 4.11Å; I176-L180 HydrophobicContact CG2-CG 4.32Å; I176-L180 WeakPolarHBondContact O-CG 3.43Å; I176-L180 PolarHBondContact O-N 3.46Å; I176-T326 HydrophobicContact CG2-CG2 3.89Å
177K95.9Very high93.4Very high33 Ų3333.2 Ų33.214%0.14318%0.178CC..Hα-helixtrans-57.6-43.1178-61.6-176.4-168.7173.90111.1G173 W174 I179 L180 L181 W295 E299G173-K177 VanDerWaalsContact O-CG 3.28Å; G173-K177 WeakPolarHBondContact O-CG 3Å; G173-K177 PolarHBondContact O-N 3.17Å; W174-K177 HydrophobicContact CD2-CD 4.14Å; W174-K177 HydrophobicContact CE3-CB 4.36Å; W174-K177 HydrophobicContact CE3-CD 3.91Å; W174-K177 HydrophobicContact CH2-CD 4.09Å; W174-K177 HydrophobicContact CZ2-CD 4.39Å; W174-K177 HydrophobicContact CZ3-CD 3.89Å; K177-I179 VanDerWaalsContact C-N 3.34Å; K177-I179 PolarHBondContact O-N 2.92Å; K177-L180 PolarHBondContact O-N 2.89Å; K177-L181 WeakPolarHBondContact O-CB 3.32Å; K177-L181 PolarHBondContact O-N 3.14Å; K177-W295 HydrophobicContact CB-CZ2 4.03Å; K177-W295 HydrophobicContact CD-CZ2 4.09Å; K177-W295 HydrophobicContact CG-CZ2 3.78Å; K177-E299 WeakPolarHBondContact CE-OE1 3.28Å; K177-E299 IonicContact NZ-OE1 3.38Å; K177-E299 PolarHBondContact NZ-OE1 3.36Å; K177-E299 IonicContact NZ-OE2 3.98Å; K177-E299 PolarHBondContact NZ-OE2 3.28Å
178A95.8Very high93.7Very high0 Ų035.7 Ų35.70%019%0.186CC..Hα-helixtrans-65-34.6175.600000112.7W174 L175 I176 R182 I228 M232W174-A178 WeakPolarHBondContact O-CB 3.18Å; W174-A178 PolarHBondContact O-N 3.48Å; L175-A178 PolarHBondContact O-N 2.92Å; I176-A178 VanDerWaalsContact C-N 3.29Å; I176-A178 PolarHBondContact O-N 3.36Å; A178-R182 WeakPolarHBondContact O-CA 3.33Å; A178-R182 PolarHBondContact O-N 2.85Å; A178-I228 HydrophobicContact CB-CB 4.49Å; A178-I228 HydrophobicContact CB-CG2 4.46Å; A178-M232 HydrophobicContact CB-CG 4.47Å
179I93.8Very high93.9Very high32 Ų3232.5 Ų32.516%0.16417%0.17CC..Hα-helixtrans-69.3-34.3174.3-68.6163.9000112.5L175 I176 K177 R182 L234 W270L175-I179 HydrophobicContact CD2-CD1 3.47Å; L175-I179 VanDerWaalsContact CD2-CD1 3.47Å; L175-I179 HydrophobicContact CG-CD1 4.23Å; L175-I179 WeakPolarHBondContact O-CD1 3.2Å; L175-I179 WeakPolarHBondContact O-CG1 3.22Å; L175-I179 PolarHBondContact O-N 2.91Å; I176-I179 WeakPolarHBondContact O-CB 3.45Å; I176-I179 PolarHBondContact O-N 3.01Å; K177-I179 VanDerWaalsContact C-N 3.34Å; K177-I179 PolarHBondContact O-N 2.92Å; I179-R182 WeakPolarHBondContact O-CG 3.47Å; I179-R182 PolarHBondContact O-NE 3.32Å; I179-R182 VanDerWaalsContact O-NE 3.15Å; I179-L234 HydrophobicContact CD1-CD2 3.66Å; I179-L234 HydrophobicContact CG1-CD2 4.44Å; I179-W270 HydrophobicContact CG2-CH2 3.58Å; I179-W270 HydrophobicContact CG2-CZ2 3.98Å
180L93.4Very high94.2Very high35 Ų3530 Ų3018%0.18315%0.149CC..Hα-helixtrans-72.9-45.1177.8-67.2178.2000111.8I176 K177 W295 S329 A330 I333I176-L180 HydrophobicContact CG2-CD1 4.11Å; I176-L180 HydrophobicContact CG2-CG 4.32Å; I176-L180 WeakPolarHBondContact O-CG 3.43Å; I176-L180 PolarHBondContact O-N 3.46Å; K177-L180 PolarHBondContact O-N 2.89Å; L180-W295 HydrophobicContact CB-CH2 4.4Å; L180-W295 HydrophobicContact CD1-CH2 4.33Å; L180-S329 WeakPolarHBondContact CD1-OG 3.31Å; L180-A330 HydrophobicContact CD2-CB 3.57Å; L180-I333 HydrophobicContact CB-CD1 3.91Å; L180-I333 HydrophobicContact CD1-CD1 4.06Å; L180-I333 HydrophobicContact CG-CD1 4.46Å
181L92.4Very high94.3Very high0 Ų028.4 Ų28.40%014%0.142CC..Hα-helixtrans-83-34.9-178.8-69.3166000112.9K177 H183 I186 L190 T273 W275 L291 W295K177-L181 WeakPolarHBondContact O-CB 3.32Å; K177-L181 PolarHBondContact O-N 3.14Å; L181-H183 PolarHBondContact O-N 3.04Å; L181-I186 HydrophobicContact CD1-CG2 4.24Å; L181-I186 HydrophobicContact CD2-CG2 4.28Å; L181-L190 HydrophobicContact CD1-CD1 3.37Å; L181-T273 PolarHBondContact O-OG1 2.93Å; L181-W275 PolarHBondContact O-NE1 3.05Å; L181-L291 HydrophobicContact CD2-CD2 4.09Å; L181-W295 HydrophobicContact CD1-CE3 4.45Å; L181-W295 HydrophobicContact CD1-CH2 4.1Å; L181-W295 HydrophobicContact CD1-CZ2 4.48Å; L181-W295 HydrophobicContact CD1-CZ3 4.06Å; L181-W295 HydrophobicContact CD2-CE3 4.07Å; L181-W295 HydrophobicContact CD2-CH2 4.36Å; L181-W295 HydrophobicContact CD2-CZ3 3.63Å; L181-W295 HydrophobicContact CG-CE3 4.48Å; L181-W295 HydrophobicContact CG-CH2 3.99Å; L181-W295 HydrophobicContact CG-CZ3 3.77Å
182R92.7Very high94.3Very high37 Ų3729.2 Ų29.214%0.1415%0.148CC..  trans51.138.7-178-48.3175-171.4170.7-0.9113.1A178 I179 W270 T271 T273A178-R182 WeakPolarHBondContact O-CA 3.33Å; A178-R182 PolarHBondContact O-N 2.85Å; I179-R182 WeakPolarHBondContact O-CG 3.47Å; I179-R182 PolarHBondContact O-NE 3.32Å; I179-R182 VanDerWaalsContact O-NE 3.15Å; R182-W270 VanDerWaalsContact NE-CZ2 3.31Å; R182-T271 PolarHBondContact NH1-O 2.93Å; R182-T273 VanDerWaalsContact CB-OG1 3.3Å; R182-T273 WeakPolarHBondContact CB-OG1 3Å; R182-T273 PolarHBondContact O-OG1 3.06Å
183H90.3Very high94.4Very high36 Ų3625.6 Ų25.617%0.16713%0.129CC..  trans-150.1116.4179.9-162.7-77.6000112.4L181 I185 I186 A187 L276L181-H183 PolarHBondContact O-N 3.04Å; H183-I185 PolarHBondContact ND1-N 2.89Å; H183-I185 PolarHBondContact O-N 3.44Å; H183-I186 HydrophobicContact CB-CB 4.43Å; H183-I186 HydrophobicContact CB-CD1 4.24Å; H183-I186 HydrophobicContact CB-CG1 4.47Å; H183-I186 PolarHBondContact O-N 3.41Å; H183-A187 WeakPolarHBondContact O-CB 3.41Å; H183-A187 PolarHBondContact O-N 2.91Å; H183-A187 VanDerWaalsContact O-N 3.1Å; H183-L276 VanDerWaalsContact CE1-CD1 3.44Å; H183-L276 WeakPolarHBondContact CE1-CD1 3.36Å
184H90.2Very high94.4Very high33 Ų3324.8 Ų24.815%0.15312%0.119CC..Hα-helixtrans-55.6-53.9-175.9-74-80.8000113I186 A187 W188 Q229 M232 R236H184-I186 VanDerWaalsContact C-N 3.32Å; H184-I186 PolarHBondContact O-N 2.7Å; H184-A187 PolarHBondContact O-N 3.1Å; H184-W188 VanDerWaalsContact O-CD1 3.27Å; H184-W188 PolarHBondContact O-N 2.96Å; H184-Q229 PolarHBondContact CE1-OE1 2.73Å; H184-M232 WeakPolarHBondContact CE1-CB 3.39Å; H184-M232 WeakPolarHBondContact CE1-CG 3.47Å; H184-R236 PolarHBondContact NE2-NH2 2.88Å
185I91.3Very high94.3Very high37 Ų3725 Ų2519%0.1912%0.12CC..Hα-helixtrans-62-39.7-172.1-63.6170.5000111.8H183 T189 T396 L403 I458H183-I185 PolarHBondContact ND1-N 2.89Å; H183-I185 PolarHBondContact O-N 3.44Å; I185-T189 WeakPolarHBondContact O-CB 3.43Å; I185-T189 PolarHBondContact O-N 2.86Å; I185-T189 PolarHBondContact O-OG1 3.45Å; I185-T396 HydrophobicContact CG2-CG2 3.7Å; I185-L403 HydrophobicContact CD1-CD1 3.77Å; I185-I458 HydrophobicContact CD1-CD1 4.29Å
186I92.8Very high94.2Very high4 Ų425.8 Ų25.82%0.02112%0.124CC..Hα-helixtrans-70.8-43.7-179.9-62.8173.6000109.3L181 H183 H184 T189 L190 W275 L276 I292L181-I186 HydrophobicContact CD1-CG2 4.24Å; L181-I186 HydrophobicContact CD2-CG2 4.28Å; H183-I186 HydrophobicContact CB-CB 4.43Å; H183-I186 HydrophobicContact CB-CD1 4.24Å; H183-I186 HydrophobicContact CB-CG1 4.47Å; H183-I186 PolarHBondContact O-N 3.41Å; H184-I186 VanDerWaalsContact C-N 3.32Å; H184-I186 PolarHBondContact O-N 2.7Å; I186-T189 PolarHBondContact O-N 3.38Å; I186-L190 HydrophobicContact CG2-CD1 4.07Å; I186-L190 WeakPolarHBondContact O-CG 3.5Å; I186-L190 PolarHBondContact O-N 3.47Å; I186-W275 HydrophobicContact CD1-CB 3.77Å; I186-W275 HydrophobicContact CD1-CG 3.88Å; I186-L276 HydrophobicContact CD1-CD1 4.38Å; I186-L276 HydrophobicContact CG1-CD1 4.36Å; I186-I292 HydrophobicContact CG2-CG1 4.19Å
187A95.2Very high94.2Very high0 Ų022.3 Ų22.30%011%0.106CC..Hα-helixtrans-62.4-45.1178.400000112.3W174 H183 H184 T189 L190 S191 I228W174-A187 VanDerWaalsContact CZ3-O 3.31Å; W174-A187 WeakPolarHBondContact CZ3-O 3.22Å; H183-A187 WeakPolarHBondContact O-CB 3.41Å; H183-A187 PolarHBondContact O-N 2.91Å; H183-A187 VanDerWaalsContact O-N 3.1Å; H184-A187 PolarHBondContact O-N 3.1Å; A187-T189 PolarHBondContact O-N 2.84Å; A187-L190 PolarHBondContact O-N 2.93Å; A187-S191 PolarHBondContact O-N 3.49Å; A187-I228 HydrophobicContact CB-CD1 4.05Å; A187-I228 HydrophobicContact CB-CG1 4.03Å; A187-I228 HydrophobicContact CB-CG2 4.05Å
188W95.1Very high94.2Very high59 Ų5921 Ų2122%0.22310%0.101CC..Hα-helixtrans-62.8-41.5175.2-85.3105.2000112.4H184 S191 I192 I220 G225 I228H184-W188 VanDerWaalsContact O-CD1 3.27Å; H184-W188 PolarHBondContact O-N 2.96Å; W188-S191 PolarHBondContact O-N 3.46Å; W188-I192 WeakPolarHBondContact O-CG1 3.36Å; W188-I192 PolarHBondContact O-N 3.18Å; W188-I220 HydrophobicContact CZ3-CG2 3.97Å; W188-G225 VanDerWaalsContact CH2-CA 3.42Å; W188-I228 HydrophobicContact CD2-CD1 4.12Å; W188-I228 HydrophobicContact CG-CD1 4.2Å
189T95.2Very high94Very high20 Ų2025.8 Ų25.812%0.12313%0.129CC..Hα-helixtrans-61.2-46.2176.4-60.10000111.2I185 I186 A187 S191 I192 N193 I292 T396I185-T189 WeakPolarHBondContact O-CB 3.43Å; I185-T189 PolarHBondContact O-N 2.86Å; I185-T189 PolarHBondContact O-OG1 3.45Å; I186-T189 PolarHBondContact O-N 3.38Å; A187-T189 PolarHBondContact O-N 2.84Å; T189-S191 VanDerWaalsContact C-N 3.27Å; T189-S191 PolarHBondContact O-N 2.81Å; T189-I192 PolarHBondContact O-N 2.75Å; T189-N193 WeakPolarHBondContact O-CB 3.46Å; T189-N193 VanDerWaalsContact O-CG 3.26Å; T189-N193 PolarHBondContact O-N 2.98Å; T189-I292 HydrophobicContact CG2-CD1 4.42Å; T189-I292 HydrophobicContact CG2-CG2 4.47Å; T189-T396 HydrophobicContact CG2-CG2 4.09Å; T189-T396 WeakPolarHBondContact CG2-OG1 3.29Å; T189-T396 WeakPolarHBondContact OG1-CG2 3.37Å; T189-T396 PolarHBondContact OG1-OG1 3.46Å; T189-T396 VanDerWaalsContact OG1-OG1 3.06Å
190L96Very high94Very high1 Ų124.9 Ų24.91%0.00513%0.127CC..Hα-helixtrans-59.9-40.5175.7-74167.7000111.2W174 L181 I186 A187 N193 W194 I292 W295 Q296W174-L190 VanDerWaalsContact CH2-C 3.42Å; W174-L190 HydrophobicContact CH2-CB 3.89Å; W174-L190 HydrophobicContact CZ3-CB 3.95Å; L181-L190 HydrophobicContact CD1-CD1 3.37Å; I186-L190 HydrophobicContact CG2-CD1 4.07Å; I186-L190 WeakPolarHBondContact O-CG 3.5Å; I186-L190 PolarHBondContact O-N 3.47Å; A187-L190 PolarHBondContact O-N 2.93Å; L190-N193 PolarHBondContact O-N 2.87Å; L190-W194 WeakPolarHBondContact O-CB 3.27Å; L190-W194 PolarHBondContact O-N 2.99Å; L190-I292 HydrophobicContact CD2-CB 4.39Å; L190-I292 HydrophobicContact CD2-CG2 3.83Å; L190-W295 HydrophobicContact CD1-CD2 4.01Å; L190-W295 HydrophobicContact CD1-CE3 4.46Å; L190-W295 HydrophobicContact CD1-CG 4.02Å; L190-W295 HydrophobicContact CD2-CB 3.86Å; L190-W295 HydrophobicContact CD2-CG 3.83Å; L190-Q296 HydrophobicContact CD2-CG 4.22Å
191S96.2Very high94.1Very high0 Ų023.7 Ų23.70%012%0.12CC..Hα-helixtrans-63.3-49.1178.7-179.80000112.4W174 A187 W188 T189 N193 W194 E195 N224W174-S191 VanDerWaalsContact CZ2-CA 3.41Å; A187-S191 PolarHBondContact O-N 3.49Å; W188-S191 PolarHBondContact O-N 3.46Å; T189-S191 VanDerWaalsContact C-N 3.27Å; T189-S191 PolarHBondContact O-N 2.81Å; S191-N193 PolarHBondContact O-N 3.03Å; S191-W194 WeakPolarHBondContact O-CB 3.41Å; S191-W194 PolarHBondContact O-N 3.17Å; S191-E195 PolarHBondContact O-N 2.8Å; S191-N224 WeakPolarHBondContact OG-CB 3.31Å; S191-N224 PolarHBondContact OG-ND2 3.35Å
192I95.3Very high94Very high72 Ų7225.3 Ų25.337%0.36913%0.131SC..Hα-helixtrans-64.6-42.8177.5-65164.8000110.8W188 T189 W194 E195 I196 I220W188-I192 WeakPolarHBondContact O-CG1 3.36Å; W188-I192 PolarHBondContact O-N 3.18Å; T189-I192 PolarHBondContact O-N 2.75Å; I192-W194 PolarHBondContact O-N 2.93Å; I192-E195 PolarHBondContact O-N 3.38Å; I192-I196 HydrophobicContact CG2-CD1 3.94Å; I192-I196 WeakPolarHBondContact O-CG1 3.49Å; I192-I196 PolarHBondContact O-N 3.18Å; I192-I196 VanDerWaalsContact O-N 3.16Å; I192-I220 HydrophobicContact CG1-CD1 4.45Å; I192-I220 HydrophobicContact CG1-CG2 4.23Å
193N96.3Very high93.9Very high2 Ų226.7 Ų26.71%0.01114%0.139CC..Hα-helixtrans-64.6-30.2177.7-80-10.4000112.4T189 L190 S191 I196 T197 Q296 W388 M389 S392T189-N193 WeakPolarHBondContact O-CB 3.46Å; T189-N193 VanDerWaalsContact O-CG 3.26Å; T189-N193 PolarHBondContact O-N 2.98Å; L190-N193 PolarHBondContact O-N 2.87Å; S191-N193 PolarHBondContact O-N 3.03Å; N193-I196 PolarHBondContact O-N 2.92Å; N193-T197 WeakPolarHBondContact O-CB 3.26Å; N193-T197 PolarHBondContact O-N 3Å; N193-T197 PolarHBondContact O-OG1 3.47Å; N193-Q296 HydrophobicContact CB-CG 4.46Å; N193-Q296 PolarHBondContact O-NE2 3.38Å; N193-W388 PolarHBondContact OD1-NE1 3.17Å; N193-M389 HydrophobicContact CB-CE 3.83Å; N193-M389 HydrophobicContact CB-SD 3.76Å; N193-M389 WeakPolarHBondContact O-CE 3.38Å; N193-S392 PolarHBondContact ND2-OG 3.04Å; N193-S392 PolarHBondContact OD1-OG 3.42Å; N193-S392 VanDerWaalsContact OD1-OG 3.06Å
194W96.1Very high93.9Very high7 Ų725.5 Ų25.53%0.02713%0.134CC..Hα-helixtrans-64-51.2175.8-174.2-102.2000110.8W174 L190 S191 I192 I196 T197 E198 F208 E299 L300 F303W174-W194 HydrophobicContact CZ2-CB 4.32Å; L190-W194 WeakPolarHBondContact O-CB 3.27Å; L190-W194 PolarHBondContact O-N 2.99Å; S191-W194 WeakPolarHBondContact O-CB 3.41Å; S191-W194 PolarHBondContact O-N 3.17Å; I192-W194 PolarHBondContact O-N 2.93Å; W194-I196 VanDerWaalsContact C-N 3.28Å; W194-I196 PolarHBondContact O-N 3.35Å; W194-T197 HydrophobicContact CZ3-CG2 4.47Å; W194-T197 CarbonylContact O-C 3.43Å; W194-T197 WeakPolarHBondContact O-CA 3.42Å; W194-T197 WeakPolarHBondContact O-CB 3.3Å; W194-T197 PolarHBondContact O-N 3.4Å; W194-E198 PolarHBondContact NE1-OE1 3.18Å; W194-E198 PolarHBondContact O-N 3.36Å; W194-F208 HydrophobicContact CH2-CZ 4.32Å; W194-F208 HydrophobicContact CZ2-CE1 4.29Å; W194-F208 HydrophobicContact CZ2-CZ 4.07Å; W194-E299 HydrophobicContact CE3-CB 3.8Å; W194-E299 HydrophobicContact CH2-CB 3.68Å; W194-E299 HydrophobicContact CZ3-CB 3.22Å; W194-E299 HydrophobicContact CZ3-CG 4.42Å; W194-L300 HydrophobicContact CZ3-CB 4.45Å; W194-F303 AromaticContact CH2-CD2 3.58Å; W194-F303 HydrophobicContact CH2-CD2 3.58Å; W194-F303 AromaticContact CH2-CE2 3.72Å; W194-F303 HydrophobicContact CH2-CE2 3.72Å; W194-F303 HydrophobicContact CH2-CG 4.44Å; W194-F303 AromaticContact CZ2-CD2 3.55Å; W194-F303 HydrophobicContact CZ2-CD2 3.55Å; W194-F303 AromaticContact CZ2-CE2 3.27Å; W194-F303 HydrophobicContact CZ2-CE2 3.27Å; W194-F303 HydrophobicContact CZ2-CG 4.34Å; W194-F303 AromaticContact CZ2-CZ 3.85Å; W194-F303 HydrophobicContact CZ2-CZ 3.85Å
195E94.9Very high94Very high8 Ų824 Ų244%0.03713%0.127CC..Hα-helixtrans-59-39175.9-58.6-44.3134.800112.9S191 I192 T197 E198 V199 I220 N224S191-E195 PolarHBondContact O-N 2.8Å; I192-E195 PolarHBondContact O-N 3.38Å; E195-T197 VanDerWaalsContact C-N 3.26Å; E195-T197 PolarHBondContact O-N 3.28Å; E195-E198 WeakPolarHBondContact O-CB 3.22Å; E195-E198 PolarHBondContact O-N 3.37Å; E195-E198 VanDerWaalsContact O-N 3.17Å; E195-V199 WeakPolarHBondContact O-CG2 3.45Å; E195-V199 PolarHBondContact O-N 3.31Å; E195-I220 HydrophobicContact CB-CD1 4.01Å; E195-I220 HydrophobicContact CB-CG1 4.33Å; E195-I220 HydrophobicContact CG-CD1 3.42Å; E195-I220 VanDerWaalsContact CG-CD1 3.42Å; E195-I220 HydrophobicContact CG-CG1 3.22Å; E195-N224 PolarHBondContact OE1-ND2 3.03Å
196I94.3Very high93.9Very high52 Ų5225.1 Ų25.127%0.26714%0.137SC..Hα-helixtrans-65.6-33.6175.8-66.4169.7000111.1I192 N193 W194 A200 W388 M389I192-I196 HydrophobicContact CG2-CD1 3.94Å; I192-I196 WeakPolarHBondContact O-CG1 3.49Å; I192-I196 PolarHBondContact O-N 3.18Å; I192-I196 VanDerWaalsContact O-N 3.16Å; N193-I196 PolarHBondContact O-N 2.92Å; W194-I196 VanDerWaalsContact C-N 3.28Å; W194-I196 PolarHBondContact O-N 3.35Å; I196-A200 WeakPolarHBondContact O-CB 3.46Å; I196-A200 PolarHBondContact O-N 3.29Å; I196-W388 HydrophobicContact CD1-CD2 4.38Å; I196-W388 VanDerWaalsContact CD1-CE2 3.44Å; I196-W388 HydrophobicContact CD1-CZ2 3.59Å; I196-W388 HydrophobicContact CG2-CG 4.33Å; I196-M389 HydrophobicContact CB-CE 4.44Å; I196-M389 HydrophobicContact CG2-CE 4.27Å
197T95.7Very high93.6Very high0 Ų025.3 Ų25.30%014%0.138CC..Hα-helixtrans-64.2-45.5172.1-55.10000110.1N193 W194 E195 V199 A200 F201 Q296 L300 W385 M389N193-T197 WeakPolarHBondContact O-CB 3.26Å; N193-T197 PolarHBondContact O-N 3Å; N193-T197 PolarHBondContact O-OG1 3.47Å; W194-T197 HydrophobicContact CZ3-CG2 4.47Å; W194-T197 CarbonylContact O-C 3.43Å; W194-T197 WeakPolarHBondContact O-CA 3.42Å; W194-T197 WeakPolarHBondContact O-CB 3.3Å; W194-T197 PolarHBondContact O-N 3.4Å; E195-T197 VanDerWaalsContact C-N 3.26Å; E195-T197 PolarHBondContact O-N 3.28Å; T197-V199 PolarHBondContact O-N 2.89Å; T197-A200 PolarHBondContact O-N 3.15Å; T197-F201 HydrophobicContact CG2-CD2 3.75Å; T197-F201 HydrophobicContact CG2-CE2 4.03Å; T197-F201 VanDerWaalsContact O-CD2 3.29Å; T197-F201 WeakPolarHBondContact O-CD2 3.4Å; T197-F201 PolarHBondContact O-N 2.9Å; T197-Q296 PolarHBondContact OG1-NE2 2.86Å; T197-L300 HydrophobicContact CG2-CD1 3.86Å; T197-L300 HydrophobicContact CG2-CD2 4.2Å; T197-L300 HydrophobicContact CG2-CG 4.46Å; T197-W385 HydrophobicContact CG2-CZ2 4.37Å; T197-W385 PolarHBondContact OG1-NE1 3.23Å; T197-M389 VanDerWaalsContact OG1-CE 3.31Å; T197-M389 WeakPolarHBondContact OG1-CE 3.42Å
198E94.3Very high93.5Very high7 Ų725.6 Ų25.63%0.03314%0.139CC..Hα-helixtrans-59.2-48.7177.9-62.1-153.7166.900111.7W194 E195 A200 F201 S202 F208W194-E198 PolarHBondContact NE1-OE1 3.18Å; W194-E198 PolarHBondContact O-N 3.36Å; E195-E198 WeakPolarHBondContact O-CB 3.22Å; E195-E198 PolarHBondContact O-N 3.37Å; E195-E198 VanDerWaalsContact O-N 3.17Å; E198-A200 VanDerWaalsContact C-N 3.32Å; E198-A200 PolarHBondContact O-N 3.15Å; E198-F201 CarbonylContact O-C 3.54Å; E198-F201 PolarHBondContact O-N 3.39Å; E198-F201 VanDerWaalsContact O-N 3.17Å; E198-S202 WeakPolarHBondContact O-CA 3.3Å; E198-S202 WeakPolarHBondContact O-CB 3.5Å; E198-S202 PolarHBondContact O-N 2.97Å; E198-F208 HydrophobicContact CB-CB 3.91Å; E198-F208 HydrophobicContact CB-CD1 4.19Å; E198-F208 HydrophobicContact CB-CD2 4.19Å; E198-F208 HydrophobicContact CB-CG 3.89Å; E198-F208 HydrophobicContact CG-CB 4.47Å; E198-F208 HydrophobicContact CG-CD1 3.79Å; E198-F208 HydrophobicContact CG-CD2 4.28Å; E198-F208 HydrophobicContact CG-CE1 3.95Å; E198-F208 HydrophobicContact CG-CE2 4.41Å; E198-F208 HydrophobicContact CG-CG 3.97Å; E198-F208 HydrophobicContact CG-CZ 4.26Å
199V92.7Very high93.2Very high99 Ų9926.7 Ų26.760%0.615%0.149SC*.Hα-helixtrans-56.4-46.4175.3173.90000111.3E195 T197 F201 S202E195-V199 WeakPolarHBondContact O-CG2 3.45Å; E195-V199 PolarHBondContact O-N 3.31Å; T197-V199 PolarHBondContact O-N 2.89Å; V199-F201 VanDerWaalsContact C-N 3.31Å; V199-F201 PolarHBondContact O-N 2.82Å; V199-S202 PolarHBondContact O-N 3.22Å; V199-S202 PolarHBondContact O-OG 3.4Å
200A93.7Very high92.7Very high14 Ų1427.4 Ų27.412%0.11615%0.151CC..Hα-helixtrans-62.3-36.3-17900000112.9I196 T197 E198 H203 W385I196-A200 WeakPolarHBondContact O-CB 3.46Å; I196-A200 PolarHBondContact O-N 3.29Å; T197-A200 PolarHBondContact O-N 3.15Å; E198-A200 VanDerWaalsContact C-N 3.32Å; E198-A200 PolarHBondContact O-N 3.15Å; A200-H203 PolarHBondContact O-CE1 3.49Å; A200-H203 PolarHBondContact O-ND1 3.34Å; A200-W385 HydrophobicContact CB-CB 3.77Å; A200-W385 HydrophobicContact CB-CG 4.03Å
201F94.5Very high92.5Very high9 Ų927.7 Ų27.74%0.03915%0.153CC..Hα-helixtrans-102.82.4-176.2-71.1-82.7000114.6T197 E198 V199 H203 I204 L205 F208 L300 F304 L382 W385T197-F201 HydrophobicContact CG2-CD2 3.75Å; T197-F201 HydrophobicContact CG2-CE2 4.03Å; T197-F201 VanDerWaalsContact O-CD2 3.29Å; T197-F201 WeakPolarHBondContact O-CD2 3.4Å; T197-F201 PolarHBondContact O-N 2.9Å; E198-F201 CarbonylContact O-C 3.54Å; E198-F201 PolarHBondContact O-N 3.39Å; E198-F201 VanDerWaalsContact O-N 3.17Å; V199-F201 VanDerWaalsContact C-N 3.31Å; V199-F201 PolarHBondContact O-N 2.82Å; F201-H203 PolarHBondContact O-N 3.11Å; F201-H203 VanDerWaalsContact O-N 3.12Å; F201-I204 HydrophobicContact CD1-CD1 3.9Å; F201-I204 HydrophobicContact CE1-CD1 4.45Å; F201-I204 PolarHBondContact O-N 3.27Å; F201-L205 PolarHBondContact O-N 3.29Å; F201-F208 HydrophobicContact CB-CD2 3.91Å; F201-F208 HydrophobicContact CB-CE2 4.12Å; F201-L300 HydrophobicContact CD2-CD1 4.14Å; F201-L300 HydrophobicContact CD2-CD2 4.2Å; F201-L300 HydrophobicContact CE1-CD2 4.49Å; F201-L300 HydrophobicContact CE2-CD1 4.42Å; F201-L300 HydrophobicContact CE2-CD2 3.64Å; F201-L300 HydrophobicContact CG-CD1 4.4Å; F201-L300 HydrophobicContact CZ-CD2 3.8Å; F201-F304 HydrophobicContact CD1-CE2 4.18Å; F201-F304 AromaticContact CD1-CZ 3.74Å; F201-F304 HydrophobicContact CD1-CZ 3.74Å; F201-F304 HydrophobicContact CE1-CE2 4.28Å; F201-F304 HydrophobicContact CE1-CZ 4.09Å; F201-F304 HydrophobicContact CG-CZ 4.48Å; F201-L382 HydrophobicContact CE1-CD1 4.13Å; F201-L382 HydrophobicContact CZ-CD1 3.65Å; F201-W385 AromaticContact CE2-CD2 3.77Å; F201-W385 HydrophobicContact CE2-CD2 3.77Å; F201-W385 AromaticContact CE2-CE2 3.74Å; F201-W385 HydrophobicContact CE2-CE3 4.15Å; F201-W385 HydrophobicContact CE2-CG 4.11Å; F201-W385 HydrophobicContact CE2-CH2 4.45Å; F201-W385 HydrophobicContact CE2-CZ2 4.11Å; F201-W385 HydrophobicContact CE2-CZ3 4.46Å; F201-W385 HydrophobicContact CZ-CD2 4.29Å; F201-W385 HydrophobicContact CZ-CE3 4.2Å; F201-W385 HydrophobicContact CZ-CZ3 4.34Å
202S92.2Very high92.1Very high34 Ų3434.3 Ų34.324%0.23818%0.178CC..THydrogen-bonded Turntrans-54.1-31.3179.659.20000114.7E198 V199 I204 L205E198-S202 WeakPolarHBondContact O-CA 3.3Å; E198-S202 WeakPolarHBondContact O-CB 3.5Å; E198-S202 PolarHBondContact O-N 2.97Å; V199-S202 PolarHBondContact O-N 3.22Å; V199-S202 PolarHBondContact O-OG 3.4Å; S202-I204 VanDerWaalsContact C-N 3.31Å; S202-I204 PolarHBondContact O-N 2.94Å; S202-L205 CarbonylContact O-C 3.36Å
203H89.8Confident91.9Very high66 Ų6631.3 Ų31.331%0.30616%0.163SC..THydrogen-bonded Turntrans-70.8-23.4176.466.5-74.4000113.8A200 F201 V378A200-H203 PolarHBondContact O-CE1 3.49Å; A200-H203 PolarHBondContact O-ND1 3.34Å; F201-H203 PolarHBondContact O-N 3.11Å; F201-H203 VanDerWaalsContact O-N 3.12Å; H203-V378 PolarHBondContact CD2-N 3.35Å; H203-V378 PolarHBondContact NE2-N 3.42Å
204I91.3Very high91.6Very high12 Ų1231.7 Ų31.76%0.06216%0.164CC..THydrogen-bonded Turntrans-97.4-40.3178-68158.1000110.8F201 S202 P206 F304 I373 T377F201-I204 HydrophobicContact CD1-CD1 3.9Å; F201-I204 HydrophobicContact CE1-CD1 4.45Å; F201-I204 PolarHBondContact O-N 3.27Å; S202-I204 VanDerWaalsContact C-N 3.31Å; S202-I204 PolarHBondContact O-N 2.94Å; I204-P206 WeakPolarHBondContact O-CD 3.36Å; I204-F304 HydrophobicContact CG2-CE1 3.79Å; I204-F304 HydrophobicContact CG2-CZ 4.38Å; I204-I373 HydrophobicContact CG2-CG2 3.26Å; I204-T377 HydrophobicContact CD1-CG2 3.95Å; I204-T377 WeakPolarHBondContact CD1-OG1 3.06Å
205L91.6Very high91.3Very high0 Ų032.2 Ų32.20%017%0.169CC..  trans-112.699-176.7-67.5175.3000109F201 S202 N207 F208 F303 F304 H307F201-L205 PolarHBondContact O-N 3.29Å; S202-L205 CarbonylContact O-C 3.36Å; L205-N207 PolarHBondContact O-N 3.31Å; L205-F208 HydrophobicContact CB-CB 4.47Å; L205-F208 HydrophobicContact CB-CD2 3.8Å; L205-F208 HydrophobicContact CB-CE2 4.27Å; L205-F208 HydrophobicContact CB-CG 4.07Å; L205-F208 HydrophobicContact CD1-CD2 3.8Å; L205-F208 HydrophobicContact CD1-CE2 3.39Å; L205-F208 HydrophobicContact CD1-CZ 3.87Å; L205-F208 HydrophobicContact CG-CD2 4.41Å; L205-F208 HydrophobicContact CG-CE2 4.44Å; L205-F208 WeakPolarHBondContact O-CB 3.42Å; L205-F208 PolarHBondContact O-N 3.14Å; L205-F303 HydrophobicContact CD1-CB 4.29Å; L205-F304 HydrophobicContact CD1-CD1 4.26Å; L205-F304 HydrophobicContact CD1-CE1 4.03Å; L205-F304 HydrophobicContact CD1-CE2 4.43Å; L205-F304 HydrophobicContact CD1-CZ 4.11Å; L205-F304 HydrophobicContact CD2-CD1 4.34Å; L205-F304 HydrophobicContact CD2-CE1 4.33Å; L205-F304 HydrophobicContact CG-CE1 4.15Å; L205-H307 HydrophobicContact CD2-CB 3.63Å; L205-H307 VanDerWaalsContact CD2-CG 3.43Å
206P88.4Confident91.1Very high61 Ų6136.1 Ų36.140%0.39619%0.19SC..G310 helixtrans-59.5-24.9-176.6-25.133.9000113.9L143 I204 F208 N209L143-P206 HydrophobicContact CD1-CB 4.19Å; L143-P206 HydrophobicContact CD2-CB 4.18Å; I204-P206 WeakPolarHBondContact O-CD 3.36Å; P206-F208 PolarHBondContact O-N 3.48Å; P206-N209 WeakPolarHBondContact O-CB 3.42Å; P206-N209 PolarHBondContact O-N 2.85Å
207N87.6Confident90.9Very high9 Ų937.6 Ų37.65%0.04820%0.197CC..G310 helixtrans-70.8-9.2175.969.1-90.3000114.2L143 Y147 L205L143-N207 HydrophobicContact CD2-CB 3.81Å; Y147-N207 HydrophobicContact CE1-CB 4.34Å; Y147-N207 WeakPolarHBondContact CE1-O 3.48Å; Y147-N207 HydrophobicContact CE2-CB 4.17Å; L205-N207 PolarHBondContact O-N 3.31Å
208F91.4Very high90.7Very high6 Ų638.2 Ų38.23%0.02620%0.201CC..G310 helixtrans-93.7-1.5173.5-73.3-13000112.3W194 E198 F201 L205 P206 E210 L300 F303W194-F208 HydrophobicContact CH2-CZ 4.32Å; W194-F208 HydrophobicContact CZ2-CE1 4.29Å; W194-F208 HydrophobicContact CZ2-CZ 4.07Å; E198-F208 HydrophobicContact CB-CB 3.91Å; E198-F208 HydrophobicContact CB-CD1 4.19Å; E198-F208 HydrophobicContact CB-CD2 4.19Å; E198-F208 HydrophobicContact CB-CG 3.89Å; E198-F208 HydrophobicContact CG-CB 4.47Å; E198-F208 HydrophobicContact CG-CD1 3.79Å; E198-F208 HydrophobicContact CG-CD2 4.28Å; E198-F208 HydrophobicContact CG-CE1 3.95Å; E198-F208 HydrophobicContact CG-CE2 4.41Å; E198-F208 HydrophobicContact CG-CG 3.97Å; E198-F208 HydrophobicContact CG-CZ 4.26Å; F201-F208 HydrophobicContact CB-CD2 3.91Å; F201-F208 HydrophobicContact CB-CE2 4.12Å; L205-F208 HydrophobicContact CB-CB 4.47Å; L205-F208 HydrophobicContact CB-CD2 3.8Å; L205-F208 HydrophobicContact CB-CE2 4.27Å; L205-F208 HydrophobicContact CB-CG 4.07Å; L205-F208 HydrophobicContact CD1-CD2 3.8Å; L205-F208 HydrophobicContact CD1-CE2 3.39Å; L205-F208 HydrophobicContact CD1-CZ 3.87Å; L205-F208 HydrophobicContact CG-CD2 4.41Å; L205-F208 HydrophobicContact CG-CE2 4.44Å; L205-F208 WeakPolarHBondContact O-CB 3.42Å; L205-F208 PolarHBondContact O-N 3.14Å; P206-F208 PolarHBondContact O-N 3.48Å; F208-E210 VanDerWaalsContact C-N 3.31Å; F208-E210 PolarHBondContact O-N 2.86Å; F208-E210 VanDerWaalsContact O-N 3.1Å; F208-L300 HydrophobicContact CE2-CD1 4.22Å; F208-F303 HydrophobicContact CD1-CD1 4.41Å; F208-F303 HydrophobicContact CE1-CB 4.27Å; F208-F303 AromaticContact CE1-CD1 3.32Å; F208-F303 HydrophobicContact CE1-CD1 3.32Å; F208-F303 HydrophobicContact CE1-CD2 4.48Å; F208-F303 AromaticContact CE1-CE1 3.66Å; F208-F303 HydrophobicContact CE1-CE1 3.66Å; F208-F303 AromaticContact CE1-CG 3.79Å; F208-F303 HydrophobicContact CE1-CG 3.79Å; F208-F303 HydrophobicContact CE1-CZ 4.37Å; F208-F303 HydrophobicContact CZ-CB 3.75Å; F208-F303 AromaticContact CZ-CD1 3.7Å; F208-F303 HydrophobicContact CZ-CD1 3.7Å; F208-F303 HydrophobicContact CZ-CD2 4.29Å; F208-F303 HydrophobicContact CZ-CE1 4.37Å; F208-F303 AromaticContact CZ-CG 3.66Å; F208-F303 HydrophobicContact CZ-CG 3.66Å
209N89.3Confident90.6Very high81 Ų8138.2 Ų38.243%0.43320%0.201SC..  trans-85.977.9176.9-164.715.3000109.4Y147 A148 P206Y147-N209 CarbonylContact C-O 3.17Å; Y147-N209 WeakPolarHBondContact CB-O 3.43Å; A148-N209 HydrophobicContact CB-CB 4.17Å; A148-N209 VanDerWaalsContact CB-CG 3.42Å; A148-N209 WeakPolarHBondContact CB-ND2 3.25Å; A148-N209 WeakPolarHBondContact CB-O 3.31Å; A148-N209 WeakPolarHBondContact CB-OD1 3.42Å; A148-N209 PolarHBondContact N-O 3.06Å; P206-N209 WeakPolarHBondContact O-CB 3.42Å; P206-N209 PolarHBondContact O-N 2.85Å
210E86.2Confident90.5Very high36 Ų3634.3 Ų34.317%0.16818%0.177CC..  trans-96.1164.1-179.2-58.4-166.9162.400112Y147 F208 D214Y147-E210 HydrophobicContact CD1-CG 4.29Å; F208-E210 VanDerWaalsContact C-N 3.31Å; F208-E210 PolarHBondContact O-N 2.86Å; F208-E210 VanDerWaalsContact O-N 3.1Å; E210-D214 HydrophobicContact CB-CB 4.46Å
211C90.1Very high90.4Very high7 Ų738.4 Ų38.45%0.04720%0.196CC..  trans-69.8149.8173.6-68.20000110.9C151 W213 D214 S215C151-C211 WeakPolarHBondContact CA-SG 3.5Å; C151-C211 HydrophobicContact CB-CB 3.6Å; C151-C211 WeakPolarHBondContact CB-SG 3.42Å; C151-C211 WeakPolarHBondContact SG-CA 3.44Å; C151-C211 WeakPolarHBondContact SG-CB 3.48Å; C151-C211 CovalentContact SG-SG 2.04Å; C151-C211 PolarHBondContact SG-SG 3.01Å; C211-W213 HydrophobicContact CB-CG 4.48Å; C211-W213 HydrophobicContact CB-CZ2 4.46Å; C211-W213 PolarHBondContact O-N 3.06Å; C211-D214 HydrophobicContact CB-CB 4.14Å; C211-D214 WeakPolarHBondContact O-CB 3.49Å; C211-D214 PolarHBondContact O-N 3.19Å; C211-S215 PolarHBondContact O-N 3.46Å; C211-S215 PolarHBondContact O-OG 3.11Å
212W89.5Confident90.3Very high138 Ų13840.6 Ų40.652%0.52321%0.21SC..Hα-helixtrans-59.6-33.3-178.668.2-92.9000113.3I154 S215 L216 I217I154-W212 HydrophobicContact CD1-CH2 4.22Å; I154-W212 HydrophobicContact CD1-CZ2 3.79Å; W212-S215 WeakPolarHBondContact CA-OG 3.33Å; W212-S215 PolarHBondContact O-OG 3.17Å; W212-L216 WeakPolarHBondContact O-CB 3.35Å; W212-L216 WeakPolarHBondContact O-CG 3.47Å; W212-L216 PolarHBondContact O-N 3.39Å; W212-I217 HydrophobicContact CZ3-CD1 4.05Å
213W90.6Very high90.5Very high10 Ų1039.3 Ų39.34%0.03820%0.201CC..Hα-helixtrans-79.7-26178.362-97.7000111.8C151 I154 R158 V159 H162 C211 I217 L218C151-W213 PolarHBondContact O-NE1 3.24Å; I154-W213 HydrophobicContact CD1-CB 4.1Å; I154-W213 HydrophobicContact CD1-CG 3.85Å; I154-W213 HydrophobicContact CG1-CG 4.18Å; R158-W213 HydrophobicContact CG-CH2 4.47Å; R158-W213 HydrophobicContact CG-CZ2 4.19Å; V159-W213 HydrophobicContact CG2-CH2 4.34Å; V159-W213 HydrophobicContact CG2-CZ3 4.11Å; H162-W213 HydrophobicContact CB-CH2 4.21Å; H162-W213 AromaticContact CG-CH2 3.78Å; H162-W213 AromaticContact ND1-CH2 3.83Å; C211-W213 HydrophobicContact CB-CG 4.48Å; C211-W213 HydrophobicContact CB-CZ2 4.46Å; C211-W213 PolarHBondContact O-N 3.06Å; W213-I217 HydrophobicContact CB-CD1 4.26Å; W213-I217 WeakPolarHBondContact O-CA 3.24Å; W213-I217 VanDerWaalsContact O-CB 3.25Å; W213-I217 WeakPolarHBondContact O-CB 3.43Å; W213-I217 PolarHBondContact O-N 3.33Å; W213-L218 PolarHBondContact O-N 3.42Å
214D89.3Confident90.8Very high9 Ų936.1 Ų36.15%0.04819%0.186CC..Iπ-helixtrans-67.9-63.3175-158.612.5000108.2H162 E210 C211 L216 L218 D219H162-D214 IonicContact CD2-OD2 2.81Å; H162-D214 PolarHBondContact CD2-OD2 3.46Å; E210-D214 HydrophobicContact CB-CB 4.46Å; C211-D214 HydrophobicContact CB-CB 4.14Å; C211-D214 WeakPolarHBondContact O-CB 3.49Å; C211-D214 PolarHBondContact O-N 3.19Å; D214-L216 PolarHBondContact O-N 3.32Å; D214-L218 CarbonylContact O-C 3.55Å; D214-L218 WeakPolarHBondContact O-CA 3.27Å; D214-L218 VanDerWaalsContact O-CB 3.27Å; D214-L218 WeakPolarHBondContact O-CB 3.3Å; D214-L218 PolarHBondContact O-N 3.12Å; D214-L218 VanDerWaalsContact OD1-CD2 3.23Å; D214-L218 WeakPolarHBondContact OD1-CD2 3.34Å; D214-D219 PolarHBondContact O-N 3.49Å
215S89.5Confident91Very high18 Ų1835.8 Ų35.813%0.12619%0.186CC..Iπ-helixtrans-53.2-52.5175.251.40000114.8C211 W212 D219 I220C211-S215 PolarHBondContact O-N 3.46Å; C211-S215 PolarHBondContact O-OG 3.11Å; W212-S215 WeakPolarHBondContact CA-OG 3.33Å; W212-S215 PolarHBondContact O-OG 3.17Å; S215-D219 WeakPolarHBondContact O-CB 3.19Å; S215-I220 WeakPolarHBondContact O-CG1 3.46Å; S215-I220 PolarHBondContact O-N 2.99Å; S215-I220 VanDerWaalsContact O-N 3.09Å
216L90.3Very high91.2Very high91 Ų9140.3 Ų40.348%0.47621%0.209SC..Iπ-helixtrans-80.9-45.3-173.5-63.9177.9000113.7W212 D214 I220 L221W212-L216 WeakPolarHBondContact O-CB 3.35Å; W212-L216 WeakPolarHBondContact O-CG 3.47Å; W212-L216 PolarHBondContact O-N 3.39Å; D214-L216 PolarHBondContact O-N 3.32Å; L216-I220 HydrophobicContact CD2-CD1 3.96Å; L216-L221 WeakPolarHBondContact O-CG 3.06Å; L216-L221 PolarHBondContact O-N 3.41Å
217I91.1Very high91.6Very high82 Ų8237.4 Ų37.442%0.42119%0.19SC..Iπ-helixtrans-92.1-54.6-172.5-54.2177000109.6W212 W213 L221 V222W212-I217 HydrophobicContact CZ3-CD1 4.05Å; W213-I217 HydrophobicContact CB-CD1 4.26Å; W213-I217 WeakPolarHBondContact O-CA 3.24Å; W213-I217 VanDerWaalsContact O-CB 3.25Å; W213-I217 WeakPolarHBondContact O-CB 3.43Å; W213-I217 PolarHBondContact O-N 3.33Å; I217-L221 WeakPolarHBondContact O-CB 3.31Å; I217-V222 WeakPolarHBondContact O-CG2 3.48Å; I217-V222 PolarHBondContact O-N 3.13Å
218L90.5Very high92.1Very high14 Ų1437 Ų377%0.07319%0.188CC..Iπ-helixtrans-69.5-47.5-175.2-167.268.6000111.1H162 M163 W213 D214 V222 C223H162-L218 HydrophobicContact CB-CD2 4.12Å; M163-L218 HydrophobicContact SD-CD1 3.3Å; M163-L218 WeakPolarHBondContact SD-CD1 3.17Å; M163-L218 HydrophobicContact SD-CD2 4.23Å; M163-L218 HydrophobicContact SD-CG 4.3Å; W213-L218 PolarHBondContact O-N 3.42Å; D214-L218 CarbonylContact O-C 3.55Å; D214-L218 WeakPolarHBondContact O-CA 3.27Å; D214-L218 VanDerWaalsContact O-CB 3.27Å; D214-L218 WeakPolarHBondContact O-CB 3.3Å; D214-L218 PolarHBondContact O-N 3.12Å; D214-L218 VanDerWaalsContact OD1-CD2 3.23Å; D214-L218 WeakPolarHBondContact OD1-CD2 3.34Å; L218-V222 WeakPolarHBondContact O-CB 3.45Å; L218-C223 WeakPolarHBondContact O-CB 3.36Å; L218-C223 PolarHBondContact O-N 3.18Å; L218-C223 PolarHBondContact O-SG 3.45Å
219D92.1Very high92.3Very high7 Ų739.5 Ų39.54%0.03720%0.2CC..Iπ-helixtrans-81.6-69.5-175.7-79.3-0.7000112.3H170 D214 S215 L221 C223 N224H170-D219 IonicContact CE1-OD1 3.55Å; H170-D219 IonicContact CE1-OD2 2.94Å; H170-D219 PolarHBondContact CE1-OD2 3.21Å; H170-D219 VanDerWaalsContact ND1-CG 3.28Å; H170-D219 IonicContact ND1-OD1 3.01Å; H170-D219 PolarHBondContact ND1-OD1 3.47Å; H170-D219 IonicContact ND1-OD2 3.47Å; H170-D219 PolarHBondContact ND1-OD2 2.95Å; D214-D219 PolarHBondContact O-N 3.49Å; S215-D219 WeakPolarHBondContact O-CB 3.19Å; D219-L221 PolarHBondContact O-N 3.47Å; D219-C223 PolarHBondContact O-N 3.21Å; D219-N224 VanDerWaalsContact C-CG 3.46Å; D219-N224 WeakPolarHBondContact O-CA 3.36Å; D219-N224 WeakPolarHBondContact O-CB 3.38Å; D219-N224 PolarHBondContact O-N 3.2Å; D219-N224 PolarHBondContact O-ND2 3Å; D219-N224 PolarHBondContact O-OD1 2.93Å
220I90.9Very high92.7Very high17 Ų1737.7 Ų37.79%0.08719%0.193CC..Iπ-helixtrans-57-55-176.4-65.1175.2000112.1W188 I192 E195 S215 L216 G225W188-I220 HydrophobicContact CZ3-CG2 3.97Å; I192-I220 HydrophobicContact CG1-CD1 4.45Å; I192-I220 HydrophobicContact CG1-CG2 4.23Å; E195-I220 HydrophobicContact CB-CD1 4.01Å; E195-I220 HydrophobicContact CB-CG1 4.33Å; E195-I220 HydrophobicContact CG-CD1 3.42Å; E195-I220 VanDerWaalsContact CG-CD1 3.42Å; E195-I220 HydrophobicContact CG-CG1 3.22Å; S215-I220 WeakPolarHBondContact O-CG1 3.46Å; S215-I220 PolarHBondContact O-N 2.99Å; S215-I220 VanDerWaalsContact O-N 3.09Å; L216-I220 HydrophobicContact CD2-CD1 3.96Å; I220-G225 PolarHBondContact O-N 3.04Å
221L92.6Very high93.1Very high99 Ų9936 Ų3652%0.51819%0.185SC..Iπ-helixtrans-81.5-44.8-168-66.1176.9000112.7L216 I217 D219L216-L221 WeakPolarHBondContact O-CG 3.06Å; L216-L221 PolarHBondContact O-N 3.41Å; I217-L221 WeakPolarHBondContact O-CB 3.31Å; D219-L221 PolarHBondContact O-N 3.47Å
222V92.9Very high93.3Very high56 Ų5636.3 Ų36.334%0.33919%0.186SC..Iπ-helixtrans-88.7-73.6-174.5177.90000111.1I217 L218 L226I217-V222 WeakPolarHBondContact O-CG2 3.48Å; I217-V222 PolarHBondContact O-N 3.13Å; L218-V222 WeakPolarHBondContact O-CB 3.45Å; V222-L226 HydrophobicContact CG1-CD1 3.93Å; V222-L226 WeakPolarHBondContact O-CB 3.36Å; V222-L226 WeakPolarHBondContact O-CD1 3.44Å; V222-L226 WeakPolarHBondContact O-CG 3.33Å; V222-L226 PolarHBondContact O-N 2.93Å
223C94.6Very high93.5Very high6 Ų636.8 Ų36.84%0.04119%0.188CC..Iπ-helixtrans-62-56.1-172.2-67.30000111.5H170 F171 L218 D219 G227H170-C223 HydrophobicContact CB-CB 3.78Å; F171-C223 WeakPolarHBondContact CA-O 3.3Å; L218-C223 WeakPolarHBondContact O-CB 3.36Å; L218-C223 PolarHBondContact O-N 3.18Å; L218-C223 PolarHBondContact O-SG 3.45Å; D219-C223 PolarHBondContact O-N 3.21Å; C223-G227 PolarHBondContact O-N 3.47Å
224N96.3Very high93.6Very high0 Ų039.3 Ų39.30%020%0.202CC..Iπ-helixtrans-68.7-49.2-177.1-53.7-9.8000109.9W174 S191 E195 D219 L226 G227 I228W174-N224 HydrophobicContact CB-CB 4.44Å; W174-N224 VanDerWaalsContact CD1-CB 3.44Å; W174-N224 HydrophobicContact CD2-CB 4.01Å; W174-N224 HydrophobicContact CG-CB 3.71Å; W174-N224 PolarHBondContact NE1-ND2 2.72Å; W174-N224 PolarHBondContact NE1-OD1 3.41Å; S191-N224 WeakPolarHBondContact OG-CB 3.31Å; S191-N224 PolarHBondContact OG-ND2 3.35Å; E195-N224 PolarHBondContact OE1-ND2 3.03Å; D219-N224 VanDerWaalsContact C-CG 3.46Å; D219-N224 WeakPolarHBondContact O-CA 3.36Å; D219-N224 WeakPolarHBondContact O-CB 3.38Å; D219-N224 PolarHBondContact O-N 3.2Å; D219-N224 PolarHBondContact O-ND2 3Å; D219-N224 PolarHBondContact O-OD1 2.93Å; N224-L226 PolarHBondContact O-N 3.25Å; N224-G227 PolarHBondContact O-N 3.46Å; N224-I228 VanDerWaalsContact O-CG1 3.25Å; N224-I228 WeakPolarHBondContact O-CG1 3.26Å; N224-I228 PolarHBondContact O-N 3Å
225G96Very high93.6Very high5 Ų539 Ų395%0.05220%0.2CC..Hα-helixtrans-58.4-47.3179.200000113.8W188 I220 I228 Q229W188-G225 VanDerWaalsContact CH2-CA 3.42Å; I220-G225 PolarHBondContact O-N 3.04Å; G225-I228 PolarHBondContact O-N 3.37Å; G225-Q229 WeakPolarHBondContact O-CB 3.46Å; G225-Q229 PolarHBondContact O-N 2.85Å
226L96.3Very high93.6Very high94 Ų9441 Ų4149%0.49221%0.205SC..Hα-helixtrans-67.2-39.7175.1-67.3174.6000111.6F171 V222 N224 Q229 C230F171-L226 HydrophobicContact CD2-CB 4.06Å; F171-L226 HydrophobicContact CE2-CB 3.98Å; V222-L226 HydrophobicContact CG1-CD1 3.93Å; V222-L226 WeakPolarHBondContact O-CB 3.36Å; V222-L226 WeakPolarHBondContact O-CD1 3.44Å; V222-L226 WeakPolarHBondContact O-CG 3.33Å; V222-L226 PolarHBondContact O-N 2.93Å; N224-L226 PolarHBondContact O-N 3.25Å; L226-Q229 PolarHBondContact O-N 3.25Å; L226-C230 VanDerWaalsContact O-CB 3.31Å; L226-C230 WeakPolarHBondContact O-CB 3.21Å; L226-C230 PolarHBondContact O-N 2.69Å; L226-C230 PolarHBondContact O-SG 3.45Å; L226-C230 VanDerWaalsContact O-SG 3.36Å
227G97.1Very high93.4Very high0 Ų043 Ų430%021%0.206CC..Hα-helixtrans-57.3-50174.900000111.3F171 L175 C223 N224 Q229 C230 G231F171-G227 WeakPolarHBondContact O-CA 3.31Å; L175-G227 VanDerWaalsContact CA-O 3.25Å; L175-G227 WeakPolarHBondContact CA-O 3.34Å; C223-G227 PolarHBondContact O-N 3.47Å; N224-G227 PolarHBondContact O-N 3.46Å; G227-Q229 PolarHBondContact O-N 3.49Å; G227-C230 PolarHBondContact O-N 2.98Å; G227-G231 PolarHBondContact O-N 3.46Å
228I97.1Very high93.2Very high0 Ų039.8 Ų39.80%019%0.19CC..Hα-helixtrans-57.9-49176.2-67.7166.4000110.6W174 A178 A187 W188 N224 G225 G231 M232W174-I228 HydrophobicContact CB-CG1 4.25Å; W174-I228 HydrophobicContact CE3-CD1 3.99Å; W174-I228 HydrophobicContact CE3-CG1 4.03Å; A178-I228 HydrophobicContact CB-CB 4.49Å; A178-I228 HydrophobicContact CB-CG2 4.46Å; A187-I228 HydrophobicContact CB-CD1 4.05Å; A187-I228 HydrophobicContact CB-CG1 4.03Å; A187-I228 HydrophobicContact CB-CG2 4.05Å; W188-I228 HydrophobicContact CD2-CD1 4.12Å; W188-I228 HydrophobicContact CG-CD1 4.2Å; N224-I228 VanDerWaalsContact O-CG1 3.25Å; N224-I228 WeakPolarHBondContact O-CG1 3.26Å; N224-I228 PolarHBondContact O-N 3Å; G225-I228 PolarHBondContact O-N 3.37Å; I228-G231 PolarHBondContact O-N 3.48Å; I228-M232 HydrophobicContact CG2-CG 4.42Å; I228-M232 VanDerWaalsContact O-CG 3.25Å; I228-M232 WeakPolarHBondContact O-CG 3.37Å; I228-M232 PolarHBondContact O-N 2.94Å
229Q96.7Very high92.8Very high59 Ų5942.1 Ų42.128%0.27620%0.201SC..Hα-helixtrans-63-47.5-177.6-17366.4-0.200112H184 G225 L226 G227 G231 M232 W233H184-Q229 PolarHBondContact CE1-OE1 2.73Å; G225-Q229 WeakPolarHBondContact O-CB 3.46Å; G225-Q229 PolarHBondContact O-N 2.85Å; L226-Q229 PolarHBondContact O-N 3.25Å; G227-Q229 PolarHBondContact O-N 3.49Å; Q229-G231 VanDerWaalsContact C-N 3.35Å; Q229-G231 PolarHBondContact O-N 2.8Å; Q229-M232 PolarHBondContact O-N 2.91Å; Q229-W233 HydrophobicContact CG-CD2 4.37Å; Q229-W233 HydrophobicContact CG-CZ2 4.01Å; Q229-W233 PolarHBondContact O-N 2.88Å
230C97Very high91.6Very high43 Ų4348.9 Ų48.929%0.29123%0.234SC..Hα-helixtrans-61.3-42.1176.2-74.50000111.9F171 L175 L226 G227 M232 W233 L234F171-C230 HydrophobicContact CE2-CB 4.38Å; F171-C230 HydrophobicContact CZ-CB 4.24Å; L175-C230 HydrophobicContact CD1-CB 3.99Å; L226-C230 VanDerWaalsContact O-CB 3.31Å; L226-C230 WeakPolarHBondContact O-CB 3.21Å; L226-C230 PolarHBondContact O-N 2.69Å; L226-C230 PolarHBondContact O-SG 3.45Å; L226-C230 VanDerWaalsContact O-SG 3.36Å; G227-C230 PolarHBondContact O-N 2.98Å; C230-M232 VanDerWaalsContact C-N 3.34Å; C230-M232 PolarHBondContact O-N 3.22Å; C230-W233 PolarHBondContact O-N 2.96Å; C230-L234 WeakPolarHBondContact O-CB 3.46Å; C230-L234 PolarHBondContact O-N 3.39Å
231G95.6Very high90.8Very high0 Ų051.6 Ų51.60%024%0.243CC..Hα-helixtrans-60.5-42.2175.700000112.3G227 I228 Q229 L234 C235G227-G231 PolarHBondContact O-N 3.46Å; I228-G231 PolarHBondContact O-N 3.48Å; Q229-G231 VanDerWaalsContact C-N 3.35Å; Q229-G231 PolarHBondContact O-N 2.8Å; G231-L234 PolarHBondContact O-N 3.38Å; G231-C235 PolarHBondContact O-N 2.84Å; G231-C235 PolarHBondContact O-SG 3.15Å
232M93.2Very high89.7Confident15 Ų1552.4 Ų52.47%0.07425%0.248CC..Hα-helixtrans-71.4-36.6177.7-66.9-59.9-55.800112.8A178 H184 I228 Q229 C230 L234 C235 R236A178-M232 HydrophobicContact CB-CG 4.47Å; H184-M232 WeakPolarHBondContact CE1-CB 3.39Å; H184-M232 WeakPolarHBondContact CE1-CG 3.47Å; I228-M232 HydrophobicContact CG2-CG 4.42Å; I228-M232 VanDerWaalsContact O-CG 3.25Å; I228-M232 WeakPolarHBondContact O-CG 3.37Å; I228-M232 PolarHBondContact O-N 2.94Å; Q229-M232 PolarHBondContact O-N 2.91Å; C230-M232 VanDerWaalsContact C-N 3.34Å; C230-M232 PolarHBondContact O-N 3.22Å; M232-L234 VanDerWaalsContact C-N 3.34Å; M232-C235 WeakPolarHBondContact O-CB 3.4Å; M232-C235 PolarHBondContact O-N 3.41Å; M232-R236 WeakPolarHBondContact O-CG 3.39Å; M232-R236 PolarHBondContact O-N 3.15Å
233W94Very high88.6Confident147 Ų14751.4 Ų51.456%0.55724%0.238SC*.Hα-helixtrans-61.2-43.6170.1-73.7-0.3000111.9Q229 C230 C235 R236 W237Q229-W233 HydrophobicContact CG-CD2 4.37Å; Q229-W233 HydrophobicContact CG-CZ2 4.01Å; Q229-W233 PolarHBondContact O-N 2.88Å; C230-W233 PolarHBondContact O-N 2.96Å; W233-C235 VanDerWaalsContact C-N 3.33Å; W233-C235 PolarHBondContact O-N 3.03Å; W233-R236 PolarHBondContact O-N 2.72Å; W233-W237 WeakPolarHBondContact O-CB 3.43Å; W233-W237 PolarHBondContact O-N 3.48Å
234L92.1Very high87.4Confident64 Ų6459.1 Ų59.134%0.33527%0.273SS..Hα-helixtrans-62.8-41175.8-178.157.9000111.4I179 C230 G231 M232 W237 L238I179-L234 HydrophobicContact CD1-CD2 3.66Å; I179-L234 HydrophobicContact CG1-CD2 4.44Å; C230-L234 WeakPolarHBondContact O-CB 3.46Å; C230-L234 PolarHBondContact O-N 3.39Å; G231-L234 PolarHBondContact O-N 3.38Å; M232-L234 VanDerWaalsContact C-N 3.34Å; L234-W237 HydrophobicContact CD1-CE3 3.73Å; L234-W237 HydrophobicContact CD1-CZ3 4.18Å; L234-W237 PolarHBondContact O-N 3.31Å; L234-L238 HydrophobicContact CD1-CD1 4.34Å; L234-L238 HydrophobicContact CD1-CG 4.3Å; L234-L238 HydrophobicContact CG-CD1 4.13Å; L234-L238 VanDerWaalsContact O-CG 3.26Å; L234-L238 WeakPolarHBondContact O-CG 3.46Å; L234-L238 PolarHBondContact O-N 2.92Å
235C90.8Very high86.1Confident1 Ų160.1 Ų60.11%0.00728%0.277CS..Hα-helixtrans-57.8-49.2173.7-67.60000111.7G231 M232 W233 W237 L238 E239 W270G231-C235 PolarHBondContact O-N 2.84Å; G231-C235 PolarHBondContact O-SG 3.15Å; M232-C235 WeakPolarHBondContact O-CB 3.4Å; M232-C235 PolarHBondContact O-N 3.41Å; W233-C235 VanDerWaalsContact C-N 3.33Å; W233-C235 PolarHBondContact O-N 3.03Å; C235-W237 VanDerWaalsContact C-N 3.33Å; C235-W237 PolarHBondContact O-N 2.94Å; C235-L238 CarbonylContact O-C 3.51Å; C235-L238 PolarHBondContact O-N 2.85Å; C235-L238 VanDerWaalsContact O-N 3.15Å; C235-E239 VanDerWaalsContact O-CG 3.31Å; C235-E239 WeakPolarHBondContact O-CG 3.3Å; C235-E239 PolarHBondContact O-N 3.33Å; C235-W270 HydrophobicContact CB-CZ2 4.38Å
236R87.7Confident84.9Confident60 Ų6064.5 Ų64.523%0.22630%0.3CS..Hα-helixtrans-61.4-41.3177.7-71-178.7-175.1148.211.6112.4H184 M232 W233 L238 E239 M240 V457H184-R236 PolarHBondContact NE2-NH2 2.88Å; M232-R236 WeakPolarHBondContact O-CG 3.39Å; M232-R236 PolarHBondContact O-N 3.15Å; W233-R236 PolarHBondContact O-N 2.72Å; R236-L238 VanDerWaalsContact C-N 3.3Å; R236-L238 PolarHBondContact O-N 3.5Å; R236-E239 PolarHBondContact O-N 2.82Å; R236-M240 WeakPolarHBondContact O-CG 3.27Å; R236-M240 PolarHBondContact O-N 3.03Å; R236-V457 VanDerWaalsContact NH2-CG2 3.35Å
237W87Confident83.7Confident133 Ų13361.3 Ų61.350%0.50429%0.285SS..Hα-helixtrans-62.6-38176.1178.180.6000112.3W233 L234 C235W233-W237 WeakPolarHBondContact O-CB 3.43Å; W233-W237 PolarHBondContact O-N 3.48Å; L234-W237 HydrophobicContact CD1-CE3 3.73Å; L234-W237 HydrophobicContact CD1-CZ3 4.18Å; L234-W237 PolarHBondContact O-N 3.31Å; C235-W237 VanDerWaalsContact C-N 3.33Å; C235-W237 PolarHBondContact O-N 2.94Å
238L86.2Confident82.5Confident15 Ų1563.3 Ų63.38%0.07930%0.295CS..Hα-helixtrans-70.8-35.8173.5-67170000112L234 C235 R236 R241 Y243 P267 W270L234-L238 HydrophobicContact CD1-CD1 4.34Å; L234-L238 HydrophobicContact CD1-CG 4.3Å; L234-L238 HydrophobicContact CG-CD1 4.13Å; L234-L238 VanDerWaalsContact O-CG 3.26Å; L234-L238 WeakPolarHBondContact O-CG 3.46Å; L234-L238 PolarHBondContact O-N 2.92Å; C235-L238 CarbonylContact O-C 3.51Å; C235-L238 PolarHBondContact O-N 2.85Å; C235-L238 VanDerWaalsContact O-N 3.15Å; R236-L238 VanDerWaalsContact C-N 3.3Å; R236-L238 PolarHBondContact O-N 3.5Å; L238-R241 PolarHBondContact O-N 3.45Å; L238-Y243 WeakPolarHBondContact CD2-OH 3.48Å; L238-Y243 VanDerWaalsContact O-CE2 3.25Å; L238-Y243 WeakPolarHBondContact O-CE2 3.13Å; L238-Y243 PolarHBondContact O-OH 2.87Å; L238-Y243 VanDerWaalsContact O-OH 3.1Å; L238-P267 HydrophobicContact CD2-CG 4.31Å; L238-W270 HydrophobicContact CB-CB 4.26Å; L238-W270 HydrophobicContact CB-CD2 3.78Å; L238-W270 HydrophobicContact CB-CE3 4.21Å; L238-W270 HydrophobicContact CB-CG 3.88Å; L238-W270 HydrophobicContact CD1-CD2 4.02Å; L238-W270 HydrophobicContact CD1-CE3 3.86Å; L238-W270 HydrophobicContact CD1-CH2 3.55Å; L238-W270 HydrophobicContact CD1-CZ2 3.8Å; L238-W270 HydrophobicContact CD1-CZ3 3.61Å
239E82.5Confident81.4Confident64 Ų6472.8 Ų72.830%0.29933%0.331SS..Hα-helixtrans-67.2-42.1178.2-76.8172-179.700113.5C235 R236 R241 W270 H272C235-E239 VanDerWaalsContact O-CG 3.31Å; C235-E239 WeakPolarHBondContact O-CG 3.3Å; C235-E239 PolarHBondContact O-N 3.33Å; R236-E239 PolarHBondContact O-N 2.82Å; E239-R241 PolarHBondContact O-N 3.19Å; E239-W270 HydrophobicContact CG-CG 4.13Å; E239-H272 IonicContact OE1-CD2 2.7Å; E239-H272 PolarHBondContact OE1-CD2 3.29Å; E239-H272 IonicContact OE1-CG 3.1Å; E239-H272 IonicContact OE2-CD2 3.27Å; E239-H272 PolarHBondContact OE2-CD2 3.09Å
240M67Low80.7Confident149 Ų14975.8 Ų75.873%0.73435%0.349SS*.THydrogen-bonded Turntrans-72.7-6.9179.8-68-175.2-65.300113.2R236R236-M240 WeakPolarHBondContact O-CG 3.27Å; R236-M240 PolarHBondContact O-N 3.03Å
241R75.2Confident79.9Confident74 Ų7475.2 Ų75.228%0.27934%0.343SS..SBendtrans-89.1122.9-174.9-169.5171.1-175.9151.83.6110.7L238 E239 Y243 L263L238-R241 PolarHBondContact O-N 3.45Å; E239-R241 PolarHBondContact O-N 3.19Å; R241-Y243 HydrophobicContact CB-CE2 4.24Å; R241-Y243 HydrophobicContact CG-CE1 4.47Å; R241-Y243 WeakPolarHBondContact O-CD2 3.28Å; R241-Y243 VanDerWaalsContact O-CE2 3.26Å; R241-Y243 WeakPolarHBondContact O-CE2 2.9Å; R241-Y243 PolarHBondContact O-N 2.93Å; R241-L263 VanDerWaalsContact NH2-CD2 3.26Å
242D69.2Low79.4Confident115 Ų11581.3 Ų81.362%0.61538%0.382SS*.  trans-72.5126.9168.8-70.4-42.1000110.8Q450D242-Q450 PolarHBondContact OD1-NE2 3.17Å
243Y69.5Low79.1Confident36 Ų3683.6 Ų83.614%0.14140%0.4CS..  trans-103.979.3-177-70.6-76.3000110.7L238 R241 W245 P267 R268 W270L238-Y243 WeakPolarHBondContact CD2-OH 3.48Å; L238-Y243 VanDerWaalsContact O-CE2 3.25Å; L238-Y243 WeakPolarHBondContact O-CE2 3.13Å; L238-Y243 PolarHBondContact O-OH 2.87Å; L238-Y243 VanDerWaalsContact O-OH 3.1Å; R241-Y243 HydrophobicContact CB-CE2 4.24Å; R241-Y243 HydrophobicContact CG-CE1 4.47Å; R241-Y243 WeakPolarHBondContact O-CD2 3.28Å; R241-Y243 VanDerWaalsContact O-CE2 3.26Å; R241-Y243 WeakPolarHBondContact O-CE2 2.9Å; R241-Y243 PolarHBondContact O-N 2.93Å; Y243-W245 AromaticContact CD1-CZ2 3.94Å; Y243-W245 HydrophobicContact CD1-CZ2 3.94Å; Y243-W245 VanDerWaalsContact O-CD1 3.27Å; Y243-P267 VanDerWaalsContact CD1-O 3.23Å; Y243-P267 WeakPolarHBondContact CD1-O 3.39Å; Y243-P267 HydrophobicContact CE1-CG 4.32Å; Y243-P267 WeakPolarHBondContact CE1-O 3.14Å; Y243-R268 WeakPolarHBondContact CB-O 3.46Å; Y243-R268 PolarHBondContact O-NH1 2.89Å; Y243-W270 HydrophobicContact CE2-CB 4.11Å
244Q68.6Low78.8Confident167 Ų16780.5 Ų80.578%0.7841%0.406SS*.  trans-92.2120.5169.8-66.9-178.7-16.100109.6
245W69.8Low78.5Confident22 Ų2288 Ų888%0.08343%0.43CS..  trans-111.878.6-173.5-64.483.2000111.6Y243 R260 L263 T266 P267 R268Y243-W245 AromaticContact CD1-CZ2 3.94Å; Y243-W245 HydrophobicContact CD1-CZ2 3.94Å; Y243-W245 VanDerWaalsContact O-CD1 3.27Å; W245-R260 VanDerWaalsContact CE3-CZ 3.47Å; W245-L263 HydrophobicContact CH2-CB 4.42Å; W245-L263 WeakPolarHBondContact CH2-O 3.28Å; W245-L263 HydrophobicContact CZ3-CB 4.06Å; W245-L263 VanDerWaalsContact CZ3-O 3.31Å; W245-L263 WeakPolarHBondContact CZ3-O 3.17Å; W245-T266 VanDerWaalsContact CH2-OG1 3.31Å; W245-T266 WeakPolarHBondContact CH2-OG1 3.27Å; W245-P267 WeakPolarHBondContact CZ2-O 3.29Å; W245-R268 PolarHBondContact NE1-O 3.41Å
246D69.5Low78.3Confident97 Ų9788.8 Ų88.852%0.51944%0.438SS..  trans-64149.9173.1-63.5-41000111.5I248 R260D246-I248 PolarHBondContact O-N 3.21Å; D246-R260 PolarHBondContact O-NE 2.99Å
247S72.1Confident78.1Confident27 Ų2790.4 Ų90.419%0.18945%0.446CS..  trans-60.8134.2170-174.50000110.5R249 N250S247-R249 PolarHBondContact O-N 3.33Å; S247-R249 PolarHBondContact OG-N 3.14Å; S247-N250 WeakPolarHBondContact O-CB 3.45Å; S247-N250 PolarHBondContact O-N 3.19Å
248I72.8Confident77.9Confident42 Ų4289 Ų8922%0.21545%0.448CS..G310 helixtrans-53.5-27.5173.4-66.1165.7000110.8I30 D246 N250 I251 K257 R260I30-I248 HydrophobicContact CD1-CD1 4.31Å; D246-I248 PolarHBondContact O-N 3.21Å; I248-N250 VanDerWaalsContact C-N 3.33Å; I248-I251 PolarHBondContact O-N 3.28Å; I248-K257 HydrophobicContact CG2-CB 4.37Å; I248-K257 HydrophobicContact CG2-CD 4.42Å; I248-K257 HydrophobicContact CG2-CG 4.09Å; I248-R260 HydrophobicContact CD1-CG 4.3Å; I248-R260 HydrophobicContact CG1-CB 4.29Å; I248-R260 HydrophobicContact CG1-CG 3.41Å; I248-R260 VanDerWaalsContact CG1-CG 3.41Å
249R73.8Confident77.8Confident199 Ų19994.6 Ų94.675%0.75147%0.472SS*.G310 helixtrans-67.1-30.2177-62.2-178.3179.3173.9-2.2113.3S247 I251S247-R249 PolarHBondContact O-N 3.33Å; S247-R249 PolarHBondContact OG-N 3.14Å; R249-I251 VanDerWaalsContact C-N 3.31Å
250N80.4Confident77.7Confident122 Ų12292.1 Ų92.165%0.65246%0.46SS*.G310 helixtrans-83.9-9.6-177.3-61.2-5.5000112.3S247 I248 P252S247-N250 WeakPolarHBondContact O-CB 3.45Å; S247-N250 PolarHBondContact O-N 3.19Å; I248-N250 VanDerWaalsContact C-N 3.33Å; N250-P252 WeakPolarHBondContact O-CD 3.28Å
251I80.5Confident78.2Confident31 Ų3187.1 Ų87.116%0.15944%0.442CS..  trans-91.5114.3-178.2-56.9173.4000109.2I248 R249 K257 R260I248-I251 PolarHBondContact O-N 3.28Å; R249-I251 VanDerWaalsContact C-N 3.31Å; I251-K257 HydrophobicContact CB-CG 4.24Å; I251-K257 HydrophobicContact CG2-CG 4.31Å; I251-K257 WeakPolarHBondContact O-CE 3.24Å; I251-R260 HydrophobicContact CD1-CB 3.51Å; I251-R260 HydrophobicContact CD1-CG 3.75Å
252P85.2Confident78.3Confident127 Ų12790.1 Ų90.183%0.82546%0.458SS*.  trans-75-33.2-173.627.2-33.8000113.2N250N250-P252 WeakPolarHBondContact O-CD 3.28Å
253S87.8Confident78.7Confident63 Ų6386.6 Ų86.644%0.44144%0.438SS..SBendtrans-88.4142.2-172.769.50000113.4R255 G256 K257S253-R255 VanDerWaalsContact C-N 3.32Å; S253-R255 PolarHBondContact O-N 2.95Å; S253-G256 PolarHBondContact O-N 3.38Å; S253-G256 VanDerWaalsContact O-N 3.13Å; S253-G256 PolarHBondContact OG-N 2.92Å; S253-G256 VanDerWaalsContact OG-N 3.11Å; S253-K257 WeakPolarHBondContact O-CG 3.44Å; S253-K257 PolarHBondContact O-N 3.29Å
254A86.9Confident78.9Confident83 Ų8386.6 Ų86.669%0.68644%0.44SS*.Hα-helixtrans-60.4-40.6175.700000112.3G256 K257 L258A254-G256 VanDerWaalsContact C-N 3.32Å; A254-G256 PolarHBondContact O-N 3.45Å; A254-K257 PolarHBondContact O-N 3.05Å; A254-L258 WeakPolarHBondContact O-CB 3.29Å; A254-L258 PolarHBondContact O-N 3.35Å
255R87Confident79.1Confident222 Ų22286.3 Ų86.384%0.83844%0.436SS*.Hα-helixtrans-61.2-39.9174.3-172.7178.9-179.7-175.70.8111.8S253 L258 K259S253-R255 VanDerWaalsContact C-N 3.32Å; S253-R255 PolarHBondContact O-N 2.95Å; R255-L258 PolarHBondContact O-N 3.46Å; R255-K259 WeakPolarHBondContact O-CB 3.33Å; R255-K259 PolarHBondContact O-N 3.14Å
256G84.7Confident79.4Confident17 Ų1786.5 Ų86.518%0.17544%0.44CS..Hα-helixtrans-66.2-42.6175.700000112.4S253 A254 K259 R260S253-G256 PolarHBondContact O-N 3.38Å; S253-G256 VanDerWaalsContact O-N 3.13Å; S253-G256 PolarHBondContact OG-N 2.92Å; S253-G256 VanDerWaalsContact OG-N 3.11Å; A254-G256 VanDerWaalsContact C-N 3.32Å; A254-G256 PolarHBondContact O-N 3.45Å; G256-K259 PolarHBondContact O-N 3.03Å; G256-R260 WeakPolarHBondContact O-CB 3.41Å; G256-R260 PolarHBondContact O-N 2.89Å
257K83.6Confident79.8Confident93 Ų9383.5 Ų83.540%0.40443%0.425SS..Hα-helixtrans-62.1-43.8174.4-68.8-178.7-175.5177.80111.8I248 I251 S253 A254 R260 A261I248-K257 HydrophobicContact CG2-CB 4.37Å; I248-K257 HydrophobicContact CG2-CD 4.42Å; I248-K257 HydrophobicContact CG2-CG 4.09Å; I251-K257 HydrophobicContact CB-CG 4.24Å; I251-K257 HydrophobicContact CG2-CG 4.31Å; I251-K257 WeakPolarHBondContact O-CE 3.24Å; S253-K257 WeakPolarHBondContact O-CG 3.44Å; S253-K257 PolarHBondContact O-N 3.29Å; A254-K257 PolarHBondContact O-N 3.05Å; K257-R260 PolarHBondContact O-N 3.21Å; K257-A261 WeakPolarHBondContact O-CB 3.48Å; K257-A261 PolarHBondContact O-N 3.45Å
258L83.2Confident80Confident103 Ų10385.2 Ų85.254%0.53943%0.428SS..Hα-helixtrans-62-47.3175.4-174.463.3000111.1A254 R255 R260 A261 F262A254-L258 WeakPolarHBondContact O-CB 3.29Å; A254-L258 PolarHBondContact O-N 3.35Å; R255-L258 PolarHBondContact O-N 3.46Å; L258-R260 VanDerWaalsContact C-N 3.32Å; L258-R260 PolarHBondContact O-N 3.28Å; L258-A261 WeakPolarHBondContact O-CB 3.35Å; L258-A261 PolarHBondContact O-N 3.33Å; L258-A261 VanDerWaalsContact O-N 3.14Å; L258-F262 HydrophobicContact CD1-CD2 3.97Å; L258-F262 HydrophobicContact CD1-CE2 3.59Å; L258-F262 HydrophobicContact CD2-CE2 4.26Å; L258-F262 HydrophobicContact CG-CD2 3.88Å; L258-F262 HydrophobicContact CG-CE2 3.73Å; L258-F262 VanDerWaalsContact O-CD2 3.3Å; L258-F262 WeakPolarHBondContact O-CD2 3.48Å; L258-F262 PolarHBondContact O-N 3.04Å
259K83.9Confident80.4Confident134 Ų13486.5 Ų86.558%0.58344%0.441SS*.Hα-helixtrans-55.8-46.8174.3-176.4-177.9179-175.20111.1R255 G256 A261 F262 L263R255-K259 WeakPolarHBondContact O-CB 3.33Å; R255-K259 PolarHBondContact O-N 3.14Å; G256-K259 PolarHBondContact O-N 3.03Å; K259-A261 VanDerWaalsContact C-N 3.31Å; K259-A261 PolarHBondContact O-N 3.17Å; K259-F262 PolarHBondContact O-N 3.27Å; K259-L263 HydrophobicContact CG-CD1 4.11Å; K259-L263 HydrophobicContact CG-CG 4.41Å; K259-L263 WeakPolarHBondContact O-CB 3.3Å; K259-L263 VanDerWaalsContact O-CG 3.26Å; K259-L263 WeakPolarHBondContact O-CG 3.39Å; K259-L263 PolarHBondContact O-N 2.9Å
260R80.1Confident80.6Confident11 Ų1179 Ų794%0.04241%0.413CS..Hα-helixtrans-64.3-34.1178.2178.461.2-178.182.21113W245 D246 I248 I251 G256 K257 L258 Q264W245-R260 VanDerWaalsContact CE3-CZ 3.47Å; D246-R260 PolarHBondContact O-NE 2.99Å; I248-R260 HydrophobicContact CD1-CG 4.3Å; I248-R260 HydrophobicContact CG1-CB 4.29Å; I248-R260 HydrophobicContact CG1-CG 3.41Å; I248-R260 VanDerWaalsContact CG1-CG 3.41Å; I251-R260 HydrophobicContact CD1-CB 3.51Å; I251-R260 HydrophobicContact CD1-CG 3.75Å; G256-R260 WeakPolarHBondContact O-CB 3.41Å; G256-R260 PolarHBondContact O-N 2.89Å; K257-R260 PolarHBondContact O-N 3.21Å; L258-R260 VanDerWaalsContact C-N 3.32Å; L258-R260 PolarHBondContact O-N 3.28Å; R260-Q264 PolarHBondContact O-N 3.35Å
261A77.7Confident80.5Confident45 Ų4575.8 Ų75.837%0.37240%0.397SS..Hα-helixtrans-67.5-44.8173.400000111.6K257 L258 K259 Q264K257-A261 WeakPolarHBondContact O-CB 3.48Å; K257-A261 PolarHBondContact O-N 3.45Å; L258-A261 WeakPolarHBondContact O-CB 3.35Å; L258-A261 PolarHBondContact O-N 3.33Å; L258-A261 VanDerWaalsContact O-N 3.14Å; K259-A261 VanDerWaalsContact C-N 3.31Å; K259-A261 PolarHBondContact O-N 3.17Å; A261-Q264 WeakPolarHBondContact O-CB 3.39Å; A261-Q264 PolarHBondContact O-N 2.89Å
262F78.4Confident80.5Confident137 Ų13778.9 Ų78.960%0.60141%0.411SS*.Hα-helixtrans-64-40.6173-84.1-75.5000112.5L258 K259 Q264 F265L258-F262 HydrophobicContact CD1-CD2 3.97Å; L258-F262 HydrophobicContact CD1-CE2 3.59Å; L258-F262 HydrophobicContact CD2-CE2 4.26Å; L258-F262 HydrophobicContact CG-CD2 3.88Å; L258-F262 HydrophobicContact CG-CE2 3.73Å; L258-F262 VanDerWaalsContact O-CD2 3.3Å; L258-F262 WeakPolarHBondContact O-CD2 3.48Å; L258-F262 PolarHBondContact O-N 3.04Å; K259-F262 PolarHBondContact O-N 3.27Å; F262-Q264 PolarHBondContact O-N 3.38Å; F262-Q264 VanDerWaalsContact O-N 3.14Å; F262-F265 WeakPolarHBondContact O-CD2 3.46Å; F262-F265 PolarHBondContact O-N 3.49Å
263L77.8Confident80.3Confident40 Ų4073.2 Ų73.221%0.20937%0.374CS..Hα-helixtrans-61.9-21.3176.6-71.4175.1000112.1R241 W245 K259 F265 T266R241-L263 VanDerWaalsContact NH2-CD2 3.26Å; W245-L263 HydrophobicContact CH2-CB 4.42Å; W245-L263 WeakPolarHBondContact CH2-O 3.28Å; W245-L263 HydrophobicContact CZ3-CB 4.06Å; W245-L263 VanDerWaalsContact CZ3-O 3.31Å; W245-L263 WeakPolarHBondContact CZ3-O 3.17Å; K259-L263 HydrophobicContact CG-CD1 4.11Å; K259-L263 HydrophobicContact CG-CG 4.41Å; K259-L263 WeakPolarHBondContact O-CB 3.3Å; K259-L263 VanDerWaalsContact O-CG 3.26Å; K259-L263 WeakPolarHBondContact O-CG 3.39Å; K259-L263 PolarHBondContact O-N 2.9Å; L263-F265 PolarHBondContact O-N 3.44Å; L263-T266 HydrophobicContact CD2-CG2 4.01Å; L263-T266 WeakPolarHBondContact O-CA 3.46Å; L263-T266 WeakPolarHBondContact O-CB 3.32Å; L263-T266 PolarHBondContact O-N 3.29Å; L263-T266 PolarHBondContact O-OG1 2.83Å
264Q73.5Confident80.1Confident37 Ų3775.7 Ų75.717%0.17337%0.373CS..THydrogen-bonded Turntrans-54.6-26.2175.3-170.365.423.800113.6P93 R260 A261 F262 T266P93-Q264 PolarHBondContact O-NE2 3.27Å; R260-Q264 PolarHBondContact O-N 3.35Å; A261-Q264 WeakPolarHBondContact O-CB 3.39Å; A261-Q264 PolarHBondContact O-N 2.89Å; F262-Q264 PolarHBondContact O-N 3.38Å; F262-Q264 VanDerWaalsContact O-N 3.14Å; Q264-T266 VanDerWaalsContact C-N 3.33Å
265F73.2Confident79.9Confident160 Ų16071.8 Ų71.870%0.70234%0.341SS*.THydrogen-bonded Turntrans-84.8-6.5176.1-58.8-73000113.6P93 F262 L263P93-F265 HydrophobicContact CB-CD1 4.14Å; F262-F265 WeakPolarHBondContact O-CD2 3.46Å; F262-F265 PolarHBondContact O-N 3.49Å; L263-F265 PolarHBondContact O-N 3.44Å
266T76.3Confident79.5Confident27 Ų2761.9 Ų61.917%0.16631%0.305CS..SBendtrans-83.6149.5170680000110.6W245 L263 Q264W245-T266 VanDerWaalsContact CH2-OG1 3.31Å; W245-T266 WeakPolarHBondContact CH2-OG1 3.27Å; L263-T266 HydrophobicContact CD2-CG2 4.01Å; L263-T266 WeakPolarHBondContact O-CA 3.46Å; L263-T266 WeakPolarHBondContact O-CB 3.32Å; L263-T266 PolarHBondContact O-N 3.29Å; L263-T266 PolarHBondContact O-OG1 2.83Å; Q264-T266 VanDerWaalsContact C-N 3.33Å
267P76.5Confident79Confident33 Ų3364 Ų6421%0.21431%0.31CS..  trans-61.6143.3-178.926.3-37.4000111.6L238 Y243 W245 S269 W270L238-P267 HydrophobicContact CD2-CG 4.31Å; Y243-P267 VanDerWaalsContact CD1-O 3.23Å; Y243-P267 WeakPolarHBondContact CD1-O 3.39Å; Y243-P267 HydrophobicContact CE1-CG 4.32Å; Y243-P267 WeakPolarHBondContact CE1-O 3.14Å; W245-P267 WeakPolarHBondContact CZ2-O 3.29Å; P267-S269 PolarHBondContact O-N 3.15Å; P267-W270 HydrophobicContact CB-CE3 3.79Å; P267-W270 HydrophobicContact CB-CZ3 4.14Å; P267-W270 HydrophobicContact CG-CE3 3.42Å; P267-W270 VanDerWaalsContact CG-CE3 3.42Å; P267-W270 HydrophobicContact CG-CZ3 3.81Å
268R77.9Confident78.4Confident64 Ų6461 Ų6124%0.24230%0.3CS..SBendtrans-58.7-36.9178.9174.365-177.494.6-16.5112.1D27 I91 R92 Y243 W245D27-R268 IonicContact OD2-CZ 3.12Å; D27-R268 IonicContact OD2-NH2 2.84Å; D27-R268 PolarHBondContact OD2-NH2 3.17Å; I91-R268 HydrophobicContact CD1-CG 4.49Å; R92-R268 HydrophobicContact CG-CB 3.96Å; Y243-R268 WeakPolarHBondContact CB-O 3.46Å; Y243-R268 PolarHBondContact O-NH1 2.89Å; W245-R268 PolarHBondContact NE1-O 3.41Å
269S79.7Confident77.9Confident69 Ų6963.4 Ų63.448%0.48331%0.314SS..  trans-153.7155.2175.156.50000107.5P267P267-S269 PolarHBondContact O-N 3.15Å
270W78.4Confident77.4Confident42 Ų4257.3 Ų57.316%0.15929%0.287CS..  trans-115.7112.4174.3-162.6-86.2000110.3I179 R182 C235 L238 E239 Y243 P267I179-W270 HydrophobicContact CG2-CH2 3.58Å; I179-W270 HydrophobicContact CG2-CZ2 3.98Å; R182-W270 VanDerWaalsContact NE-CZ2 3.31Å; C235-W270 HydrophobicContact CB-CZ2 4.38Å; L238-W270 HydrophobicContact CB-CB 4.26Å; L238-W270 HydrophobicContact CB-CD2 3.78Å; L238-W270 HydrophobicContact CB-CE3 4.21Å; L238-W270 HydrophobicContact CB-CG 3.88Å; L238-W270 HydrophobicContact CD1-CD2 4.02Å; L238-W270 HydrophobicContact CD1-CE3 3.86Å; L238-W270 HydrophobicContact CD1-CH2 3.55Å; L238-W270 HydrophobicContact CD1-CZ2 3.8Å; L238-W270 HydrophobicContact CD1-CZ3 3.61Å; E239-W270 HydrophobicContact CG-CG 4.13Å; Y243-W270 HydrophobicContact CE2-CB 4.11Å; P267-W270 HydrophobicContact CB-CE3 3.79Å; P267-W270 HydrophobicContact CB-CZ3 4.14Å; P267-W270 HydrophobicContact CG-CE3 3.42Å; P267-W270 VanDerWaalsContact CG-CE3 3.42Å; P267-W270 HydrophobicContact CG-CZ3 3.81Å
271T78.9Confident77.5Confident54 Ų5459.9 Ų59.933%0.33131%0.307SS..PPolyproline II helixtrans-86.7121.9179.6-46.50000110.6R182 T273R182-T271 PolarHBondContact NH1-O 2.93Å; T271-T273 PolarHBondContact O-N 3.29Å
272H80Confident77.8Confident96 Ų9663.2 Ų63.244%0.44432%0.318SS..PPolyproline II helixtrans-64.2126168.8-177.2-80.5000109.9E239 R274E239-H272 IonicContact OE1-CD2 2.7Å; E239-H272 PolarHBondContact OE1-CD2 3.29Å; E239-H272 IonicContact OE1-CG 3.1Å; E239-H272 IonicContact OE2-CD2 3.27Å; E239-H272 PolarHBondContact OE2-CD2 3.09Å; H272-R274 WeakPolarHBondContact ND1-CG 3.41Å
273T81.6Confident78.2Confident8 Ų860.8 Ų60.85%0.04932%0.316CS..PPolyproline II helixtrans-94128.917856.40000110.5L181 R182 T271 Y337L181-T273 PolarHBondContact O-OG1 2.93Å; R182-T273 VanDerWaalsContact CB-OG1 3.3Å; R182-T273 WeakPolarHBondContact CB-OG1 3Å; R182-T273 PolarHBondContact O-OG1 3.06Å; T271-T273 PolarHBondContact O-N 3.29Å; T273-Y337 HydrophobicContact CG2-CD2 4.07Å; T273-Y337 HydrophobicContact CG2-CE2 4Å; T273-Y337 HydrophobicContact CG2-CG 4.41Å
274R82.3Confident78.6Confident114 Ų11460.5 Ų60.543%0.4331%0.312SS..  trans-114.679.3173.3-61.9-175.3-179170.3-4.4109.3H272 H277 R284 Y337H272-R274 WeakPolarHBondContact ND1-CG 3.41Å; R274-H277 VanDerWaalsContact CB-NE2 3.27Å; R274-H277 WeakPolarHBondContact CB-NE2 3.49Å; R274-H277 WeakPolarHBondContact CD-NE2 3.34Å; R274-R284 PolarHBondContact O-NH2 3.41Å; R274-Y337 PolarHBondContact N-OH 2.98Å
275W82.5Confident79.2Confident1 Ų158.9 Ų58.90%0.00431%0.305CS..  trans-60.2-49.1179.5-68.4100.5000111.3L181 I186 R284 L288 L291 I333 Y336 Y337L181-W275 PolarHBondContact O-NE1 3.05Å; I186-W275 HydrophobicContact CD1-CB 3.77Å; I186-W275 HydrophobicContact CD1-CG 3.88Å; W275-R284 PolarHBondContact O-NE 2.68Å; W275-R284 PolarHBondContact O-NH2 3.14Å; W275-L288 HydrophobicContact CB-CD2 4.12Å; W275-L288 HydrophobicContact CD2-CD2 4.33Å; W275-L288 HydrophobicContact CE3-CD2 3.49Å; W275-L288 VanDerWaalsContact CE3-CD2 3.49Å; W275-L288 HydrophobicContact CZ3-CD2 4.27Å; W275-L288 VanDerWaalsContact O-CD1 3.24Å; W275-L288 WeakPolarHBondContact O-CD1 3.43Å; W275-L291 HydrophobicContact CE3-CD2 4.28Å; W275-L291 HydrophobicContact CH2-CD2 3.86Å; W275-L291 HydrophobicContact CZ2-CD2 4.32Å; W275-L291 HydrophobicContact CZ3-CD2 3.85Å; W275-I333 HydrophobicContact CH2-CG2 4.06Å; W275-I333 HydrophobicContact CZ2-CG2 3.92Å; W275-Y336 HydrophobicContact CH2-CD1 4.35Å; W275-Y336 HydrophobicContact CZ3-CD1 4.02Å; W275-Y337 AromaticContact CD2-CD2 3.75Å; W275-Y337 HydrophobicContact CD2-CD2 3.75Å; W275-Y337 HydrophobicContact CD2-CE2 4.27Å; W275-Y337 AromaticContact CE2-CD2 3.74Å; W275-Y337 AromaticContact CE3-CD2 3.71Å; W275-Y337 HydrophobicContact CE3-CD2 3.71Å; W275-Y337 HydrophobicContact CE3-CE2 4.45Å; W275-Y337 HydrophobicContact CG-CD2 4.48Å; W275-Y337 VanDerWaalsContact CH2-CB 3.48Å; W275-Y337 AromaticContact CH2-CD2 3.84Å; W275-Y337 HydrophobicContact CH2-CD2 3.84Å; W275-Y337 HydrophobicContact CH2-CG 4.16Å; W275-Y337 AromaticContact CZ2-CD2 3.81Å; W275-Y337 HydrophobicContact CZ2-CD2 3.81Å; W275-Y337 HydrophobicContact CZ2-CG 4.34Å; W275-Y337 AromaticContact CZ3-CD2 3.76Å; W275-Y337 HydrophobicContact CZ3-CD2 3.76Å; W275-Y337 HydrophobicContact CZ3-CG 4.31Å
276L80.6Confident80Confident14 Ų1454.6 Ų54.67%0.07329%0.291CS..  trans-104.9115.1-175.3-67.3155.6000109H183 I186 L288 V397 R401H183-L276 VanDerWaalsContact CE1-CD1 3.44Å; H183-L276 WeakPolarHBondContact CE1-CD1 3.36Å; I186-L276 HydrophobicContact CD1-CD1 4.38Å; I186-L276 HydrophobicContact CG1-CD1 4.36Å; L276-L288 HydrophobicContact CD2-CD1 3.7Å; L276-L288 HydrophobicContact CG-CD1 4.26Å; L276-V397 HydrophobicContact CD2-CB 4.08Å; L276-V397 HydrophobicContact CD2-CG1 3.71Å; L276-V397 HydrophobicContact CD2-CG2 4.26Å; L276-R401 HydrophobicContact CD2-CG 4.44Å
277H73.1Confident80.8Confident61 Ų6155.5 Ų55.528%0.28230%0.295SS..  trans-115145170-97.9-72.1000109.5R274 D279 S280R274-H277 VanDerWaalsContact CB-NE2 3.27Å; R274-H277 WeakPolarHBondContact CB-NE2 3.49Å; R274-H277 WeakPolarHBondContact CD-NE2 3.34Å; H277-D279 PolarHBondContact O-N 3.02Å; H277-S280 PolarHBondContact N-OG 3.37Å; H277-S280 VanDerWaalsContact O-CB 3.24Å; H277-S280 WeakPolarHBondContact O-CB 3.41Å; H277-S280 PolarHBondContact O-N 3.46Å; H277-S280 PolarHBondContact O-OG 2.85Å; H277-S280 VanDerWaalsContact O-OG 3.05Å
278P70.9Confident81.4Confident32 Ų3254 Ų5421%0.20829%0.285CS..THydrogen-bonded Turntrans-38.2-52.2168.4-41.646.2000113.9S280 R401 A404 N405P278-S280 VanDerWaalsContact C-N 3.27Å; P278-S280 PolarHBondContact O-N 2.91Å; P278-R401 PolarHBondContact O-NH2 3.19Å; P278-A404 HydrophobicContact CG-CB 3.73Å; P278-N405 WeakPolarHBondContact CA-OD1 3.41Å; P278-N405 WeakPolarHBondContact CB-OD1 3.23Å; P278-N405 VanDerWaalsContact CG-OD1 3.28Å; P278-N405 WeakPolarHBondContact CG-OD1 3.47Å
279D72.4Confident82.1Confident153 Ų15351.1 Ų51.182%0.81827%0.274SS*.THydrogen-bonded Turntrans-89.311.8-171.3-53.1-39.5000112.7H277 S281H277-D279 PolarHBondContact O-N 3.02Å; D279-S281 PolarHBondContact O-N 3.38Å
280S74.3Confident82.8Confident5 Ų552 Ų524%0.03527%0.271CS..  trans-55.6132.6176-76.90000110.6H277 P278 R284 R401H277-S280 PolarHBondContact N-OG 3.37Å; H277-S280 VanDerWaalsContact O-CB 3.24Å; H277-S280 WeakPolarHBondContact O-CB 3.41Å; H277-S280 PolarHBondContact O-N 3.46Å; H277-S280 PolarHBondContact O-OG 2.85Å; H277-S280 VanDerWaalsContact O-OG 3.05Å; P278-S280 VanDerWaalsContact C-N 3.27Å; P278-S280 PolarHBondContact O-N 2.91Å; S280-R284 WeakPolarHBondContact OG-CD 3.36Å; S280-R284 PolarHBondContact OG-NE 2.99Å; S280-R401 PolarHBondContact O-NH1 3.35Å; S280-R401 PolarHBondContact O-NH2 3.34Å
281S82.2Confident83.6Confident65 Ų6550.8 Ų50.846%0.45527%0.267SS..  trans-66.2158.9174.468.50000111.1D279 P283 R284 S285D279-S281 PolarHBondContact O-N 3.38Å; S281-P283 VanDerWaalsContact C-N 3.33Å; S281-R284 WeakPolarHBondContact O-CB 3.47Å; S281-R284 PolarHBondContact O-N 3.25Å; S281-R284 VanDerWaalsContact O-N 3.16Å; S281-R284 PolarHBondContact OG-N 2.94Å; S281-S285 PolarHBondContact O-N 3.37Å; S281-S285 PolarHBondContact O-OG 2.99Å; S281-S285 VanDerWaalsContact O-OG 3.09Å
282I84.2Confident84.4Confident116 Ų11648.2 Ų48.260%0.59525%0.252SS*.Hα-helixtrans-56.2-44.3172.7-63.2172000111R284 S285 V286I282-R284 VanDerWaalsContact C-N 3.31Å; I282-R284 PolarHBondContact O-N 2.7Å; I282-S285 WeakPolarHBondContact O-CA 3.07Å; I282-S285 VanDerWaalsContact O-CB 3.27Å; I282-S285 WeakPolarHBondContact O-CB 3.26Å; I282-S285 PolarHBondContact O-N 3.47Å; I282-V286 PolarHBondContact O-N 3.05Å
283P86.3Confident85.1Confident86 Ų8646.3 Ų46.356%0.55825%0.245SC*.Hα-helixtrans-55.3-42.8173.4-28.235.7000113.6S281 S285 V286 L287S281-P283 VanDerWaalsContact C-N 3.33Å; P283-S285 PolarHBondContact O-N 3.46Å; P283-V286 PolarHBondContact O-N 3.03Å; P283-L287 WeakPolarHBondContact O-CG 3.45Å; P283-L287 PolarHBondContact O-N 3.06Å
284R85.5Confident85.8Confident34 Ų3448.1 Ų48.113%0.12826%0.256CS..Hα-helixtrans-60.4-37.4174.5176166.5172.8178.5-2.6111.5R274 W275 S280 S281 I282 L287 L288 V340 T341R274-R284 PolarHBondContact O-NH2 3.41Å; W275-R284 PolarHBondContact O-NE 2.68Å; W275-R284 PolarHBondContact O-NH2 3.14Å; S280-R284 WeakPolarHBondContact OG-CD 3.36Å; S280-R284 PolarHBondContact OG-NE 2.99Å; S281-R284 WeakPolarHBondContact O-CB 3.47Å; S281-R284 PolarHBondContact O-N 3.25Å; S281-R284 VanDerWaalsContact O-N 3.16Å; S281-R284 PolarHBondContact OG-N 2.94Å; I282-R284 VanDerWaalsContact C-N 3.31Å; I282-R284 PolarHBondContact O-N 2.7Å; R284-L287 PolarHBondContact O-N 2.9Å; R284-L288 HydrophobicContact CG-CD1 4.26Å; R284-L288 HydrophobicContact CG-CG 4.49Å; R284-L288 VanDerWaalsContact O-CG 3.28Å; R284-L288 WeakPolarHBondContact O-CG 3.37Å; R284-L288 PolarHBondContact O-N 2.67Å; R284-V340 HydrophobicContact CG-CG1 3.78Å; R284-T341 VanDerWaalsContact NH2-CG2 3.33Å
285S85.8Confident86.4Confident3 Ų344.1 Ų44.12%0.02124%0.241CC..Hα-helixtrans-66.3-39.1178.2-53.40000112.5S281 I282 P283 L288 S289 R401S281-S285 PolarHBondContact O-N 3.37Å; S281-S285 PolarHBondContact O-OG 2.99Å; S281-S285 VanDerWaalsContact O-OG 3.09Å; I282-S285 WeakPolarHBondContact O-CA 3.07Å; I282-S285 VanDerWaalsContact O-CB 3.27Å; I282-S285 WeakPolarHBondContact O-CB 3.26Å; I282-S285 PolarHBondContact O-N 3.47Å; P283-S285 PolarHBondContact O-N 3.46Å; S285-L288 PolarHBondContact O-N 3.49Å; S285-S289 PolarHBondContact O-N 2.8Å; S285-S289 PolarHBondContact O-OG 3.34Å; S285-R401 PolarHBondContact OG-NH1 2.8Å
286V90.7Very high87Confident70 Ų7044.2 Ų44.242%0.42424%0.241SC..Hα-helixtrans-63.7-44.6173.5175.30000110.9I282 P283 S289 Q290 F394I282-V286 PolarHBondContact O-N 3.05Å; P283-V286 PolarHBondContact O-N 3.03Å; V286-S289 WeakPolarHBondContact O-CB 3.29Å; V286-S289 PolarHBondContact O-N 3.46Å; V286-Q290 PolarHBondContact O-N 3.47Å; V286-F394 HydrophobicContact CG2-CE1 3.93Å; V286-F394 HydrophobicContact CG2-CZ 4.2Å
287L92.4Very high87.8Confident46 Ų4645.3 Ų45.324%0.24125%0.247CC..Hα-helixtrans-61.9-45.5176.7-67.3170.7000111.3P283 R284 S289 Q290 L291 Y336 V340P283-L287 WeakPolarHBondContact O-CG 3.45Å; P283-L287 PolarHBondContact O-N 3.06Å; R284-L287 PolarHBondContact O-N 2.9Å; L287-S289 PolarHBondContact O-N 3.1Å; L287-Q290 WeakPolarHBondContact O-CA 3.14Å; L287-Q290 VanDerWaalsContact O-CB 3.29Å; L287-Q290 WeakPolarHBondContact O-CB 3.25Å; L287-Q290 PolarHBondContact O-N 2.97Å; L287-L291 PolarHBondContact O-N 3.06Å; L287-Y336 VanDerWaalsContact C-OH 3.29Å; L287-Y336 PolarHBondContact O-OH 3.25Å; L287-V340 HydrophobicContact CB-CG1 4.16Å; L287-V340 HydrophobicContact CB-CG2 3.84Å; L287-V340 HydrophobicContact CD1-CG2 4.13Å
288L90.9Very high88.9Confident2 Ų242.9 Ų42.91%0.0124%0.237CC..Hα-helixtrans-60.3-35.8175.3-66.4172.9000112.9W275 L276 R284 S285 L291 V340 V397W275-L288 HydrophobicContact CB-CD2 4.12Å; W275-L288 HydrophobicContact CD2-CD2 4.33Å; W275-L288 HydrophobicContact CE3-CD2 3.49Å; W275-L288 VanDerWaalsContact CE3-CD2 3.49Å; W275-L288 HydrophobicContact CZ3-CD2 4.27Å; W275-L288 VanDerWaalsContact O-CD1 3.24Å; W275-L288 WeakPolarHBondContact O-CD1 3.43Å; L276-L288 HydrophobicContact CD2-CD1 3.7Å; L276-L288 HydrophobicContact CG-CD1 4.26Å; R284-L288 HydrophobicContact CG-CD1 4.26Å; R284-L288 HydrophobicContact CG-CG 4.49Å; R284-L288 VanDerWaalsContact O-CG 3.28Å; R284-L288 WeakPolarHBondContact O-CG 3.37Å; R284-L288 PolarHBondContact O-N 2.67Å; S285-L288 PolarHBondContact O-N 3.49Å; L288-L291 WeakPolarHBondContact O-CB 3.12Å; L288-L291 PolarHBondContact O-N 3.11Å; L288-V340 HydrophobicContact CD2-CG1 3.98Å; L288-V340 HydrophobicContact CG-CG1 4.22Å; L288-V397 HydrophobicContact CB-CG1 4.5Å; L288-V397 HydrophobicContact CB-CG2 3.66Å; L288-V397 HydrophobicContact CD1-CG1 4.35Å
289S92.8Very high90.1Very high2 Ų242.7 Ų42.71%0.01423%0.233CC..Hα-helixtrans-67.1-40.1174.8-52.80000111.1S285 V286 L287 L291 I292 L293S285-S289 PolarHBondContact O-N 2.8Å; S285-S289 PolarHBondContact O-OG 3.34Å; V286-S289 WeakPolarHBondContact O-CB 3.29Å; V286-S289 PolarHBondContact O-N 3.46Å; L287-S289 PolarHBondContact O-N 3.1Å; S289-L291 VanDerWaalsContact C-N 3.3Å; S289-L291 PolarHBondContact O-N 2.72Å; S289-I292 PolarHBondContact O-N 3.41Å; S289-L293 WeakPolarHBondContact O-CG 3.37Å; S289-L293 PolarHBondContact O-N 3.21Å
290Q94Very high91.2Very high89 Ų8935.7 Ų35.742%0.41620%0.196SC..Hα-helixtrans-58-39.6174.1-179-1704500112.3V286 L287 I292 L293 V294 Y336V286-Q290 PolarHBondContact O-N 3.47Å; L287-Q290 WeakPolarHBondContact O-CA 3.14Å; L287-Q290 VanDerWaalsContact O-CB 3.29Å; L287-Q290 WeakPolarHBondContact O-CB 3.25Å; L287-Q290 PolarHBondContact O-N 2.97Å; Q290-I292 VanDerWaalsContact C-N 3.3Å; Q290-I292 PolarHBondContact O-N 3.38Å; Q290-L293 PolarHBondContact O-N 3.31Å; Q290-V294 HydrophobicContact CG-CG2 4Å; Q290-V294 WeakPolarHBondContact O-CB 3.23Å; Q290-V294 WeakPolarHBondContact O-CG2 3.37Å; Q290-V294 PolarHBondContact O-N 3.31Å; Q290-Y336 PolarHBondContact OE1-OH 2.91Å
291L94.5Very high92.3Very high15 Ų1535.6 Ų35.68%0.07920%0.195CC..Hα-helixtrans-55.6-46.8175.9177.663.4000111.5L181 W275 L287 L288 S289 L293 W295 Y336L181-L291 HydrophobicContact CD2-CD2 4.09Å; W275-L291 HydrophobicContact CE3-CD2 4.28Å; W275-L291 HydrophobicContact CH2-CD2 3.86Å; W275-L291 HydrophobicContact CZ2-CD2 4.32Å; W275-L291 HydrophobicContact CZ3-CD2 3.85Å; L287-L291 PolarHBondContact O-N 3.06Å; L288-L291 WeakPolarHBondContact O-CB 3.12Å; L288-L291 PolarHBondContact O-N 3.11Å; S289-L291 VanDerWaalsContact C-N 3.3Å; S289-L291 PolarHBondContact O-N 2.72Å; L291-L293 PolarHBondContact O-N 3.36Å; L291-W295 VanDerWaalsContact O-CB 3.24Å; L291-W295 WeakPolarHBondContact O-CB 3.45Å; L291-W295 PolarHBondContact O-N 3.23Å; L291-Y336 HydrophobicContact CB-CD1 4.32Å; L291-Y336 HydrophobicContact CB-CE1 3.73Å; L291-Y336 HydrophobicContact CD1-CD1 4.01Å; L291-Y336 HydrophobicContact CD1-CE1 4.23Å; L291-Y336 HydrophobicContact CD2-CD1 4.35Å; L291-Y336 HydrophobicContact CD2-CE1 4.42Å; L291-Y336 HydrophobicContact CG-CD1 4.46Å; L291-Y336 HydrophobicContact CG-CE1 4.35Å
292I94.9Very high92.9Very high1 Ų133.5 Ų33.51%0.00518%0.18CC..Hα-helixtrans-61.8-45.3179.9-62.8171.3000110I186 T189 L190 S289 Q290 W295 Q296 T396I186-I292 HydrophobicContact CG2-CG1 4.19Å; T189-I292 HydrophobicContact CG2-CD1 4.42Å; T189-I292 HydrophobicContact CG2-CG2 4.47Å; L190-I292 HydrophobicContact CD2-CB 4.39Å; L190-I292 HydrophobicContact CD2-CG2 3.83Å; S289-I292 PolarHBondContact O-N 3.41Å; Q290-I292 VanDerWaalsContact C-N 3.3Å; Q290-I292 PolarHBondContact O-N 3.38Å; I292-W295 PolarHBondContact O-N 3.37Å; I292-Q296 WeakPolarHBondContact O-CG 3.39Å; I292-Q296 PolarHBondContact O-N 3.37Å; I292-Q296 VanDerWaalsContact O-N 3.13Å; I292-T396 HydrophobicContact CD1-CG2 4Å
293L95.5Very high93.3Very high56 Ų5630.4 Ų30.429%0.29316%0.163SC..Hα-helixtrans-64.4-47.9-180-63.3176.5000112.8S289 Q290 L291 W295 Q296 L297 M389 V390S289-L293 WeakPolarHBondContact O-CG 3.37Å; S289-L293 PolarHBondContact O-N 3.21Å; Q290-L293 PolarHBondContact O-N 3.31Å; L291-L293 PolarHBondContact O-N 3.36Å; L293-W295 VanDerWaalsContact C-N 3.27Å; L293-W295 PolarHBondContact O-N 3.32Å; L293-Q296 PolarHBondContact O-N 3.5Å; L293-L297 PolarHBondContact O-N 2.9Å; L293-M389 HydrophobicContact CD2-CB 3.64Å; L293-M389 WeakPolarHBondContact CD2-O 3.33Å; L293-V390 HydrophobicContact CD1-CG2 4.38Å
294V95.6Very high93.8Very high46 Ų4626.6 Ų26.628%0.27914%0.137SC..Hα-helixtrans-65.3-35.1-179.4172.30000110.9Q290 L297 A298 I359Q290-V294 HydrophobicContact CG-CG2 4Å; Q290-V294 WeakPolarHBondContact O-CB 3.23Å; Q290-V294 WeakPolarHBondContact O-CG2 3.37Å; Q290-V294 PolarHBondContact O-N 3.31Å; V294-L297 PolarHBondContact O-N 2.93Å; V294-A298 PolarHBondContact O-N 3.49Å; V294-I359 HydrophobicContact CG1-CD1 3.72Å
295W95.5Very high94.3Very high30 Ų3025.4 Ų25.411%0.11413%0.134CC..Hα-helixtrans-61.5-51.1174.5-167.1-65.2000111.8K177 L180 L181 L190 L291 I292 L293 L297 A298 E299 I333K177-W295 HydrophobicContact CB-CZ2 4.03Å; K177-W295 HydrophobicContact CD-CZ2 4.09Å; K177-W295 HydrophobicContact CG-CZ2 3.78Å; L180-W295 HydrophobicContact CB-CH2 4.4Å; L180-W295 HydrophobicContact CD1-CH2 4.33Å; L181-W295 HydrophobicContact CD1-CE3 4.45Å; L181-W295 HydrophobicContact CD1-CH2 4.1Å; L181-W295 HydrophobicContact CD1-CZ2 4.48Å; L181-W295 HydrophobicContact CD1-CZ3 4.06Å; L181-W295 HydrophobicContact CD2-CE3 4.07Å; L181-W295 HydrophobicContact CD2-CH2 4.36Å; L181-W295 HydrophobicContact CD2-CZ3 3.63Å; L181-W295 HydrophobicContact CG-CE3 4.48Å; L181-W295 HydrophobicContact CG-CH2 3.99Å; L181-W295 HydrophobicContact CG-CZ3 3.77Å; L190-W295 HydrophobicContact CD1-CD2 4.01Å; L190-W295 HydrophobicContact CD1-CE3 4.46Å; L190-W295 HydrophobicContact CD1-CG 4.02Å; L190-W295 HydrophobicContact CD2-CB 3.86Å; L190-W295 HydrophobicContact CD2-CG 3.83Å; L291-W295 VanDerWaalsContact O-CB 3.24Å; L291-W295 WeakPolarHBondContact O-CB 3.45Å; L291-W295 PolarHBondContact O-N 3.23Å; I292-W295 PolarHBondContact O-N 3.37Å; L293-W295 VanDerWaalsContact C-N 3.27Å; L293-W295 PolarHBondContact O-N 3.32Å; W295-L297 VanDerWaalsContact C-N 3.26Å; W295-L297 PolarHBondContact O-N 3.22Å; W295-A298 PolarHBondContact O-N 2.9Å; W295-E299 VanDerWaalsContact CD1-OE1 3.27Å; W295-E299 PolarHBondContact NE1-OE1 3.13Å; W295-E299 PolarHBondContact O-N 2.94Å; W295-E299 VanDerWaalsContact O-N 3.12Å; W295-I333 HydrophobicContact CE3-CD1 4.37Å; W295-I333 HydrophobicContact CH2-CD1 3.66Å; W295-I333 HydrophobicContact CZ3-CD1 3.31Å; W295-I333 HydrophobicContact CZ3-CG1 4Å
296Q95.9Very high94.6Very high2 Ų226.3 Ų26.31%0.00914%0.137CC..Hα-helixtrans-58.4-40.5177.5-67.8-58.695.500111.7L190 N193 T197 I292 L293 E299 L300 M389L190-Q296 HydrophobicContact CD2-CG 4.22Å; N193-Q296 HydrophobicContact CB-CG 4.46Å; N193-Q296 PolarHBondContact O-NE2 3.38Å; T197-Q296 PolarHBondContact OG1-NE2 2.86Å; I292-Q296 WeakPolarHBondContact O-CG 3.39Å; I292-Q296 PolarHBondContact O-N 3.37Å; I292-Q296 VanDerWaalsContact O-N 3.13Å; L293-Q296 PolarHBondContact O-N 3.5Å; Q296-E299 PolarHBondContact O-N 3.18Å; Q296-L300 VanDerWaalsContact O-CB 3.3Å; Q296-L300 WeakPolarHBondContact O-CB 3.42Å; Q296-L300 PolarHBondContact O-N 2.92Å; Q296-M389 HydrophobicContact CG-SD 4.12Å
297L96.4Very high94.8Very high38 Ų3824 Ų2420%0.19912%0.122CC..Hα-helixtrans-63.2-43.7177.4-178.362000112.4L293 V294 W295 E299 L300 N301 I359 L363L293-L297 PolarHBondContact O-N 2.9Å; V294-L297 PolarHBondContact O-N 2.93Å; W295-L297 VanDerWaalsContact C-N 3.26Å; W295-L297 PolarHBondContact O-N 3.22Å; L297-E299 VanDerWaalsContact C-N 3.34Å; L297-E299 PolarHBondContact O-N 3.04Å; L297-L300 PolarHBondContact O-N 3.33Å; L297-N301 WeakPolarHBondContact O-CB 3.31Å; L297-N301 VanDerWaalsContact O-CG 3.25Å; L297-N301 PolarHBondContact O-N 3.44Å; L297-I359 HydrophobicContact CB-CG2 4.45Å; L297-I359 HydrophobicContact CD2-CG2 3.83Å; L297-I359 HydrophobicContact CG-CG2 3.9Å; L297-L363 HydrophobicContact CD1-CD1 4.11Å; L297-L363 HydrophobicContact CD1-CD2 4.22Å; L297-L363 HydrophobicContact CD2-CD2 4.19Å
298A96.9Very high94.9Very high10 Ų1022 Ų228%0.08311%0.111CC..Hα-helixtrans-62.8-39.9178.800000112.4V294 W295 S302 I359V294-A298 PolarHBondContact O-N 3.49Å; W295-A298 PolarHBondContact O-N 2.9Å; A298-S302 PolarHBondContact O-N 3.43Å; A298-S302 PolarHBondContact O-OG 3.1Å; A298-I359 HydrophobicContact CB-CD1 3.77Å; A298-I359 HydrophobicContact CB-CG1 3.84Å; A298-I359 HydrophobicContact CB-CG2 4.41Å
299E95.6Very high95.1Very high27 Ų2723.1 Ų23.113%0.12612%0.116CC..Hα-helixtrans-68.2-47174.8-67.7-163.3-158.400111.2K177 W194 W295 Q296 L297 N301 S302 F303K177-E299 WeakPolarHBondContact CE-OE1 3.28Å; K177-E299 IonicContact NZ-OE1 3.38Å; K177-E299 PolarHBondContact NZ-OE1 3.36Å; K177-E299 IonicContact NZ-OE2 3.98Å; K177-E299 PolarHBondContact NZ-OE2 3.28Å; W194-E299 HydrophobicContact CE3-CB 3.8Å; W194-E299 HydrophobicContact CH2-CB 3.68Å; W194-E299 HydrophobicContact CZ3-CB 3.22Å; W194-E299 HydrophobicContact CZ3-CG 4.42Å; W295-E299 VanDerWaalsContact CD1-OE1 3.27Å; W295-E299 PolarHBondContact NE1-OE1 3.13Å; W295-E299 PolarHBondContact O-N 2.94Å; W295-E299 VanDerWaalsContact O-N 3.12Å; Q296-E299 PolarHBondContact O-N 3.18Å; L297-E299 VanDerWaalsContact C-N 3.34Å; L297-E299 PolarHBondContact O-N 3.04Å; E299-N301 PolarHBondContact O-N 3.47Å; E299-S302 WeakPolarHBondContact O-CA 3.26Å; E299-S302 WeakPolarHBondContact O-CB 3.46Å; E299-S302 PolarHBondContact O-N 3.23Å; E299-F303 WeakPolarHBondContact O-CD2 3.31Å; E299-F303 PolarHBondContact O-N 3.28Å
300L95.7Very high95.2Very high7 Ų723.9 Ų23.94%0.03712%0.12CC..Hα-helixtrans-59.3-44.2179.9-174.957.8000112.3W194 T197 F201 F208 Q296 L297 S302 F303 F304 W385W194-L300 HydrophobicContact CZ3-CB 4.45Å; T197-L300 HydrophobicContact CG2-CD1 3.86Å; T197-L300 HydrophobicContact CG2-CD2 4.2Å; T197-L300 HydrophobicContact CG2-CG 4.46Å; F201-L300 HydrophobicContact CD2-CD1 4.14Å; F201-L300 HydrophobicContact CD2-CD2 4.2Å; F201-L300 HydrophobicContact CE1-CD2 4.49Å; F201-L300 HydrophobicContact CE2-CD1 4.42Å; F201-L300 HydrophobicContact CE2-CD2 3.64Å; F201-L300 HydrophobicContact CG-CD1 4.4Å; F201-L300 HydrophobicContact CZ-CD2 3.8Å; F208-L300 HydrophobicContact CE2-CD1 4.22Å; Q296-L300 VanDerWaalsContact O-CB 3.3Å; Q296-L300 WeakPolarHBondContact O-CB 3.42Å; Q296-L300 PolarHBondContact O-N 2.92Å; L297-L300 PolarHBondContact O-N 3.33Å; L300-S302 PolarHBondContact O-N 3.43Å; L300-F303 PolarHBondContact O-N 3.44Å; L300-F303 VanDerWaalsContact O-N 3.1Å; L300-F304 HydrophobicContact CD1-CD2 3.85Å; L300-F304 HydrophobicContact CD1-CE2 3.48Å; L300-F304 VanDerWaalsContact CD1-CE2 3.48Å; L300-F304 HydrophobicContact CD1-CZ 4.48Å; L300-F304 HydrophobicContact CD2-CE2 4.04Å; L300-F304 HydrophobicContact CG-CD2 3.75Å; L300-F304 HydrophobicContact CG-CE2 3.58Å; L300-F304 WeakPolarHBondContact O-CD2 3.35Å; L300-F304 PolarHBondContact O-N 3.43Å; L300-W385 HydrophobicContact CD2-CH2 4.1Å; L300-W385 HydrophobicContact CD2-CZ2 3.97Å
301N96.9Very high95.2Very high2 Ų219.8 Ų19.81%0.01110%0.101CC..Hα-helixtrans-54.8-37.6173.3-76.7-8.1000112L297 E299 F303 F304 L305 I359 E362 L363L297-N301 WeakPolarHBondContact O-CB 3.31Å; L297-N301 VanDerWaalsContact O-CG 3.25Å; L297-N301 PolarHBondContact O-N 3.44Å; E299-N301 PolarHBondContact O-N 3.47Å; N301-F303 VanDerWaalsContact C-N 3.31Å; N301-F303 PolarHBondContact O-N 3.2Å; N301-F304 PolarHBondContact O-N 2.9Å; N301-L305 WeakPolarHBondContact O-CB 3.31Å; N301-L305 VanDerWaalsContact O-CG 3.22Å; N301-L305 WeakPolarHBondContact O-CG 3.41Å; N301-L305 PolarHBondContact O-N 3.25Å; N301-I359 PolarHBondContact ND2-O 3.26Å; N301-E362 HydrophobicContact CB-CB 4.14Å; N301-E362 WeakPolarHBondContact ND2-CB 3.36Å; N301-L363 PolarHBondContact ND2-N 3.25Å
302S94.9Very high95.1Very high21 Ų2122.7 Ų22.715%0.14711%0.113CC..Hα-helixtrans-63.1-37.9179.9-59.50000112.6A298 E299 L300 R321A298-S302 PolarHBondContact O-N 3.43Å; A298-S302 PolarHBondContact O-OG 3.1Å; E299-S302 WeakPolarHBondContact O-CA 3.26Å; E299-S302 WeakPolarHBondContact O-CB 3.46Å; E299-S302 PolarHBondContact O-N 3.23Å; L300-S302 PolarHBondContact O-N 3.43Å; S302-R321 VanDerWaalsContact CA-NH1 3.33Å; S302-R321 PolarHBondContact OG-NH1 3.21Å; S302-R321 PolarHBondContact OG-NH2 2.9Å
303F93.9Very high94.8Very high51 Ų5123.3 Ų23.322%0.22412%0.117CC..Hα-helixtrans-76-37.9177.1-78.2-99.4000112.4W194 L205 F208 E299 L300 N301 K306 H307W194-F303 AromaticContact CH2-CD2 3.58Å; W194-F303 HydrophobicContact CH2-CD2 3.58Å; W194-F303 AromaticContact CH2-CE2 3.72Å; W194-F303 HydrophobicContact CH2-CE2 3.72Å; W194-F303 HydrophobicContact CH2-CG 4.44Å; W194-F303 AromaticContact CZ2-CD2 3.55Å; W194-F303 HydrophobicContact CZ2-CD2 3.55Å; W194-F303 AromaticContact CZ2-CE2 3.27Å; W194-F303 HydrophobicContact CZ2-CE2 3.27Å; W194-F303 HydrophobicContact CZ2-CG 4.34Å; W194-F303 AromaticContact CZ2-CZ 3.85Å; W194-F303 HydrophobicContact CZ2-CZ 3.85Å; L205-F303 HydrophobicContact CD1-CB 4.29Å; F208-F303 HydrophobicContact CD1-CD1 4.41Å; F208-F303 HydrophobicContact CE1-CB 4.27Å; F208-F303 AromaticContact CE1-CD1 3.32Å; F208-F303 HydrophobicContact CE1-CD1 3.32Å; F208-F303 HydrophobicContact CE1-CD2 4.48Å; F208-F303 AromaticContact CE1-CE1 3.66Å; F208-F303 HydrophobicContact CE1-CE1 3.66Å; F208-F303 AromaticContact CE1-CG 3.79Å; F208-F303 HydrophobicContact CE1-CG 3.79Å; F208-F303 HydrophobicContact CE1-CZ 4.37Å; F208-F303 HydrophobicContact CZ-CB 3.75Å; F208-F303 AromaticContact CZ-CD1 3.7Å; F208-F303 HydrophobicContact CZ-CD1 3.7Å; F208-F303 HydrophobicContact CZ-CD2 4.29Å; F208-F303 HydrophobicContact CZ-CE1 4.37Å; F208-F303 AromaticContact CZ-CG 3.66Å; F208-F303 HydrophobicContact CZ-CG 3.66Å; E299-F303 WeakPolarHBondContact O-CD2 3.31Å; E299-F303 PolarHBondContact O-N 3.28Å; L300-F303 PolarHBondContact O-N 3.44Å; L300-F303 VanDerWaalsContact O-N 3.1Å; N301-F303 VanDerWaalsContact C-N 3.31Å; N301-F303 PolarHBondContact O-N 3.2Å; F303-K306 WeakPolarHBondContact O-CG 3.01Å; F303-H307 PolarHBondContact O-N 3.34Å
304F95.3Very high94.5Very high6 Ų623.7 Ų23.73%0.02612%0.124CC..Hα-helixtrans-65.4-45.3175-84.5-66000112.6F201 I204 L205 L300 N301 K306 H307 I308 C366 F374F201-F304 HydrophobicContact CD1-CE2 4.18Å; F201-F304 AromaticContact CD1-CZ 3.74Å; F201-F304 HydrophobicContact CD1-CZ 3.74Å; F201-F304 HydrophobicContact CE1-CE2 4.28Å; F201-F304 HydrophobicContact CE1-CZ 4.09Å; F201-F304 HydrophobicContact CG-CZ 4.48Å; I204-F304 HydrophobicContact CG2-CE1 3.79Å; I204-F304 HydrophobicContact CG2-CZ 4.38Å; L205-F304 HydrophobicContact CD1-CD1 4.26Å; L205-F304 HydrophobicContact CD1-CE1 4.03Å; L205-F304 HydrophobicContact CD1-CE2 4.43Å; L205-F304 HydrophobicContact CD1-CZ 4.11Å; L205-F304 HydrophobicContact CD2-CD1 4.34Å; L205-F304 HydrophobicContact CD2-CE1 4.33Å; L205-F304 HydrophobicContact CG-CE1 4.15Å; L300-F304 HydrophobicContact CD1-CD2 3.85Å; L300-F304 HydrophobicContact CD1-CE2 3.48Å; L300-F304 VanDerWaalsContact CD1-CE2 3.48Å; L300-F304 HydrophobicContact CD1-CZ 4.48Å; L300-F304 HydrophobicContact CD2-CE2 4.04Å; L300-F304 HydrophobicContact CG-CD2 3.75Å; L300-F304 HydrophobicContact CG-CE2 3.58Å; L300-F304 WeakPolarHBondContact O-CD2 3.35Å; L300-F304 PolarHBondContact O-N 3.43Å; N301-F304 PolarHBondContact O-N 2.9Å; F304-K306 PolarHBondContact O-N 3.48Å; F304-H307 PolarHBondContact O-N 2.96Å; F304-H307 VanDerWaalsContact O-N 3.09Å; F304-I308 HydrophobicContact CB-CD1 4.18Å; F304-I308 WeakPolarHBondContact O-CB 3.33Å; F304-I308 VanDerWaalsContact O-CG1 3.28Å; F304-I308 WeakPolarHBondContact O-CG1 3.37Å; F304-I308 PolarHBondContact O-N 3.03Å; F304-C366 HydrophobicContact CB-CB 4.26Å; F304-F374 HydrophobicContact CD1-CE1 4.3Å; F304-F374 AromaticContact CD1-CZ 3.76Å; F304-F374 HydrophobicContact CD1-CZ 3.76Å; F304-F374 HydrophobicContact CD2-CZ 4.34Å; F304-F374 AromaticContact CE1-CE1 3.65Å; F304-F374 HydrophobicContact CE1-CE1 3.65Å; F304-F374 AromaticContact CE1-CZ 3.59Å; F304-F374 HydrophobicContact CE1-CZ 3.59Å; F304-F374 HydrophobicContact CE2-CE1 4.2Å; F304-F374 HydrophobicContact CE2-CZ 4.18Å; F304-F374 HydrophobicContact CG-CZ 4.15Å; F304-F374 AromaticContact CZ-CE1 3.6Å; F304-F374 HydrophobicContact CZ-CE1 3.6Å; F304-F374 AromaticContact CZ-CZ 3.82Å; F304-F374 HydrophobicContact CZ-CZ 3.82Å
305L95.6Very high94.3Very high10 Ų1022 Ų225%0.05211%0.113CC..Hα-helixtrans-59.4-44.7-178.9-71.7167.6000111.9N301 H307 F309 E362 V365N301-L305 WeakPolarHBondContact O-CB 3.31Å; N301-L305 VanDerWaalsContact O-CG 3.22Å; N301-L305 WeakPolarHBondContact O-CG 3.41Å; N301-L305 PolarHBondContact O-N 3.25Å; L305-H307 VanDerWaalsContact C-N 3.26Å; L305-H307 PolarHBondContact O-N 3.19Å; L305-F309 HydrophobicContact CB-CD2 4.43Å; L305-F309 HydrophobicContact CD2-CD2 4.28Å; L305-F309 HydrophobicContact CD2-CE2 3.69Å; L305-F309 WeakPolarHBondContact O-CB 3.4Å; L305-F309 WeakPolarHBondContact O-CD2 3.34Å; L305-F309 PolarHBondContact O-N 3.19Å; L305-E362 HydrophobicContact CD1-CB 4.14Å; L305-E362 HydrophobicContact CD1-CG 3.87Å; L305-V365 HydrophobicContact CD2-CB 4.38Å; L305-V365 HydrophobicContact CD2-CG1 3.83Å
306K94Very high94.3Very high21 Ų2124.8 Ų24.89%0.09113%0.13CC..Hα-helixtrans-61.5-37.417765.9162.7-174.4168.60111.8F303 F304 I310 V311 P313F303-K306 WeakPolarHBondContact O-CG 3.01Å; F304-K306 PolarHBondContact O-N 3.48Å; K306-I310 PolarHBondContact O-N 3.49Å; K306-I310 VanDerWaalsContact O-N 3.12Å; K306-V311 PolarHBondContact O-N 2.94Å; K306-P313 HydrophobicContact CD-CG 4.24Å
307H93.6Very high94.2Very high21 Ų2127.1 Ų27.110%0.09714%0.142CC..Hα-helixtrans-74.2-50.2-177.2-17575000111.3H139 L205 F303 F304 L305 F309 I310H139-H307 AromaticContact CD2-CE1 3.89Å; L205-H307 HydrophobicContact CD2-CB 3.63Å; L205-H307 VanDerWaalsContact CD2-CG 3.43Å; F303-H307 PolarHBondContact O-N 3.34Å; F304-H307 PolarHBondContact O-N 2.96Å; F304-H307 VanDerWaalsContact O-N 3.09Å; L305-H307 VanDerWaalsContact C-N 3.26Å; L305-H307 PolarHBondContact O-N 3.19Å; H307-F309 VanDerWaalsContact C-N 3.32Å; H307-F309 PolarHBondContact O-N 2.63Å; H307-I310 PolarHBondContact O-N 2.8Å
308I94.8Very high94.1Very high4 Ų426.7 Ų26.72%0.02114%0.141CC..Hα-helixtrans-58-44177.6-67.6165.4000111L120 F304 I310 C366 L369 I373L120-I308 HydrophobicContact CD1-CG2 3.76Å; F304-I308 HydrophobicContact CB-CD1 4.18Å; F304-I308 WeakPolarHBondContact O-CB 3.33Å; F304-I308 VanDerWaalsContact O-CG1 3.28Å; F304-I308 WeakPolarHBondContact O-CG1 3.37Å; F304-I308 PolarHBondContact O-N 3.03Å; I308-I310 VanDerWaalsContact C-N 3.28Å; I308-I310 PolarHBondContact O-N 3.34Å; I308-C366 HydrophobicContact CD1-CB 3.96Å; I308-L369 HydrophobicContact CG2-CB 4.03Å; I308-I373 HydrophobicContact CG1-CD1 3.94Å
309F95Very high93.9Very high26 Ų2630.6 Ų30.611%0.11416%0.158CC..THydrogen-bonded Turntrans-854.8178.4-65.5-59.6000114V115 L120 A123 R124 L127 L305 H307 V311 V365 L369V115-F309 HydrophobicContact CG1-CZ 3.91Å; L120-F309 HydrophobicContact CD1-CD1 4.28Å; L120-F309 HydrophobicContact CD1-CE1 4.3Å; A123-F309 HydrophobicContact CB-CE1 3.77Å; R124-F309 PolarHBondContact NH1-O 3.27Å; L127-F309 HydrophobicContact CD1-CB 3.74Å; L127-F309 HydrophobicContact CD1-CD1 3.69Å; L127-F309 HydrophobicContact CD1-CE1 4.47Å; L127-F309 HydrophobicContact CD1-CG 3.76Å; L305-F309 HydrophobicContact CB-CD2 4.43Å; L305-F309 HydrophobicContact CD2-CD2 4.28Å; L305-F309 HydrophobicContact CD2-CE2 3.69Å; L305-F309 WeakPolarHBondContact O-CB 3.4Å; L305-F309 WeakPolarHBondContact O-CD2 3.34Å; L305-F309 PolarHBondContact O-N 3.19Å; H307-F309 VanDerWaalsContact C-N 3.32Å; H307-F309 PolarHBondContact O-N 2.63Å; F309-V311 HydrophobicContact CB-CG2 4.01Å; F309-V311 WeakPolarHBondContact O-CG2 3.06Å; F309-V311 PolarHBondContact O-N 3.26Å; F309-V365 HydrophobicContact CE2-CG1 4.12Å; F309-V365 HydrophobicContact CZ-CG1 3.9Å; F309-L369 HydrophobicContact CE1-CD1 3.85Å; F309-L369 HydrophobicContact CZ-CD1 3.74Å
310I94.5Very high93.9Very high19 Ų1933.5 Ų33.510%0.09717%0.173CC..THydrogen-bonded Turntrans46.956.7-179.7-42.6174.3000111.4R124 M137 R138 H139 I142 K306 H307 I308R124-I310 VanDerWaalsContact NH1-CD1 3.27Å; M137-I310 HydrophobicContact CB-CG2 4.19Å; R138-I310 VanDerWaalsContact C-CG2 3.4Å; H139-I310 WeakPolarHBondContact CE1-CD1 3.37Å; H139-I310 WeakPolarHBondContact NE2-CG1 3.3Å; I142-I310 HydrophobicContact CD1-CB 4.2Å; I142-I310 HydrophobicContact CD1-CG2 3.82Å; I142-I310 HydrophobicContact CG1-CG2 4Å; K306-I310 PolarHBondContact O-N 3.49Å; K306-I310 VanDerWaalsContact O-N 3.12Å; H307-I310 PolarHBondContact O-N 2.8Å; I308-I310 VanDerWaalsContact C-N 3.28Å; I308-I310 PolarHBondContact O-N 3.34Å
311V93.8Very high93.9Very high3 Ų334.6 Ų34.62%0.01818%0.177CC..  trans-117.1126.4177.4-174.50000108.2L134 K306 F309 H315 L317 T318L134-V311 HydrophobicContact CD1-CG2 4.21Å; L134-V311 HydrophobicContact CD2-CG1 4.46Å; L134-V311 HydrophobicContact CD2-CG2 4.48Å; K306-V311 PolarHBondContact O-N 2.94Å; F309-V311 HydrophobicContact CB-CG2 4.01Å; F309-V311 WeakPolarHBondContact O-CG2 3.06Å; F309-V311 PolarHBondContact O-N 3.26Å; V311-H315 HydrophobicContact CG1-CB 3.53Å; V311-L317 HydrophobicContact CG2-CD2 4.4Å; V311-T318 WeakPolarHBondContact CG1-OG1 3.15Å
312K92.1Very high93.8Very high75 Ų7538.8 Ų38.833%0.32620%0.199SC..  trans-64.8151.5178.662.8-179.5-169.6170.60112.1M137 S314 H315 T318M137-K312 HydrophobicContact CE-CB 3.78Å; M137-K312 HydrophobicContact CE-CD 4.21Å; M137-K312 HydrophobicContact CE-CG 4.06Å; K312-S314 VanDerWaalsContact C-N 3.26Å; K312-S314 VanDerWaalsContact CD-OG 3.25Å; K312-S314 WeakPolarHBondContact CD-OG 3.28Å; K312-S314 VanDerWaalsContact CE-OG 3.26Å; K312-S314 WeakPolarHBondContact CE-OG 3.49Å; K312-S314 PolarHBondContact O-N 3.47Å; K312-H315 HydrophobicContact CG-CB 3.76Å; K312-H315 VanDerWaalsContact O-CB 3.29Å; K312-H315 WeakPolarHBondContact O-CB 3.38Å; K312-H315 PolarHBondContact O-N 3.46Å; K312-H315 VanDerWaalsContact O-N 3.11Å; K312-T318 PolarHBondContact O-OG1 2.98Å; K312-T318 VanDerWaalsContact O-OG1 3.11Å
313P89.1Confident93.8Very high14 Ų1442.8 Ų42.89%0.09122%0.218CC..THydrogen-bonded Turntrans-56.7-38176.8-2534.7000113.4F166 K306 H315 Q319F166-P313 HydrophobicContact CE1-CB 4.23Å; K306-P313 HydrophobicContact CD-CG 4.24Å; P313-H315 PolarHBondContact O-N 3.46Å; P313-Q319 PolarHBondContact O-NE2 2.84Å
314S89.4Confident94Very high64 Ų6442.2 Ų42.245%0.44822%0.217SC..THydrogen-bonded Turntrans-75.1-5.8-179.956.90000114.7K312K312-S314 VanDerWaalsContact C-N 3.26Å; K312-S314 VanDerWaalsContact CD-OG 3.25Å; K312-S314 WeakPolarHBondContact CD-OG 3.28Å; K312-S314 VanDerWaalsContact CE-OG 3.26Å; K312-S314 WeakPolarHBondContact CE-OG 3.49Å; K312-S314 PolarHBondContact O-N 3.47Å
315H92.5Very high94Very high11 Ų1142.8 Ų42.85%0.05122%0.22CC..SBendtrans-70.6142.9-178.3-167.9-97.7000111.5Y131 E133 V311 K312 P313 L317 T318 Q319Y131-H315 AromaticContact CD1-CE1 3.74Å; Y131-H315 AromaticContact CG-CE1 3.82Å; E133-H315 IonicContact OE1-NE2 3.18Å; E133-H315 PolarHBondContact OE1-NE2 3.49Å; V311-H315 HydrophobicContact CG1-CB 3.53Å; K312-H315 HydrophobicContact CG-CB 3.76Å; K312-H315 VanDerWaalsContact O-CB 3.29Å; K312-H315 WeakPolarHBondContact O-CB 3.38Å; K312-H315 PolarHBondContact O-N 3.46Å; K312-H315 VanDerWaalsContact O-N 3.11Å; P313-H315 PolarHBondContact O-N 3.46Å; H315-L317 WeakPolarHBondContact ND1-CB 3.46Å; H315-L317 PolarHBondContact ND1-N 3.47Å; H315-L317 VanDerWaalsContact ND1-N 3.11Å; H315-L317 PolarHBondContact O-N 3.36Å; H315-L317 VanDerWaalsContact O-N 3.15Å; H315-T318 PolarHBondContact O-N 2.89Å; H315-Q319 WeakPolarHBondContact O-CG 3.18Å; H315-Q319 PolarHBondContact O-N 3.27Å; H315-Q319 VanDerWaalsContact O-N 3.08Å
316I93.9Very high94Very high89 Ų8944.4 Ų44.446%0.45623%0.23SC..Hα-helixtrans-55.8-36.6-178.5-172.458.9000112.6Y131 T318 Q319 L320Y131-I316 HydrophobicContact CE1-CG2 3.86Å; I316-T318 PolarHBondContact O-N 2.94Å; I316-Q319 PolarHBondContact O-N 3.33Å; I316-L320 HydrophobicContact CD1-CD1 4.23Å; I316-L320 HydrophobicContact CD1-CD2 4.32Å; I316-L320 HydrophobicContact CD1-CG 3.88Å; I316-L320 HydrophobicContact CG1-CD1 3.84Å; I316-L320 HydrophobicContact CG1-CG 3.98Å; I316-L320 VanDerWaalsContact O-CB 3.3Å; I316-L320 WeakPolarHBondContact O-CB 3.5Å; I316-L320 VanDerWaalsContact O-CG 3.26Å; I316-L320 WeakPolarHBondContact O-CG 3.24Å; I316-L320 PolarHBondContact O-N 3.43Å
317L94.1Very high94.1Very high51 Ų5145.6 Ų45.627%0.26724%0.241SC..Hα-helixtrans-58.4-46.8175.8-177.161.7000112.2L127 Y131 V311 H315 R321L127-L317 HydrophobicContact CD2-CD2 3.81Å; Y131-L317 HydrophobicContact CE2-CB 4.29Å; Y131-L317 HydrophobicContact CE2-CD1 4.11Å; Y131-L317 HydrophobicContact CE2-CD2 4.33Å; Y131-L317 HydrophobicContact CE2-CG 4.48Å; V311-L317 HydrophobicContact CG2-CD2 4.4Å; H315-L317 WeakPolarHBondContact ND1-CB 3.46Å; H315-L317 PolarHBondContact ND1-N 3.47Å; H315-L317 VanDerWaalsContact ND1-N 3.11Å; H315-L317 PolarHBondContact O-N 3.36Å; H315-L317 VanDerWaalsContact O-N 3.15Å; L317-R321 WeakPolarHBondContact O-CB 3.27Å; L317-R321 PolarHBondContact O-N 3.29Å
318T93.8Very high94.3Very high29 Ų2944.6 Ų44.618%0.17824%0.236CC..Hα-helixtrans-65.8-43.6179.1-52.10000110.6V311 K312 H315 I316 R321 L322V311-T318 WeakPolarHBondContact CG1-OG1 3.15Å; K312-T318 PolarHBondContact O-OG1 2.98Å; K312-T318 VanDerWaalsContact O-OG1 3.11Å; H315-T318 PolarHBondContact O-N 2.89Å; I316-T318 PolarHBondContact O-N 2.94Å; T318-R321 PolarHBondContact O-N 2.87Å; T318-L322 WeakPolarHBondContact O-CB 3.45Å; T318-L322 PolarHBondContact O-N 3.11Å
319Q93.2Very high94.4Very high92 Ų9244.9 Ų44.943%0.4324%0.239SC..Hα-helixtrans-64.9-44.7178.9-62.6-61.5-32.200112.3P313 H315 I316 L322 L323P313-Q319 PolarHBondContact O-NE2 2.84Å; H315-Q319 WeakPolarHBondContact O-CG 3.18Å; H315-Q319 PolarHBondContact O-N 3.27Å; H315-Q319 VanDerWaalsContact O-N 3.08Å; I316-Q319 PolarHBondContact O-N 3.33Å; Q319-L322 PolarHBondContact O-N 3.13Å; Q319-L323 WeakPolarHBondContact O-CB 3.29Å; Q319-L323 PolarHBondContact O-N 2.65Å
320L95.2Very high94.3Very high87 Ų8744.3 Ų44.346%0.45524%0.239SC..Hα-helixtrans-64.8-39.8176.1-73.4178.1000111.7I316 L323 L324I316-L320 HydrophobicContact CD1-CD1 4.23Å; I316-L320 HydrophobicContact CD1-CD2 4.32Å; I316-L320 HydrophobicContact CD1-CG 3.88Å; I316-L320 HydrophobicContact CG1-CD1 3.84Å; I316-L320 HydrophobicContact CG1-CG 3.98Å; I316-L320 VanDerWaalsContact O-CB 3.3Å; I316-L320 WeakPolarHBondContact O-CB 3.5Å; I316-L320 VanDerWaalsContact O-CG 3.26Å; I316-L320 WeakPolarHBondContact O-CG 3.24Å; I316-L320 PolarHBondContact O-N 3.43Å; L320-L323 PolarHBondContact O-N 2.92Å; L320-L324 VanDerWaalsContact O-CB 3.27Å; L320-L324 WeakPolarHBondContact O-CB 3.17Å; L320-L324 PolarHBondContact O-N 2.89Å
321R96.2Very high94.4Very high31 Ų3143.7 Ų43.712%0.11724%0.236CC..Hα-helixtrans-63.5-46.4174.9-175.2-178.5161.4-76.6-2.9110.9Y108 S302 L317 T318 L323 L324 I325 E362Y108-R321 WeakPolarHBondContact OH-CD 3.42Å; Y108-R321 PolarHBondContact OH-NE 2.94Å; S302-R321 VanDerWaalsContact CA-NH1 3.33Å; S302-R321 PolarHBondContact OG-NH1 3.21Å; S302-R321 PolarHBondContact OG-NH2 2.9Å; L317-R321 WeakPolarHBondContact O-CB 3.27Å; L317-R321 PolarHBondContact O-N 3.29Å; T318-R321 PolarHBondContact O-N 2.87Å; R321-L323 VanDerWaalsContact C-N 3.34Å; R321-L323 PolarHBondContact O-N 3.2Å; R321-L324 PolarHBondContact O-N 3.33Å; R321-I325 HydrophobicContact CG-CG1 4.32Å; R321-I325 WeakPolarHBondContact O-CG1 3.12Å; R321-I325 PolarHBondContact O-N 3.03Å; R321-E362 IonicContact CZ-OE1 3.34Å; R321-E362 VanDerWaalsContact CZ-OE1 3.27Å; R321-E362 IonicContact NE-OE1 2.68Å; R321-E362 PolarHBondContact NE-OE1 2.92Å; R321-E362 VanDerWaalsContact NE-OE1 3.1Å; R321-E362 IonicContact NH2-OE1 2.75Å; R321-E362 PolarHBondContact NH2-OE1 3.23Å; R321-E362 IonicContact NH2-OE2 3.41Å; R321-E362 PolarHBondContact NH2-OE2 2.76Å
322L94.5Very high94.5Very high90 Ų9043.6 Ų43.647%0.47124%0.236SC..Hα-helixtrans-59.7-44.8177.6-179.960.6000111.7T318 Q319 I325 T326T318-L322 WeakPolarHBondContact O-CB 3.45Å; T318-L322 PolarHBondContact O-N 3.11Å; Q319-L322 PolarHBondContact O-N 3.13Å; L322-I325 PolarHBondContact O-N 2.95Å; L322-T326 WeakPolarHBondContact O-CB 3.41Å; L322-T326 PolarHBondContact O-N 3.09Å; L322-T326 PolarHBondContact O-OG1 3.33Å
323L95.7Very high94.6Very high104 Ų10440.5 Ų40.555%0.54522%0.223SC..Hα-helixtrans-60.8-44.8174.9178.663.4000111.7Q319 L320 R321 T326 C327Q319-L323 WeakPolarHBondContact O-CB 3.29Å; Q319-L323 PolarHBondContact O-N 2.65Å; L320-L323 PolarHBondContact O-N 2.92Å; R321-L323 VanDerWaalsContact C-N 3.34Å; R321-L323 PolarHBondContact O-N 3.2Å; L323-T326 PolarHBondContact O-N 2.95Å; L323-C327 WeakPolarHBondContact O-CB 3.27Å; L323-C327 PolarHBondContact O-N 3.16Å; L323-C327 PolarHBondContact O-SG 2.95Å; L323-C327 VanDerWaalsContact O-SG 3.33Å
324L96.9Very high94.9Very high39 Ų3941.8 Ų41.820%0.20423%0.226CC..Hα-helixtrans-61.1-51.2178.5178.161.9000111.2A104 Y108 L320 R321 T326 C327 I328A104-L324 HydrophobicContact CB-CD1 3.71Å; Y108-L324 HydrophobicContact CD1-CD2 4.37Å; Y108-L324 HydrophobicContact CD2-CD2 4.46Å; Y108-L324 HydrophobicContact CG-CD2 4Å; L320-L324 VanDerWaalsContact O-CB 3.27Å; L320-L324 WeakPolarHBondContact O-CB 3.17Å; L320-L324 PolarHBondContact O-N 2.89Å; R321-L324 PolarHBondContact O-N 3.33Å; L324-T326 VanDerWaalsContact C-N 3.3Å; L324-T326 PolarHBondContact O-N 3.05Å; L324-C327 PolarHBondContact O-N 3.28Å; L324-I328 HydrophobicContact CD1-CD1 3.76Å; L324-I328 HydrophobicContact CD1-CG1 4.12Å; L324-I328 HydrophobicContact CD2-CD1 4.37Å; L324-I328 HydrophobicContact CG-CD1 3.65Å; L324-I328 HydrophobicContact CG-CG1 4.4Å; L324-I328 WeakPolarHBondContact O-CB 3.38Å; L324-I328 WeakPolarHBondContact O-CG1 3.37Å; L324-I328 PolarHBondContact O-N 3.05Å
325I97Very high95.1Very high18 Ų1838.8 Ų38.89%0.09220%0.204CC..Hα-helixtrans-60.4-41178.3-65.8-62.9000110.9Y108 R321 L322 C327 I328 S329 F355 I358Y108-I325 HydrophobicContact CE1-CD1 4.24Å; R321-I325 HydrophobicContact CG-CG1 4.32Å; R321-I325 WeakPolarHBondContact O-CG1 3.12Å; R321-I325 PolarHBondContact O-N 3.03Å; L322-I325 PolarHBondContact O-N 2.95Å; I325-C327 PolarHBondContact O-N 2.72Å; I325-I328 PolarHBondContact O-N 2.8Å; I325-S329 VanDerWaalsContact O-CB 3.3Å; I325-S329 WeakPolarHBondContact O-CB 3.49Å; I325-S329 PolarHBondContact O-N 3.04Å; I325-S329 PolarHBondContact O-OG 3.05Å; I325-F355 HydrophobicContact CD1-CE2 4.32Å; I325-F355 HydrophobicContact CG2-CE2 4.1Å; I325-F355 HydrophobicContact CG2-CZ 4.31Å; I325-I358 HydrophobicContact CD1-CG2 4.17Å
326T95.6Very high95.2Very high44 Ų4439.1 Ų39.127%0.2721%0.205SC..Hα-helixtrans-59.5-49.1175-58.10000111.1I176 L322 L323 L324 I328 S329 A330I176-T326 HydrophobicContact CG2-CG2 3.89Å; L322-T326 WeakPolarHBondContact O-CB 3.41Å; L322-T326 PolarHBondContact O-N 3.09Å; L322-T326 PolarHBondContact O-OG1 3.33Å; L323-T326 PolarHBondContact O-N 2.95Å; L324-T326 VanDerWaalsContact C-N 3.3Å; L324-T326 PolarHBondContact O-N 3.05Å; T326-I328 PolarHBondContact O-N 3.34Å; T326-S329 PolarHBondContact O-N 3.22Å; T326-S329 PolarHBondContact O-OG 2.77Å; T326-A330 PolarHBondContact O-N 2.66Å
327C96.1Very high95.2Very high46 Ų4636.1 Ų36.131%0.31119%0.189SC..Hα-helixtrans-63-38.9177.8-73.20000113.1V101 L323 L324 I325 P331V101-C327 HydrophobicContact CG1-CB 4.16Å; V101-C327 HydrophobicContact CG2-CB 4.07Å; L323-C327 WeakPolarHBondContact O-CB 3.27Å; L323-C327 PolarHBondContact O-N 3.16Å; L323-C327 PolarHBondContact O-SG 2.95Å; L323-C327 VanDerWaalsContact O-SG 3.33Å; L324-C327 PolarHBondContact O-N 3.28Å; I325-C327 PolarHBondContact O-N 2.72Å; C327-P331 WeakPolarHBondContact O-CD 3.42Å
328I97.1Very high95.1Very high0 Ų034.1 Ų34.10%018%0.178CC..Hα-helixtrans-66.6-41.2176.6-73.6171.4000111.1V101 L324 I325 T326 A330 P331 A332 F355 I358V101-I328 HydrophobicContact CG1-CG1 3.99Å; L324-I328 HydrophobicContact CD1-CD1 3.76Å; L324-I328 HydrophobicContact CD1-CG1 4.12Å; L324-I328 HydrophobicContact CD2-CD1 4.37Å; L324-I328 HydrophobicContact CG-CD1 3.65Å; L324-I328 HydrophobicContact CG-CG1 4.4Å; L324-I328 WeakPolarHBondContact O-CB 3.38Å; L324-I328 WeakPolarHBondContact O-CG1 3.37Å; L324-I328 PolarHBondContact O-N 3.05Å; I325-I328 PolarHBondContact O-N 2.8Å; T326-I328 PolarHBondContact O-N 3.34Å; I328-A330 VanDerWaalsContact C-N 3.31Å; I328-A330 PolarHBondContact O-N 2.84Å; I328-P331 WeakPolarHBondContact O-CD 3.36Å; I328-P331 WeakPolarHBondContact O-CG 3.32Å; I328-A332 WeakPolarHBondContact O-CB 3.42Å; I328-A332 PolarHBondContact O-N 3.02Å; I328-F355 HydrophobicContact CG2-CB 3.76Å; I328-F355 HydrophobicContact CG2-CD2 3.37Å; I328-F355 HydrophobicContact CG2-CE2 4.04Å; I328-F355 HydrophobicContact CG2-CG 3.64Å; I328-I358 HydrophobicContact CD1-CD1 4.18Å
329S96.1Very high95Very high10 Ų1036.2 Ų36.27%0.0718%0.183CC..Hα-helixtrans-64-35.5-175.374.10000112.1L180 I325 T326 A332 I333L180-S329 WeakPolarHBondContact CD1-OG 3.31Å; I325-S329 VanDerWaalsContact O-CB 3.3Å; I325-S329 WeakPolarHBondContact O-CB 3.49Å; I325-S329 PolarHBondContact O-N 3.04Å; I325-S329 PolarHBondContact O-OG 3.05Å; T326-S329 PolarHBondContact O-N 3.22Å; T326-S329 PolarHBondContact O-OG 2.77Å; S329-A332 PolarHBondContact O-N 3.01Å; S329-I333 WeakPolarHBondContact O-CB 3.45Å; S329-I333 VanDerWaalsContact O-CD1 3.3Å; S329-I333 WeakPolarHBondContact O-CD1 3.47Å; S329-I333 WeakPolarHBondContact O-CG1 3.46Å; S329-I333 PolarHBondContact O-N 3.4Å
330A94.3Very high94.9Very high15 Ų1532.5 Ų32.512%0.12417%0.167CC..Hα-helixtrans-57-57.7-176.700000113.7F90 W98 L180 T326 I328 A332 R334F90-A330 VanDerWaalsContact CE2-C 3.45Å; F90-A330 HydrophobicContact CE2-CB 3.93Å; W98-A330 HydrophobicContact CH2-CB 4.42Å; W98-A330 HydrophobicContact CZ3-CB 4.46Å; L180-A330 HydrophobicContact CD2-CB 3.57Å; T326-A330 PolarHBondContact O-N 2.66Å; I328-A330 VanDerWaalsContact C-N 3.31Å; I328-A330 PolarHBondContact O-N 2.84Å; A330-A332 VanDerWaalsContact C-N 3.35Å; A330-R334 PolarHBondContact O-N 2.81Å
331P95.2Very high94.6Very high5 Ų529.8 Ų29.83%0.03215%0.154CC..Hα-helixtrans-65.3-36.8174.623-32.5000112.1P89 F90 W98 C327 I328 I333 R334 Q335 Q351P89-P331 HydrophobicContact CG-CB 3.81Å; F90-P331 HydrophobicContact CD2-CB 4.19Å; F90-P331 HydrophobicContact CE2-CB 4.14Å; W98-P331 HydrophobicContact CE3-CG 4.18Å; W98-P331 HydrophobicContact CZ3-CG 4.27Å; C327-P331 WeakPolarHBondContact O-CD 3.42Å; I328-P331 WeakPolarHBondContact O-CD 3.36Å; I328-P331 WeakPolarHBondContact O-CG 3.32Å; P331-I333 PolarHBondContact O-N 3.3Å; P331-R334 PolarHBondContact O-N 2.96Å; P331-Q335 VanDerWaalsContact O-CG 3.29Å; P331-Q335 WeakPolarHBondContact O-CG 3.43Å; P331-Q335 PolarHBondContact O-N 2.95Å; P331-Q351 HydrophobicContact CB-CG 3.98Å; P331-Q351 HydrophobicContact CG-CG 3.68Å
332A96.7Very high94.1Very high1 Ų129.5 Ų29.51%0.00816%0.155CC..Hα-helixtrans-61.5-45.6179.300000112.6I328 S329 A330 R334 Q335 Y336 Q351 L352 F355I328-A332 WeakPolarHBondContact O-CB 3.42Å; I328-A332 PolarHBondContact O-N 3.02Å; S329-A332 PolarHBondContact O-N 3.01Å; A330-A332 VanDerWaalsContact C-N 3.35Å; A332-R334 VanDerWaalsContact C-N 3.33Å; A332-R334 PolarHBondContact O-N 3.19Å; A332-Q335 PolarHBondContact O-N 3.3Å; A332-Y336 WeakPolarHBondContact O-CB 3.29Å; A332-Y336 PolarHBondContact O-N 2.94Å; A332-Q351 HydrophobicContact CB-CG 4.47Å; A332-L352 HydrophobicContact CB-CB 4.4Å; A332-L352 HydrophobicContact CB-CD1 4.41Å; A332-F355 HydrophobicContact CB-CB 3.96Å; A332-F355 HydrophobicContact CB-CD1 3.61Å; A332-F355 HydrophobicContact CB-CE1 4.5Å; A332-F355 HydrophobicContact CB-CG 4.14Å
333I94.7Very high93.6Very high11 Ų1130.2 Ų30.26%0.05617%0.165CC..Hα-helixtrans-63.9-39.4176.9-66.3157.7000110.4L180 W275 W295 S329 P331 Y336 Y337L180-I333 HydrophobicContact CB-CD1 3.91Å; L180-I333 HydrophobicContact CD1-CD1 4.06Å; L180-I333 HydrophobicContact CG-CD1 4.46Å; W275-I333 HydrophobicContact CH2-CG2 4.06Å; W275-I333 HydrophobicContact CZ2-CG2 3.92Å; W295-I333 HydrophobicContact CE3-CD1 4.37Å; W295-I333 HydrophobicContact CH2-CD1 3.66Å; W295-I333 HydrophobicContact CZ3-CD1 3.31Å; W295-I333 HydrophobicContact CZ3-CG1 4Å; S329-I333 WeakPolarHBondContact O-CB 3.45Å; S329-I333 VanDerWaalsContact O-CD1 3.3Å; S329-I333 WeakPolarHBondContact O-CD1 3.47Å; S329-I333 WeakPolarHBondContact O-CG1 3.46Å; S329-I333 PolarHBondContact O-N 3.4Å; P331-I333 PolarHBondContact O-N 3.3Å; I333-Y336 PolarHBondContact O-N 3.35Å; I333-Y337 WeakPolarHBondContact O-CB 3.36Å; I333-Y337 PolarHBondContact O-N 3.43Å
334R93.8Very high93.2Very high41 Ų4130 Ų3016%0.15516%0.161CC..Hα-helixtrans-63.7-44175.4177.356.5179.5169.71.5111.8P89 F90 A330 P331 A332 Y336 Y337 L338P89-R334 HydrophobicContact CB-CB 4.45Å; P89-R334 HydrophobicContact CB-CG 3.76Å; P89-R334 HydrophobicContact CG-CB 4.12Å; P89-R334 HydrophobicContact CG-CG 3.98Å; F90-R334 HydrophobicContact CE1-CB 4.05Å; F90-R334 HydrophobicContact CE1-CG 3.97Å; F90-R334 HydrophobicContact CZ-CB 3.79Å; F90-R334 HydrophobicContact CZ-CG 4.24Å; A330-R334 PolarHBondContact O-N 2.81Å; P331-R334 PolarHBondContact O-N 2.96Å; A332-R334 VanDerWaalsContact C-N 3.33Å; A332-R334 PolarHBondContact O-N 3.19Å; R334-Y336 VanDerWaalsContact C-N 3.32Å; R334-Y337 PolarHBondContact O-N 3.44Å; R334-L338 WeakPolarHBondContact O-CG 3.48Å; R334-L338 PolarHBondContact O-N 3.28Å; R334-L338 VanDerWaalsContact O-N 3.13Å
335Q94.8Very high92.7Very high0 Ų028.4 Ų28.40%015%0.152CC..Hα-helixtrans-64.5-38.4175.4-66.8-176.1-24.600111.2I20 P89 P331 A332 L338 Y339 G349 L352I20-Q335 HydrophobicContact CG2-CG 3.9Å; I20-Q335 PolarHBondContact O-NE2 2.69Å; I20-Q335 VanDerWaalsContact O-NE2 3.09Å; P89-Q335 HydrophobicContact CB-CG 4.42Å; P89-Q335 HydrophobicContact CG-CG 4.03Å; P331-Q335 VanDerWaalsContact O-CG 3.29Å; P331-Q335 WeakPolarHBondContact O-CG 3.43Å; P331-Q335 PolarHBondContact O-N 2.95Å; A332-Q335 PolarHBondContact O-N 3.3Å; Q335-L338 PolarHBondContact O-N 2.91Å; Q335-Y339 WeakPolarHBondContact O-CB 3.49Å; Q335-Y339 PolarHBondContact O-N 3.47Å; Q335-G349 VanDerWaalsContact OE1-C 3.26Å; Q335-L352 HydrophobicContact CB-CB 4.04Å
336Y95.2Very high92.2Very high18 Ų1834.2 Ų34.27%0.07118%0.177CC..Hα-helixtrans-64-46.4175.5-166.7-97.2000112W275 L287 Q290 L291 A332 I333 R334 L338 Y339 V340 L352W275-Y336 HydrophobicContact CH2-CD1 4.35Å; W275-Y336 HydrophobicContact CZ3-CD1 4.02Å; L287-Y336 VanDerWaalsContact C-OH 3.29Å; L287-Y336 PolarHBondContact O-OH 3.25Å; Q290-Y336 PolarHBondContact OE1-OH 2.91Å; L291-Y336 HydrophobicContact CB-CD1 4.32Å; L291-Y336 HydrophobicContact CB-CE1 3.73Å; L291-Y336 HydrophobicContact CD1-CD1 4.01Å; L291-Y336 HydrophobicContact CD1-CE1 4.23Å; L291-Y336 HydrophobicContact CD2-CD1 4.35Å; L291-Y336 HydrophobicContact CD2-CE1 4.42Å; L291-Y336 HydrophobicContact CG-CD1 4.46Å; L291-Y336 HydrophobicContact CG-CE1 4.35Å; A332-Y336 WeakPolarHBondContact O-CB 3.29Å; A332-Y336 PolarHBondContact O-N 2.94Å; I333-Y336 PolarHBondContact O-N 3.35Å; R334-Y336 VanDerWaalsContact C-N 3.32Å; Y336-L338 VanDerWaalsContact C-N 3.32Å; Y336-L338 PolarHBondContact O-N 3.26Å; Y336-Y339 PolarHBondContact O-N 3.37Å; Y336-V340 HydrophobicContact CD1-CG2 3.88Å; Y336-V340 HydrophobicContact CE1-CG2 3.47Å; Y336-V340 VanDerWaalsContact CE1-CG2 3.47Å; Y336-V340 HydrophobicContact CE2-CG2 4.3Å; Y336-V340 HydrophobicContact CG-CG2 4.43Å; Y336-V340 WeakPolarHBondContact O-CB 3.48Å; Y336-V340 VanDerWaalsContact O-CG2 3.31Å; Y336-V340 WeakPolarHBondContact O-CG2 3.07Å; Y336-V340 PolarHBondContact O-N 3.13Å; Y336-L352 HydrophobicContact CD2-CD1 3.94Å; Y336-L352 HydrophobicContact CD2-CD2 3.73Å; Y336-L352 HydrophobicContact CD2-CG 4.47Å; Y336-L352 HydrophobicContact CG-CD1 4.47Å; Y336-L352 HydrophobicContact CG-CD2 4.36Å
337Y92.9Very high92Very high27 Ų2739.4 Ų39.411%0.10619%0.192CC..Hα-helixtrans-53.1-50.7175176.1-96.3000111.4T273 R274 W275 I333 R334 V340 T341T273-Y337 HydrophobicContact CG2-CD2 4.07Å; T273-Y337 HydrophobicContact CG2-CE2 4Å; T273-Y337 HydrophobicContact CG2-CG 4.41Å; R274-Y337 PolarHBondContact N-OH 2.98Å; W275-Y337 AromaticContact CD2-CD2 3.75Å; W275-Y337 HydrophobicContact CD2-CD2 3.75Å; W275-Y337 HydrophobicContact CD2-CE2 4.27Å; W275-Y337 AromaticContact CE2-CD2 3.74Å; W275-Y337 AromaticContact CE3-CD2 3.71Å; W275-Y337 HydrophobicContact CE3-CD2 3.71Å; W275-Y337 HydrophobicContact CE3-CE2 4.45Å; W275-Y337 HydrophobicContact CG-CD2 4.48Å; W275-Y337 VanDerWaalsContact CH2-CB 3.48Å; W275-Y337 AromaticContact CH2-CD2 3.84Å; W275-Y337 HydrophobicContact CH2-CD2 3.84Å; W275-Y337 HydrophobicContact CH2-CG 4.16Å; W275-Y337 AromaticContact CZ2-CD2 3.81Å; W275-Y337 HydrophobicContact CZ2-CD2 3.81Å; W275-Y337 HydrophobicContact CZ2-CG 4.34Å; W275-Y337 AromaticContact CZ3-CD2 3.76Å; W275-Y337 HydrophobicContact CZ3-CD2 3.76Å; W275-Y337 HydrophobicContact CZ3-CG 4.31Å; I333-Y337 WeakPolarHBondContact O-CB 3.36Å; I333-Y337 PolarHBondContact O-N 3.43Å; R334-Y337 PolarHBondContact O-N 3.44Å; Y337-V340 PolarHBondContact O-N 2.83Å; Y337-T341 HydrophobicContact CD2-CG2 3.98Å; Y337-T341 HydrophobicContact CE1-CG2 4.5Å; Y337-T341 WeakPolarHBondContact CE1-OG1 3.19Å; Y337-T341 HydrophobicContact CE2-CG2 3.69Å; Y337-T341 WeakPolarHBondContact O-CB 3.49Å; Y337-T341 WeakPolarHBondContact O-CG2 3.32Å; Y337-T341 PolarHBondContact O-N 3.3Å; Y337-T341 PolarHBondContact O-OG1 2.84Å
338L91.6Very high91.8Very high8 Ų839.9 Ų39.94%0.04219%0.191CC..Hα-helixtrans-62.9-45.6180-73175.3000111.6L19 I20 R334 Q335 Y336 V340 T341 D342 I345L19-L338 HydrophobicContact CD2-CD1 3.94Å; L19-L338 HydrophobicContact CD2-CD2 3.8Å; L19-L338 HydrophobicContact CD2-CG 4.47Å; L19-L338 HydrophobicContact CG-CD1 3.81Å; L19-L338 HydrophobicContact CG-CD2 4.48Å; I20-L338 HydrophobicContact CD1-CB 4.15Å; I20-L338 HydrophobicContact CD1-CD1 4.41Å; I20-L338 HydrophobicContact CG1-CB 4.4Å; I20-L338 HydrophobicContact CG1-CD1 3.76Å; R334-L338 WeakPolarHBondContact O-CG 3.48Å; R334-L338 PolarHBondContact O-N 3.28Å; R334-L338 VanDerWaalsContact O-N 3.13Å; Q335-L338 PolarHBondContact O-N 2.91Å; Y336-L338 VanDerWaalsContact C-N 3.32Å; Y336-L338 PolarHBondContact O-N 3.26Å; L338-V340 VanDerWaalsContact C-N 3.29Å; L338-V340 PolarHBondContact O-N 2.79Å; L338-T341 PolarHBondContact O-N 2.94Å; L338-D342 WeakPolarHBondContact O-CB 3.27Å; L338-D342 PolarHBondContact O-N 3.39Å; L338-I345 HydrophobicContact CB-CD1 3.79Å
339Y92.1Very high91.7Very high74 Ų7439.9 Ų39.929%0.2919%0.191SC..Hα-helixtrans-58.8-37.1176177.1-106.2000113.6Q335 Y336 I345 R347 I348Q335-Y339 WeakPolarHBondContact O-CB 3.49Å; Q335-Y339 PolarHBondContact O-N 3.47Å; Y336-Y339 PolarHBondContact O-N 3.37Å; Y339-I345 HydrophobicContact CD2-CG2 4.35Å; Y339-R347 WeakPolarHBondContact CD2-O 3.38Å; Y339-I348 HydrophobicContact CD1-CG2 3.86Å; Y339-I348 HydrophobicContact CD2-CG2 3.82Å; Y339-I348 HydrophobicContact CE1-CG2 3.88Å; Y339-I348 HydrophobicContact CE2-CG2 3.84Å; Y339-I348 HydrophobicContact CG-CG2 3.83Å
340V91.5Very high91.6Very high13 Ų1340.9 Ų40.98%0.07920%0.197CC..Hα-helixtrans-83-31.2-177.6173.70000112.8R284 L287 L288 Y336 Y337 L338R284-V340 HydrophobicContact CG-CG1 3.78Å; L287-V340 HydrophobicContact CB-CG1 4.16Å; L287-V340 HydrophobicContact CB-CG2 3.84Å; L287-V340 HydrophobicContact CD1-CG2 4.13Å; L288-V340 HydrophobicContact CD2-CG1 3.98Å; L288-V340 HydrophobicContact CG-CG1 4.22Å; Y336-V340 HydrophobicContact CD1-CG2 3.88Å; Y336-V340 HydrophobicContact CE1-CG2 3.47Å; Y336-V340 VanDerWaalsContact CE1-CG2 3.47Å; Y336-V340 HydrophobicContact CE2-CG2 4.3Å; Y336-V340 HydrophobicContact CG-CG2 4.43Å; Y336-V340 WeakPolarHBondContact O-CB 3.48Å; Y336-V340 VanDerWaalsContact O-CG2 3.31Å; Y336-V340 WeakPolarHBondContact O-CG2 3.07Å; Y336-V340 PolarHBondContact O-N 3.13Å; Y337-V340 PolarHBondContact O-N 2.83Å; L338-V340 VanDerWaalsContact C-N 3.29Å; L338-V340 PolarHBondContact O-N 2.79Å
341T87.8Confident91.7Very high31 Ų3140.4 Ų40.419%0.1919%0.193CC..Hα-helixtrans-102.7-26.7-170.462.20000114.3R284 Y337 L338R284-T341 VanDerWaalsContact NH2-CG2 3.33Å; Y337-T341 HydrophobicContact CD2-CG2 3.98Å; Y337-T341 HydrophobicContact CE1-CG2 4.5Å; Y337-T341 WeakPolarHBondContact CE1-OG1 3.19Å; Y337-T341 HydrophobicContact CE2-CG2 3.69Å; Y337-T341 WeakPolarHBondContact O-CB 3.49Å; Y337-T341 WeakPolarHBondContact O-CG2 3.32Å; Y337-T341 PolarHBondContact O-N 3.3Å; Y337-T341 PolarHBondContact O-OG1 2.84Å; L338-T341 PolarHBondContact O-N 2.94Å
342D86.8Confident91.8Very high24 Ų2440.8 Ų40.813%0.12819%0.194CC..  trans-99.9114.6-176.4-166.6-32.1000111.2Y15 L338 H344 I345Y15-D342 VanDerWaalsContact CE1-OD2 3.32Å; Y15-D342 WeakPolarHBondContact CE1-OD2 3.35Å; Y15-D342 PolarHBondContact OH-OD2 2.95Å; L338-D342 WeakPolarHBondContact O-CB 3.27Å; L338-D342 PolarHBondContact O-N 3.39Å; D342-H344 PolarHBondContact O-N 3.23Å; D342-H344 WeakPolarHBondContact OD1-CB 3.38Å; D342-H344 IonicContact OD1-CD2 3.76Å; D342-H344 PolarHBondContact OD1-CD2 2.94Å; D342-H344 IonicContact OD1-CG 3.66Å; D342-H344 PolarHBondContact OD1-N 3.43Å; D342-I345 HydrophobicContact CB-CB 4.25Å; D342-I345 HydrophobicContact CB-CD1 3.73Å; D342-I345 HydrophobicContact CB-CG1 3.98Å; D342-I345 PolarHBondContact O-N 3.25Å; D342-I345 VanDerWaalsContact O-N 3.16Å
343P84.7Confident91.9Very high106 Ų10647.9 Ų47.969%0.68822%0.221SC*.THydrogen-bonded Turntrans-67.1-16.9-178.628.8-35.7000114.2I345P343-I345 VanDerWaalsContact C-N 3.32Å
344H85.6Confident92Very high98 Ų9847.6 Ų47.645%0.45422%0.22SC..THydrogen-bonded Turntrans-77.7-21.2176.4-64.2-78.1000112.1D12 Y15 D342 K346D12-H344 IonicContact OD1-ND1 3.35Å; Y15-H344 HydrophobicContact CD1-CB 4.03Å; Y15-H344 HydrophobicContact CE1-CB 4.09Å; D342-H344 PolarHBondContact O-N 3.23Å; D342-H344 WeakPolarHBondContact OD1-CB 3.38Å; D342-H344 IonicContact OD1-CD2 3.76Å; D342-H344 PolarHBondContact OD1-CD2 2.94Å; D342-H344 IonicContact OD1-CG 3.66Å; D342-H344 PolarHBondContact OD1-N 3.43Å; H344-K346 PolarHBondContact O-N 3.48Å
345I87.9Confident92.2Very high6 Ų646.7 Ų46.73%0.03122%0.217CC..  trans-95100.5-174-62.4176.2000109.4Y15 F16 L19 I20 L338 Y339 D342 P343 R347Y15-I345 HydrophobicContact CD1-CG1 4.3Å; Y15-I345 HydrophobicContact CE1-CD1 4.17Å; Y15-I345 HydrophobicContact CE1-CG1 4.1Å; F16-I345 HydrophobicContact CD2-CG2 4.13Å; F16-I345 HydrophobicContact CE2-CG2 4.43Å; L19-I345 HydrophobicContact CD2-CD1 4.14Å; I20-I345 HydrophobicContact CD1-CB 4.48Å; I20-I345 HydrophobicContact CD1-CD1 3.73Å; I20-I345 HydrophobicContact CD1-CG1 4.3Å; I20-I345 HydrophobicContact CD1-CG2 3.43Å; I20-I345 VanDerWaalsContact CD1-CG2 3.43Å; I20-I345 HydrophobicContact CG1-CD1 4.36Å; L338-I345 HydrophobicContact CB-CD1 3.79Å; Y339-I345 HydrophobicContact CD2-CG2 4.35Å; D342-I345 HydrophobicContact CB-CB 4.25Å; D342-I345 HydrophobicContact CB-CD1 3.73Å; D342-I345 HydrophobicContact CB-CG1 3.98Å; D342-I345 PolarHBondContact O-N 3.25Å; D342-I345 VanDerWaalsContact O-N 3.16Å; P343-I345 VanDerWaalsContact C-N 3.32Å; I345-R347 WeakPolarHBondContact CG2-O 3.37Å
346K86.2Confident92.4Very high141 Ų14149.1 Ų49.161%0.61323%0.232SC*.  trans-99.7-8.8-177.5-65.3174.1-176.6160.60113.9H344H344-K346 PolarHBondContact O-N 3.48Å
347R90.4Very high92.5Very high153 Ų15349 Ų4958%0.57723%0.234SC*.SBendtrans-114.7143.8-178-176.7179.8174.3-179.1-0.3110.2F16 Y339 I345F16-R347 HydrophobicContact CD2-CB 4.38Å; F16-R347 HydrophobicContact CE2-CB 3.95Å; F16-R347 HydrophobicContact CE2-CG 4.28Å; F16-R347 VanDerWaalsContact CE2-O 3.28Å; F16-R347 WeakPolarHBondContact CE2-O 3.42Å; F16-R347 HydrophobicContact CZ-CB 4.24Å; F16-R347 HydrophobicContact CZ-CG 4.09Å; Y339-R347 WeakPolarHBondContact CD2-O 3.38Å; I345-R347 WeakPolarHBondContact CG2-O 3.37Å
348I92.8Very high92.8Very high56 Ų5647.7 Ų47.729%0.28723%0.229SC..  trans-77.7141.8170.356.5172.8000110.8Y339 L352 W353Y339-I348 HydrophobicContact CD1-CG2 3.86Å; Y339-I348 HydrophobicContact CD2-CG2 3.82Å; Y339-I348 HydrophobicContact CE1-CG2 3.88Å; Y339-I348 HydrophobicContact CE2-CG2 3.84Å; Y339-I348 HydrophobicContact CG-CG2 3.83Å; I348-L352 HydrophobicContact CB-CD2 3.92Å; I348-L352 HydrophobicContact CG2-CD2 3.93Å; I348-W353 HydrophobicContact CD1-CB 4Å; I348-W353 HydrophobicContact CD1-CG 4.27Å; I348-W353 HydrophobicContact CG1-CB 4.48Å
349G93.8Very high93.1Very high0 Ų047.5 Ų47.50%023%0.228CC..  trans-65.6155.9175.600000113E21 Q335 Q351 L352 W353E21-G349 VanDerWaalsContact OE1-CA 3.27Å; E21-G349 WeakPolarHBondContact OE1-CA 3.48Å; Q335-G349 VanDerWaalsContact OE1-C 3.26Å; G349-Q351 PolarHBondContact O-N 2.94Å; G349-L352 PolarHBondContact O-N 3.42Å; G349-W353 PolarHBondContact O-N 3.39Å
350S95.6Very high93.4Very high30 Ų3048.3 Ų48.321%0.2124%0.237CC..Hα-helixtrans-59.5-44.1-176.4590000112.7E21 F102 W353 L354E21-S350 VanDerWaalsContact CD-OG 3.27Å; E21-S350 WeakPolarHBondContact OE1-CB 3.39Å; E21-S350 PolarHBondContact OE1-N 3.49Å; E21-S350 PolarHBondContact OE1-OG 3.01Å; E21-S350 WeakPolarHBondContact OE2-CB 3.3Å; E21-S350 PolarHBondContact OE2-OG 3.25Å; F102-S350 WeakPolarHBondContact CE2-OG 3.38Å; S350-W353 PolarHBondContact O-N 2.79Å; S350-L354 WeakPolarHBondContact O-CB 3.28Å; S350-L354 PolarHBondContact O-N 2.86Å
351Q96.8Very high93.7Very high6 Ų648.6 Ų48.63%0.02824%0.239CC..Hα-helixtrans-68.9-40.1179.6-172.96839.800111.7F102 S105 P331 A332 G349 L354 F355F102-Q351 VanDerWaalsContact CA-OE1 3.3Å; F102-Q351 HydrophobicContact CD2-CB 4.29Å; S105-Q351 PolarHBondContact OG-NE2 2.83Å; P331-Q351 HydrophobicContact CB-CG 3.98Å; P331-Q351 HydrophobicContact CG-CG 3.68Å; A332-Q351 HydrophobicContact CB-CG 4.47Å; G349-Q351 PolarHBondContact O-N 2.94Å; Q351-L354 PolarHBondContact O-N 3.48Å; Q351-F355 VanDerWaalsContact O-CB 3.29Å; Q351-F355 WeakPolarHBondContact O-CB 3.31Å; Q351-F355 PolarHBondContact O-N 3.31Å
352L97Very high94.2Very high13 Ų1347.2 Ų47.27%0.06823%0.23CC..Hα-helixtrans-62.5-44.6173.3170.763.1000111.6A332 Q335 Y336 I348 G349 L354 F355 T356A332-L352 HydrophobicContact CB-CB 4.4Å; A332-L352 HydrophobicContact CB-CD1 4.41Å; Q335-L352 HydrophobicContact CB-CB 4.04Å; Y336-L352 HydrophobicContact CD2-CD1 3.94Å; Y336-L352 HydrophobicContact CD2-CD2 3.73Å; Y336-L352 HydrophobicContact CD2-CG 4.47Å; Y336-L352 HydrophobicContact CG-CD1 4.47Å; Y336-L352 HydrophobicContact CG-CD2 4.36Å; I348-L352 HydrophobicContact CB-CD2 3.92Å; I348-L352 HydrophobicContact CG2-CD2 3.93Å; G349-L352 PolarHBondContact O-N 3.42Å; L352-L354 VanDerWaalsContact C-N 3.35Å; L352-F355 PolarHBondContact O-N 3.21Å; L352-T356 WeakPolarHBondContact O-CB 3.15Å; L352-T356 PolarHBondContact O-N 3.29Å; L352-T356 PolarHBondContact O-OG1 2.88Å
353W97.3Very high94.7Very high150 Ų15048.4 Ų48.457%0.56824%0.236SC*.Hα-helixtrans-58.4-49.3175.7-176.595.2000110.8I348 G349 S350 F355 T356 A357I348-W353 HydrophobicContact CD1-CB 4Å; I348-W353 HydrophobicContact CD1-CG 4.27Å; I348-W353 HydrophobicContact CG1-CB 4.48Å; G349-W353 PolarHBondContact O-N 3.39Å; S350-W353 PolarHBondContact O-N 2.79Å; W353-F355 PolarHBondContact O-N 3.48Å; W353-T356 WeakPolarHBondContact O-CB 3.39Å; W353-T356 PolarHBondContact O-N 2.63Å; W353-A357 HydrophobicContact CE3-CB 4.5Å; W353-A357 HydrophobicContact CH2-CB 4.42Å; W353-A357 HydrophobicContact CZ3-CB 4.2Å; W353-A357 PolarHBondContact O-N 2.96Å
354L97.8Very high95.3Very high5 Ų548.1 Ų48.13%0.02623%0.228CC..Hα-helixtrans-65.2-40.6-179-177.753.9000112F102 S105 L106 F109 S350 Q351 L352 T356 A357 I358F102-L354 HydrophobicContact CE1-CD2 4.25Å; F102-L354 HydrophobicContact CE2-CD2 4.3Å; F102-L354 HydrophobicContact CZ-CD2 4.05Å; S105-L354 WeakPolarHBondContact OG-CD2 3.19Å; L106-L354 HydrophobicContact CB-CD2 3.94Å; L106-L354 HydrophobicContact CD1-CD1 4.28Å; F109-L354 HydrophobicContact CB-CD1 3.89Å; F109-L354 HydrophobicContact CD1-CD1 4.13Å; F109-L354 HydrophobicContact CG-CD1 3.96Å; S350-L354 WeakPolarHBondContact O-CB 3.28Å; S350-L354 PolarHBondContact O-N 2.86Å; Q351-L354 PolarHBondContact O-N 3.48Å; L352-L354 VanDerWaalsContact C-N 3.35Å; L354-T356 VanDerWaalsContact C-N 3.34Å; L354-T356 PolarHBondContact O-N 3.38Å; L354-A357 WeakPolarHBondContact O-CB 3.38Å; L354-A357 PolarHBondContact O-N 3.25Å; L354-I358 HydrophobicContact CG-CD1 4.35Å; L354-I358 WeakPolarHBondContact O-CG1 3.31Å; L354-I358 PolarHBondContact O-N 3.07Å
355F98Very high95.9Very high22 Ų2243.4 Ų43.410%0.09621%0.207CC..Hα-helixtrans-63.3-41175.2-176.3-140.4000112.1I325 I328 A332 Q351 L352 W353 A357 I358 I359I325-F355 HydrophobicContact CD1-CE2 4.32Å; I325-F355 HydrophobicContact CG2-CE2 4.1Å; I325-F355 HydrophobicContact CG2-CZ 4.31Å; I328-F355 HydrophobicContact CG2-CB 3.76Å; I328-F355 HydrophobicContact CG2-CD2 3.37Å; I328-F355 HydrophobicContact CG2-CE2 4.04Å; I328-F355 HydrophobicContact CG2-CG 3.64Å; A332-F355 HydrophobicContact CB-CB 3.96Å; A332-F355 HydrophobicContact CB-CD1 3.61Å; A332-F355 HydrophobicContact CB-CE1 4.5Å; A332-F355 HydrophobicContact CB-CG 4.14Å; Q351-F355 VanDerWaalsContact O-CB 3.29Å; Q351-F355 WeakPolarHBondContact O-CB 3.31Å; Q351-F355 PolarHBondContact O-N 3.31Å; L352-F355 PolarHBondContact O-N 3.21Å; W353-F355 PolarHBondContact O-N 3.48Å; F355-A357 VanDerWaalsContact C-N 3.33Å; F355-A357 PolarHBondContact O-N 2.99Å; F355-I358 WeakPolarHBondContact O-CB 3.5Å; F355-I358 PolarHBondContact O-N 3.08Å; F355-I359 HydrophobicContact CD1-CD1 4.1Å; F355-I359 HydrophobicContact CD2-CD1 4.1Å; F355-I359 HydrophobicContact CD2-CG1 4.18Å; F355-I359 HydrophobicContact CE1-CD1 3.82Å; F355-I359 HydrophobicContact CE2-CD1 3.8Å; F355-I359 HydrophobicContact CE2-CG1 3.89Å; F355-I359 HydrophobicContact CG-CD1 4.25Å; F355-I359 HydrophobicContact CZ-CD1 3.68Å; F355-I359 HydrophobicContact CZ-CG1 4.22Å; F355-I359 WeakPolarHBondContact O-CG1 3.37Å; F355-I359 PolarHBondContact O-N 2.81Å
356T97.7Very high96.3Very high51 Ų5143.2 Ų43.231%0.31321%0.205SC..Hα-helixtrans-61.3-43.3174-53.60000110.8L352 W353 L354 I358 I359 L360L352-T356 WeakPolarHBondContact O-CB 3.15Å; L352-T356 PolarHBondContact O-N 3.29Å; L352-T356 PolarHBondContact O-OG1 2.88Å; W353-T356 WeakPolarHBondContact O-CB 3.39Å; W353-T356 PolarHBondContact O-N 2.63Å; L354-T356 VanDerWaalsContact C-N 3.34Å; L354-T356 PolarHBondContact O-N 3.38Å; T356-I358 VanDerWaalsContact C-N 3.34Å; T356-I358 PolarHBondContact O-N 3.49Å; T356-I359 PolarHBondContact O-N 3.09Å; T356-L360 HydrophobicContact CG2-CD1 4.13Å; T356-L360 WeakPolarHBondContact O-CG 3.37Å; T356-L360 PolarHBondContact O-N 3.42Å
357A98.2Very high96.7Very high15 Ų1540.7 Ų40.712%0.12420%0.198CC..Hα-helixtrans-62.8-38.8176.500000112.5F109 W353 L354 F355 T361F109-A357 HydrophobicContact CD2-CB 4.09Å; F109-A357 HydrophobicContact CE2-CB 3.64Å; F109-A357 HydrophobicContact CZ-CB 4.12Å; W353-A357 HydrophobicContact CE3-CB 4.5Å; W353-A357 HydrophobicContact CH2-CB 4.42Å; W353-A357 HydrophobicContact CZ3-CB 4.2Å; W353-A357 PolarHBondContact O-N 2.96Å; L354-A357 WeakPolarHBondContact O-CB 3.38Å; L354-A357 PolarHBondContact O-N 3.25Å; F355-A357 VanDerWaalsContact C-N 3.33Å; F355-A357 PolarHBondContact O-N 2.99Å; A357-T361 VanDerWaalsContact O-CB 3.27Å; A357-T361 WeakPolarHBondContact O-CB 3.22Å; A357-T361 PolarHBondContact O-N 3.26Å; A357-T361 PolarHBondContact O-OG1 2.85Å
358I98.6Very high97Very high0 Ų037.8 Ų37.80%019%0.19CC..Hα-helixtrans-60-54.7172.9-71.1164.1000110.3S105 Y108 F109 L112 I325 I328 L354 F355 T356 L360 T361 E362S105-I358 WeakPolarHBondContact O-CD1 3.48Å; Y108-I358 HydrophobicContact CD1-CD1 4.28Å; Y108-I358 HydrophobicContact CD1-CG1 4.38Å; Y108-I358 HydrophobicContact CD1-CG2 3.86Å; Y108-I358 HydrophobicContact CE1-CG2 3.66Å; F109-I358 HydrophobicContact CB-CD1 4.44Å; F109-I358 HydrophobicContact CB-CG1 3.81Å; F109-I358 HydrophobicContact CD2-CG1 4.15Å; F109-I358 HydrophobicContact CG-CG1 4.41Å; L112-I358 HydrophobicContact CD1-CG2 4.01Å; I325-I358 HydrophobicContact CD1-CG2 4.17Å; I328-I358 HydrophobicContact CD1-CD1 4.18Å; L354-I358 HydrophobicContact CG-CD1 4.35Å; L354-I358 WeakPolarHBondContact O-CG1 3.31Å; L354-I358 PolarHBondContact O-N 3.07Å; F355-I358 WeakPolarHBondContact O-CB 3.5Å; F355-I358 PolarHBondContact O-N 3.08Å; T356-I358 VanDerWaalsContact C-N 3.34Å; T356-I358 PolarHBondContact O-N 3.49Å; I358-L360 VanDerWaalsContact C-N 3.31Å; I358-L360 PolarHBondContact O-N 2.97Å; I358-T361 PolarHBondContact O-N 3.3Å; I358-T361 VanDerWaalsContact O-N 3.1Å; I358-E362 HydrophobicContact CG2-CG 4.22Å; I358-E362 WeakPolarHBondContact O-CB 3.09Å; I358-E362 WeakPolarHBondContact O-CG 3.2Å; I358-E362 PolarHBondContact O-N 3.08Å
359I98.4Very high97.1Very high3 Ų335.7 Ų35.72%0.01518%0.179CC..Hα-helixtrans-57.4-44.8-178-65.7163.6000111.2V294 L297 A298 N301 F355 T356 T361 E362 L363V294-I359 HydrophobicContact CG1-CD1 3.72Å; L297-I359 HydrophobicContact CB-CG2 4.45Å; L297-I359 HydrophobicContact CD2-CG2 3.83Å; L297-I359 HydrophobicContact CG-CG2 3.9Å; A298-I359 HydrophobicContact CB-CD1 3.77Å; A298-I359 HydrophobicContact CB-CG1 3.84Å; A298-I359 HydrophobicContact CB-CG2 4.41Å; N301-I359 PolarHBondContact ND2-O 3.26Å; F355-I359 HydrophobicContact CD1-CD1 4.1Å; F355-I359 HydrophobicContact CD2-CD1 4.1Å; F355-I359 HydrophobicContact CD2-CG1 4.18Å; F355-I359 HydrophobicContact CE1-CD1 3.82Å; F355-I359 HydrophobicContact CE2-CD1 3.8Å; F355-I359 HydrophobicContact CE2-CG1 3.89Å; F355-I359 HydrophobicContact CG-CD1 4.25Å; F355-I359 HydrophobicContact CZ-CD1 3.68Å; F355-I359 HydrophobicContact CZ-CG1 4.22Å; F355-I359 WeakPolarHBondContact O-CG1 3.37Å; F355-I359 PolarHBondContact O-N 2.81Å; T356-I359 PolarHBondContact O-N 3.09Å; I359-T361 VanDerWaalsContact C-N 3.35Å; I359-E362 PolarHBondContact O-N 2.98Å; I359-L363 PolarHBondContact O-N 2.75Å
360L98.1Very high97.1Very high92 Ų9235.8 Ų35.848%0.48218%0.18SC..Hα-helixtrans-66.8-37.2179.2-67.8176000112.3T356 I358 L363 L364T356-L360 HydrophobicContact CG2-CD1 4.13Å; T356-L360 WeakPolarHBondContact O-CG 3.37Å; T356-L360 PolarHBondContact O-N 3.42Å; I358-L360 VanDerWaalsContact C-N 3.31Å; I358-L360 PolarHBondContact O-N 2.97Å; L360-L363 WeakPolarHBondContact O-CB 3.48Å; L360-L363 PolarHBondContact O-N 3.05Å; L360-L364 WeakPolarHBondContact O-CG 3.49Å; L360-L364 PolarHBondContact O-N 2.98Å
361T98.3Very high96.9Very high18 Ų1837 Ų3711%0.1119%0.189CC..Hα-helixtrans-74.3-37.2179.1-53.60000111.2F109 L112 V113 V116 A357 I358 I359 L363 L364 V365F109-T361 WeakPolarHBondContact CE2-OG1 2.91Å; L112-T361 HydrophobicContact CB-CG2 3.76Å; V113-T361 HydrophobicContact CG2-CG2 4.49Å; V116-T361 HydrophobicContact CG2-CG2 3.89Å; A357-T361 VanDerWaalsContact O-CB 3.27Å; A357-T361 WeakPolarHBondContact O-CB 3.22Å; A357-T361 PolarHBondContact O-N 3.26Å; A357-T361 PolarHBondContact O-OG1 2.85Å; I358-T361 PolarHBondContact O-N 3.3Å; I358-T361 VanDerWaalsContact O-N 3.1Å; I359-T361 VanDerWaalsContact C-N 3.35Å; T361-L363 VanDerWaalsContact C-N 3.31Å; T361-L363 PolarHBondContact O-N 3.46Å; T361-L364 WeakPolarHBondContact O-CB 3.37Å; T361-L364 PolarHBondContact O-N 3.18Å; T361-V365 WeakPolarHBondContact O-CG2 3.36Å; T361-V365 PolarHBondContact O-N 3.26Å
362E98.1Very high96.5Very high2 Ų243.3 Ų43.31%0.00922%0.218CC..Hα-helixtrans-59.1-43.2170-74.1-173.7159.400111.5Y108 L112 N301 L305 R321 I358 I359 L364 V365 C366Y108-E362 WeakPolarHBondContact CE1-OE1 3.49Å; Y108-E362 PolarHBondContact OH-OE1 3.45Å; L112-E362 HydrophobicContact CD1-CG 3.54Å; L112-E362 HydrophobicContact CD2-CG 4.13Å; N301-E362 HydrophobicContact CB-CB 4.14Å; N301-E362 WeakPolarHBondContact ND2-CB 3.36Å; L305-E362 HydrophobicContact CD1-CB 4.14Å; L305-E362 HydrophobicContact CD1-CG 3.87Å; R321-E362 IonicContact CZ-OE1 3.34Å; R321-E362 VanDerWaalsContact CZ-OE1 3.27Å; R321-E362 IonicContact NE-OE1 2.68Å; R321-E362 PolarHBondContact NE-OE1 2.92Å; R321-E362 VanDerWaalsContact NE-OE1 3.1Å; R321-E362 IonicContact NH2-OE1 2.75Å; R321-E362 PolarHBondContact NH2-OE1 3.23Å; R321-E362 IonicContact NH2-OE2 3.41Å; R321-E362 PolarHBondContact NH2-OE2 2.76Å; I358-E362 HydrophobicContact CG2-CG 4.22Å; I358-E362 WeakPolarHBondContact O-CB 3.09Å; I358-E362 WeakPolarHBondContact O-CG 3.2Å; I358-E362 PolarHBondContact O-N 3.08Å; I359-E362 PolarHBondContact O-N 2.98Å; E362-L364 VanDerWaalsContact C-N 3.33Å; E362-L364 PolarHBondContact O-N 3.24Å; E362-V365 PolarHBondContact O-N 2.91Å; E362-C366 PolarHBondContact O-N 3.42Å; E362-C366 PolarHBondContact O-SG 3.45Å
363L97.3Very high96.1Very high49 Ų4944.2 Ų44.226%0.25722%0.223SC..Hα-helixtrans-59.6-45.3174.717661.7000110.8L297 N301 I359 L360 T361 V365 C366 L367L297-L363 HydrophobicContact CD1-CD1 4.11Å; L297-L363 HydrophobicContact CD1-CD2 4.22Å; L297-L363 HydrophobicContact CD2-CD2 4.19Å; N301-L363 PolarHBondContact ND2-N 3.25Å; I359-L363 PolarHBondContact O-N 2.75Å; L360-L363 WeakPolarHBondContact O-CB 3.48Å; L360-L363 PolarHBondContact O-N 3.05Å; T361-L363 VanDerWaalsContact C-N 3.31Å; T361-L363 PolarHBondContact O-N 3.46Å; L363-V365 PolarHBondContact O-N 3.06Å; L363-C366 PolarHBondContact O-N 3.21Å; L363-L367 HydrophobicContact CD1-CD1 3.96Å; L363-L367 HydrophobicContact CD1-CD2 4.46Å; L363-L367 HydrophobicContact CD1-CG 3.96Å; L363-L367 HydrophobicContact CG-CD1 3.95Å; L363-L367 HydrophobicContact CG-CG 4.35Å; L363-L367 WeakPolarHBondContact O-CG 3.42Å; L363-L367 PolarHBondContact O-N 3.47Å
364L97.4Very high95.7Very high100 Ų10039.1 Ų39.152%0.52421%0.205SC..Hα-helixtrans-60.5-43.1175.8-71.6172.6000112.4L360 T361 E362 C366 L367 K368L360-L364 WeakPolarHBondContact O-CG 3.49Å; L360-L364 PolarHBondContact O-N 2.98Å; T361-L364 WeakPolarHBondContact O-CB 3.37Å; T361-L364 PolarHBondContact O-N 3.18Å; E362-L364 VanDerWaalsContact C-N 3.33Å; E362-L364 PolarHBondContact O-N 3.24Å; L364-C366 VanDerWaalsContact C-N 3.33Å; L364-L367 PolarHBondContact O-N 3.41Å; L364-K368 VanDerWaalsContact O-CB 3.27Å; L364-K368 WeakPolarHBondContact O-CB 3.27Å; L364-K368 PolarHBondContact O-N 3.41Å
365V97.7Very high95.2Very high0 Ų046.2 Ų46.20%024%0.238CC..Hα-helixtrans-59.8-46174.61720000110.3L112 V115 V116 L305 F309 T361 E362 L363 L369L112-V365 HydrophobicContact CD2-CG2 4.29Å; V115-V365 HydrophobicContact CG1-CG1 3.88Å; V115-V365 HydrophobicContact CG1-CG2 4.17Å; V116-V365 HydrophobicContact CG2-CG2 3.39Å; L305-V365 HydrophobicContact CD2-CB 4.38Å; L305-V365 HydrophobicContact CD2-CG1 3.83Å; F309-V365 HydrophobicContact CE2-CG1 4.12Å; F309-V365 HydrophobicContact CZ-CG1 3.9Å; T361-V365 WeakPolarHBondContact O-CG2 3.36Å; T361-V365 PolarHBondContact O-N 3.26Å; E362-V365 PolarHBondContact O-N 2.91Å; L363-V365 PolarHBondContact O-N 3.06Å; V365-L369 HydrophobicContact CG1-CD1 3.9Å; V365-L369 HydrophobicContact CG1-CG 4.36Å; V365-L369 WeakPolarHBondContact O-CB 3.22Å; V365-L369 PolarHBondContact O-N 2.96Å
366C96.8Very high94.7Very high1 Ų150.9 Ų50.91%0.00726%0.263CS..Hα-helixtrans-60.7-53.1178.9-660000111F304 I308 E362 L363 L364 K368 G370 F374F304-C366 HydrophobicContact CB-CB 4.26Å; I308-C366 HydrophobicContact CD1-CB 3.96Å; E362-C366 PolarHBondContact O-N 3.42Å; E362-C366 PolarHBondContact O-SG 3.45Å; L363-C366 PolarHBondContact O-N 3.21Å; L364-C366 VanDerWaalsContact C-N 3.33Å; C366-K368 VanDerWaalsContact C-N 3.34Å; C366-K368 PolarHBondContact O-N 3.03Å; C366-G370 VanDerWaalsContact O-CA 3.24Å; C366-G370 WeakPolarHBondContact O-CA 3.4Å; C366-G370 PolarHBondContact O-N 2.88Å; C366-F374 HydrophobicContact CB-CE2 4.43Å; C366-F374 WeakPolarHBondContact O-CE2 3.22Å
367L94.8Very high94.2Very high89 Ų8950 Ų5047%0.46626%0.258SS..Hα-helixtrans-62.4-39.2-177.9-67.6174.6000112.6L363 L364 F374L363-L367 HydrophobicContact CD1-CD1 3.96Å; L363-L367 HydrophobicContact CD1-CD2 4.46Å; L363-L367 HydrophobicContact CD1-CG 3.96Å; L363-L367 HydrophobicContact CG-CD1 3.95Å; L363-L367 HydrophobicContact CG-CG 4.35Å; L363-L367 WeakPolarHBondContact O-CG 3.42Å; L363-L367 PolarHBondContact O-N 3.47Å; L364-L367 PolarHBondContact O-N 3.41Å; L367-F374 HydrophobicContact CD2-CD2 4.36Å; L367-F374 HydrophobicContact CD2-CE2 4.23Å; L367-F374 HydrophobicContact CD2-CZ 4.39Å
368K96Very high93.8Very high92 Ų9252.4 Ų52.440%0.427%0.271SS..Hα-helixtrans-75-53.7-179.6-173.9-163.2175.1-145.90112.1V116 L118 L364 C366V116-K368 WeakPolarHBondContact O-CD 3.33Å; V116-K368 WeakPolarHBondContact O-CE 3.27Å; V116-K368 PolarHBondContact O-NZ 2.88Å; L118-K368 PolarHBondContact O-NZ 2.87Å; L364-K368 VanDerWaalsContact O-CB 3.27Å; L364-K368 WeakPolarHBondContact O-CB 3.27Å; L364-K368 PolarHBondContact O-N 3.41Å; C366-K368 VanDerWaalsContact C-N 3.34Å; C366-K368 PolarHBondContact O-N 3.03Å
369L96.2Very high93.4Very high12 Ų1258.8 Ų58.86%0.06330%0.299CS..Hα-helixtrans-84-18.3-172.4-59.9-171.9000112.9V115 L118 L120 A123 I308 F309 V365V115-L369 HydrophobicContact CG1-CD1 3.79Å; L118-L369 WeakPolarHBondContact O-CD2 3.36Å; L120-L369 HydrophobicContact CD1-CB 4.28Å; A123-L369 HydrophobicContact CB-CD1 4.26Å; I308-L369 HydrophobicContact CG2-CB 4.03Å; F309-L369 HydrophobicContact CE1-CD1 3.85Å; F309-L369 HydrophobicContact CZ-CD1 3.74Å; V365-L369 HydrophobicContact CG1-CD1 3.9Å; V365-L369 HydrophobicContact CG1-CG 4.36Å; V365-L369 WeakPolarHBondContact O-CB 3.22Å; V365-L369 PolarHBondContact O-N 2.96Å
370G93.4Very high93.1Very high1 Ų166.3 Ų66.31%0.0133%0.327CS..THydrogen-bonded Turntrans-98.418.6173.700000113.6C366 E372 I373 F374C366-G370 VanDerWaalsContact O-CA 3.24Å; C366-G370 WeakPolarHBondContact O-CA 3.4Å; C366-G370 PolarHBondContact O-N 2.88Å; G370-E372 VanDerWaalsContact C-N 3.3Å; G370-E372 PolarHBondContact O-N 2.87Å; G370-I373 WeakPolarHBondContact O-CA 3.29Å; G370-I373 WeakPolarHBondContact O-CB 3.44Å; G370-I373 PolarHBondContact O-N 3.44Å; G370-F374 WeakPolarHBondContact O-CD2 2.97Å; G370-F374 PolarHBondContact O-N 3.01Å
371S90.9Very high92.9Very high57 Ų5764.6 Ų64.640%0.39932%0.319SS..Hα-helixtrans-53.3-44.8-174.6600000112.9I373 F374 E375S371-I373 PolarHBondContact O-N 3.44Å; S371-F374 PolarHBondContact O-N 2.87Å; S371-F374 VanDerWaalsContact O-N 3.15Å; S371-E375 WeakPolarHBondContact O-CG 3.17Å; S371-E375 PolarHBondContact O-N 3.29Å
372E89.3Confident92.6Very high138 Ų13866.8 Ų66.865%0.64533%0.33SS*.Hα-helixtrans-60-31.4177.4-62.7179.3-179.600112.8G370 N376G370-E372 VanDerWaalsContact C-N 3.3Å; G370-E372 PolarHBondContact O-N 2.87Å; E372-N376 PolarHBondContact O-ND2 3.35Å
373I88.3Confident92.4Very high32 Ų3269.3 Ų69.316%0.16434%0.342CS..Hα-helixtrans-77.1-43.6178.8-59.4179.8000109.5I204 I308 G370 S371 E375 N376I204-I373 HydrophobicContact CG2-CG2 3.26Å; I308-I373 HydrophobicContact CG1-CD1 3.94Å; G370-I373 WeakPolarHBondContact O-CA 3.29Å; G370-I373 WeakPolarHBondContact O-CB 3.44Å; G370-I373 PolarHBondContact O-N 3.44Å; S371-I373 PolarHBondContact O-N 3.44Å; I373-E375 VanDerWaalsContact C-N 3.27Å; I373-E375 PolarHBondContact O-N 3.45Å; I373-N376 PolarHBondContact O-N 2.9Å
374F88.9Confident92.2Very high43 Ų4374 Ų7419%0.18936%0.358CS..Hα-helixtrans-70.5-19.6178.6-71.1-65.6000113.5F304 C366 L367 G370 S371 N376 T377F304-F374 HydrophobicContact CD1-CE1 4.3Å; F304-F374 AromaticContact CD1-CZ 3.76Å; F304-F374 HydrophobicContact CD1-CZ 3.76Å; F304-F374 HydrophobicContact CD2-CZ 4.34Å; F304-F374 AromaticContact CE1-CE1 3.65Å; F304-F374 HydrophobicContact CE1-CE1 3.65Å; F304-F374 AromaticContact CE1-CZ 3.59Å; F304-F374 HydrophobicContact CE1-CZ 3.59Å; F304-F374 HydrophobicContact CE2-CE1 4.2Å; F304-F374 HydrophobicContact CE2-CZ 4.18Å; F304-F374 HydrophobicContact CG-CZ 4.15Å; F304-F374 AromaticContact CZ-CE1 3.6Å; F304-F374 HydrophobicContact CZ-CE1 3.6Å; F304-F374 AromaticContact CZ-CZ 3.82Å; F304-F374 HydrophobicContact CZ-CZ 3.82Å; C366-F374 HydrophobicContact CB-CE2 4.43Å; C366-F374 WeakPolarHBondContact O-CE2 3.22Å; L367-F374 HydrophobicContact CD2-CD2 4.36Å; L367-F374 HydrophobicContact CD2-CE2 4.23Å; L367-F374 HydrophobicContact CD2-CZ 4.39Å; G370-F374 WeakPolarHBondContact O-CD2 2.97Å; G370-F374 PolarHBondContact O-N 3.01Å; S371-F374 PolarHBondContact O-N 2.87Å; S371-F374 VanDerWaalsContact O-N 3.15Å; F374-N376 PolarHBondContact O-N 2.96Å; F374-T377 WeakPolarHBondContact CA-OG1 3.4Å; F374-T377 WeakPolarHBondContact O-CB 3.36Å; F374-T377 PolarHBondContact O-N 2.81Å; F374-T377 PolarHBondContact O-OG1 3.23Å
375E87.9Confident92.2Very high154 Ų15471.2 Ų71.272%0.7234%0.341SS*.THydrogen-bonded Turntrans-59.6-29.3170-77.9172.7-161.200112.6S371 I373 T377S371-E375 WeakPolarHBondContact O-CG 3.17Å; S371-E375 PolarHBondContact O-N 3.29Å; I373-E375 VanDerWaalsContact C-N 3.27Å; I373-E375 PolarHBondContact O-N 3.45Å; E375-T377 VanDerWaalsContact C-N 3.25Å; E375-T377 PolarHBondContact O-N 3.33Å
376N86.3Confident92Very high119 Ų11972.5 Ų72.564%0.63635%0.353SS*.THydrogen-bonded Turntrans-85.47.4176.9-60.8-59.5000113.3E372 I373 F374 V378E372-N376 PolarHBondContact O-ND2 3.35Å; I373-N376 PolarHBondContact O-N 2.9Å; F374-N376 PolarHBondContact O-N 2.96Å; N376-V378 PolarHBondContact O-N 2.89Å
377T87.4Confident92Very high34 Ų3477.7 Ų77.721%0.20938%0.38CS..  trans-68.6125.9-177.4-55.40000111.2I204 F374 E375 F379 L382I204-T377 HydrophobicContact CD1-CG2 3.95Å; I204-T377 WeakPolarHBondContact CD1-OG1 3.06Å; F374-T377 WeakPolarHBondContact CA-OG1 3.4Å; F374-T377 WeakPolarHBondContact O-CB 3.36Å; F374-T377 PolarHBondContact O-N 2.81Å; F374-T377 PolarHBondContact O-OG1 3.23Å; E375-T377 VanDerWaalsContact C-N 3.25Å; E375-T377 PolarHBondContact O-N 3.33Å; T377-F379 PolarHBondContact O-N 3.44Å; T377-L382 HydrophobicContact CG2-CB 4.4Å
378V90.6Very high92.1Very high65 Ų6578.2 Ų78.239%0.39438%0.376SS..  trans-72.795.6165.8-179.80000107.9H203 N376 W380 N381 L382H203-V378 PolarHBondContact CD2-N 3.35Å; H203-V378 PolarHBondContact NE2-N 3.42Å; N376-V378 PolarHBondContact O-N 2.89Å; V378-W380 PolarHBondContact O-N 3.46Å; V378-W380 VanDerWaalsContact O-N 3.08Å; V378-N381 HydrophobicContact CB-CB 4.33Å; V378-N381 HydrophobicContact CG1-CB 4.35Å; V378-N381 WeakPolarHBondContact O-CB 3.43Å; V378-N381 PolarHBondContact O-N 3.39Å; V378-L382 PolarHBondContact O-N 2.96Å
379F89.6Confident92.1Very high134 Ų13474.1 Ų74.159%0.58836%0.358SS*.Hα-helixtrans-51.5-36.7-173.4-176.1-109.9000113.8T377 N381 L382 I383T377-F379 PolarHBondContact O-N 3.44Å; F379-N381 PolarHBondContact O-N 3.32Å; F379-L382 WeakPolarHBondContact O-CB 3.44Å; F379-L382 PolarHBondContact O-N 2.95Å; F379-I383 HydrophobicContact CD1-CD1 3.68Å; F379-I383 HydrophobicContact CD1-CG1 4.43Å; F379-I383 HydrophobicContact CE1-CD1 3.22Å; F379-I383 HydrophobicContact CE1-CG1 4.11Å; F379-I383 HydrophobicContact CZ-CD1 3.73Å; F379-I383 HydrophobicContact CZ-CG1 4.24Å; F379-I383 PolarHBondContact O-N 3.46Å; F379-I383 VanDerWaalsContact O-N 3.1Å
380W92.4Very high92Very high160 Ų16076.8 Ų76.861%0.60638%0.375SS*.Hα-helixtrans-64.6-38177.1-71.5114.8000113.3V378 L382 I383 Y384V378-W380 PolarHBondContact O-N 3.46Å; V378-W380 VanDerWaalsContact O-N 3.08Å; W380-L382 VanDerWaalsContact C-N 3.29Å; W380-L382 PolarHBondContact O-N 3.32Å; W380-I383 HydrophobicContact CE3-CD1 4.09Å; W380-I383 HydrophobicContact CZ3-CD1 4.13Å; W380-I383 PolarHBondContact O-N 2.91Å; W380-Y384 HydrophobicContact CB-CD2 4.36Å; W380-Y384 HydrophobicContact CB-CE2 3.97Å; W380-Y384 WeakPolarHBondContact O-CD2 3.49Å; W380-Y384 PolarHBondContact O-N 2.96Å
381N93Very high92.1Very high56 Ų5682.3 Ų82.330%0.29940%0.399SS..Hα-helixtrans-62.6-40.3176.8-68.80000110.7V378 F379 Y384 W385V378-N381 HydrophobicContact CB-CB 4.33Å; V378-N381 HydrophobicContact CG1-CB 4.35Å; V378-N381 WeakPolarHBondContact O-CB 3.43Å; V378-N381 PolarHBondContact O-N 3.39Å; F379-N381 PolarHBondContact O-N 3.32Å; N381-Y384 PolarHBondContact O-N 3.09Å; N381-W385 WeakPolarHBondContact O-CB 3.37Å; N381-W385 PolarHBondContact O-N 2.58Å
382L91.9Very high92.4Very high65 Ų6580 Ų8034%0.3438%0.382SS..Hα-helixtrans-63.9-42.2176.2-178.665.9000112F201 T377 V378 F379 W380 W385 G386F201-L382 HydrophobicContact CE1-CD1 4.13Å; F201-L382 HydrophobicContact CZ-CD1 3.65Å; T377-L382 HydrophobicContact CG2-CB 4.4Å; V378-L382 PolarHBondContact O-N 2.96Å; F379-L382 WeakPolarHBondContact O-CB 3.44Å; F379-L382 PolarHBondContact O-N 2.95Å; W380-L382 VanDerWaalsContact C-N 3.29Å; W380-L382 PolarHBondContact O-N 3.32Å; L382-W385 HydrophobicContact CD1-CE3 3.76Å; L382-W385 HydrophobicContact CD1-CZ3 3.98Å; L382-G386 PolarHBondContact O-N 2.72Å
383I93.9Very high92.5Very high54 Ų5473.4 Ų73.428%0.27735%0.352SS..Hα-helixtrans-62.8-50.6175.9-71.5175.1000110.7F379 W380 W385 G386 I387F379-I383 HydrophobicContact CD1-CD1 3.68Å; F379-I383 HydrophobicContact CD1-CG1 4.43Å; F379-I383 HydrophobicContact CE1-CD1 3.22Å; F379-I383 HydrophobicContact CE1-CG1 4.11Å; F379-I383 HydrophobicContact CZ-CD1 3.73Å; F379-I383 HydrophobicContact CZ-CG1 4.24Å; F379-I383 PolarHBondContact O-N 3.46Å; F379-I383 VanDerWaalsContact O-N 3.1Å; W380-I383 HydrophobicContact CE3-CD1 4.09Å; W380-I383 HydrophobicContact CZ3-CD1 4.13Å; W380-I383 PolarHBondContact O-N 2.91Å; I383-W385 VanDerWaalsContact C-N 3.3Å; I383-W385 PolarHBondContact O-N 3.34Å; I383-G386 PolarHBondContact O-N 3Å; I383-I387 HydrophobicContact CG2-CD1 3.67Å; I383-I387 HydrophobicContact CG2-CG1 4.33Å; I383-I387 WeakPolarHBondContact O-CG1 3.41Å; I383-I387 PolarHBondContact O-N 3.35Å
384Y94.5Very high92.7Very high148 Ų14875.1 Ų75.158%0.5836%0.358SS*.Hα-helixtrans-60.9-42.5-179.4-67.1-48.7000111.5W380 N381 W388W380-Y384 HydrophobicContact CB-CD2 4.36Å; W380-Y384 HydrophobicContact CB-CE2 3.97Å; W380-Y384 WeakPolarHBondContact O-CD2 3.49Å; W380-Y384 PolarHBondContact O-N 2.96Å; N381-Y384 PolarHBondContact O-N 3.09Å; Y384-W388 VanDerWaalsContact O-CB 3.29Å; Y384-W388 WeakPolarHBondContact O-CB 3.45Å; Y384-W388 PolarHBondContact O-N 3.18Å
385W95.7Very high92.9Very high42 Ų4276.6 Ų76.616%0.15937%0.367CS..Hα-helixtrans-58.7-49.9172.917282.9000111.8T197 A200 F201 L300 N381 L382 I383 I387 W388 M389T197-W385 HydrophobicContact CG2-CZ2 4.37Å; T197-W385 PolarHBondContact OG1-NE1 3.23Å; A200-W385 HydrophobicContact CB-CB 3.77Å; A200-W385 HydrophobicContact CB-CG 4.03Å; F201-W385 AromaticContact CE2-CD2 3.77Å; F201-W385 HydrophobicContact CE2-CD2 3.77Å; F201-W385 AromaticContact CE2-CE2 3.74Å; F201-W385 HydrophobicContact CE2-CE3 4.15Å; F201-W385 HydrophobicContact CE2-CG 4.11Å; F201-W385 HydrophobicContact CE2-CH2 4.45Å; F201-W385 HydrophobicContact CE2-CZ2 4.11Å; F201-W385 HydrophobicContact CE2-CZ3 4.46Å; F201-W385 HydrophobicContact CZ-CD2 4.29Å; F201-W385 HydrophobicContact CZ-CE3 4.2Å; F201-W385 HydrophobicContact CZ-CZ3 4.34Å; L300-W385 HydrophobicContact CD2-CH2 4.1Å; L300-W385 HydrophobicContact CD2-CZ2 3.97Å; N381-W385 WeakPolarHBondContact O-CB 3.37Å; N381-W385 PolarHBondContact O-N 2.58Å; L382-W385 HydrophobicContact CD1-CE3 3.76Å; L382-W385 HydrophobicContact CD1-CZ3 3.98Å; I383-W385 VanDerWaalsContact C-N 3.3Å; I383-W385 PolarHBondContact O-N 3.34Å; W385-I387 PolarHBondContact O-N 2.82Å; W385-W388 PolarHBondContact O-N 3.01Å; W385-M389 VanDerWaalsContact CD1-CE 3.49Å; W385-M389 HydrophobicContact CD2-CG 4.16Å; W385-M389 HydrophobicContact CG-CG 4.37Å; W385-M389 HydrophobicContact CZ2-CG 4.17Å; W385-M389 VanDerWaalsContact NE1-CE 3.27Å; W385-M389 WeakPolarHBondContact O-CB 3.47Å; W385-M389 VanDerWaalsContact O-CG 3.26Å; W385-M389 WeakPolarHBondContact O-CG 3.27Å; W385-M389 PolarHBondContact O-N 2.98Å
386G95Very high93Very high26 Ų2669.7 Ų69.727%0.26834%0.336SS..Hα-helixtrans-60.8-45.2-179.900000112.9L382 I383 M389 V390L382-G386 PolarHBondContact O-N 2.72Å; I383-G386 PolarHBondContact O-N 3Å; G386-M389 PolarHBondContact O-N 2.78Å; G386-V390 WeakPolarHBondContact O-CG2 3.48Å; G386-V390 PolarHBondContact O-N 2.86Å; G386-V390 VanDerWaalsContact O-N 3.12Å
387I96.3Very high93.1Very high110 Ų11064.2 Ų64.256%0.56431%0.307SS*.Hα-helixtrans-61.4-46.7175.5-67.7171.5000110.3I383 W385 M389 V390 F391I383-I387 HydrophobicContact CG2-CD1 3.67Å; I383-I387 HydrophobicContact CG2-CG1 4.33Å; I383-I387 WeakPolarHBondContact O-CG1 3.41Å; I383-I387 PolarHBondContact O-N 3.35Å; W385-I387 PolarHBondContact O-N 2.82Å; I387-M389 PolarHBondContact O-N 2.69Å; I387-V390 PolarHBondContact O-N 2.84Å; I387-F391 VanDerWaalsContact O-CB 3.28Å; I387-F391 WeakPolarHBondContact O-CB 3.37Å; I387-F391 PolarHBondContact O-N 3.35Å
388W96.8Very high93Very high100 Ų10069.1 Ų69.138%0.37932%0.322SS..Hα-helixtrans-60.2-46178.1174.9-94.5000111.8N193 I196 Y384 W385 V390 F391 S392N193-W388 PolarHBondContact OD1-NE1 3.17Å; I196-W388 HydrophobicContact CD1-CD2 4.38Å; I196-W388 VanDerWaalsContact CD1-CE2 3.44Å; I196-W388 HydrophobicContact CD1-CZ2 3.59Å; I196-W388 HydrophobicContact CG2-CG 4.33Å; Y384-W388 VanDerWaalsContact O-CB 3.29Å; Y384-W388 WeakPolarHBondContact O-CB 3.45Å; Y384-W388 PolarHBondContact O-N 3.18Å; W385-W388 PolarHBondContact O-N 3.01Å; W388-V390 VanDerWaalsContact C-N 3.34Å; W388-V390 PolarHBondContact O-N 3.48Å; W388-F391 HydrophobicContact CE3-CD1 4.39Å; W388-F391 HydrophobicContact CZ3-CD1 4.38Å; W388-F391 PolarHBondContact O-N 2.94Å; W388-S392 VanDerWaalsContact O-CB 3.31Å; W388-S392 WeakPolarHBondContact O-CB 3.29Å; W388-S392 PolarHBondContact O-N 3.06Å; W388-S392 PolarHBondContact O-OG 3.19Å; W388-S392 VanDerWaalsContact O-OG 3.04Å
389M95.7Very high92.9Very high6 Ų669.7 Ų69.73%0.0332%0.322CS..Hα-helixtrans-61.1-42.6-179.6-70.9-56.315000112.1N193 I196 T197 L293 Q296 W385 G386 I387 S392 S393N193-M389 HydrophobicContact CB-CE 3.83Å; N193-M389 HydrophobicContact CB-SD 3.76Å; N193-M389 WeakPolarHBondContact O-CE 3.38Å; I196-M389 HydrophobicContact CB-CE 4.44Å; I196-M389 HydrophobicContact CG2-CE 4.27Å; T197-M389 VanDerWaalsContact OG1-CE 3.31Å; T197-M389 WeakPolarHBondContact OG1-CE 3.42Å; L293-M389 HydrophobicContact CD2-CB 3.64Å; L293-M389 WeakPolarHBondContact CD2-O 3.33Å; Q296-M389 HydrophobicContact CG-SD 4.12Å; W385-M389 VanDerWaalsContact CD1-CE 3.49Å; W385-M389 HydrophobicContact CD2-CG 4.16Å; W385-M389 HydrophobicContact CG-CG 4.37Å; W385-M389 HydrophobicContact CZ2-CG 4.17Å; W385-M389 VanDerWaalsContact NE1-CE 3.27Å; W385-M389 WeakPolarHBondContact O-CB 3.47Å; W385-M389 VanDerWaalsContact O-CG 3.26Å; W385-M389 WeakPolarHBondContact O-CG 3.27Å; W385-M389 PolarHBondContact O-N 2.98Å; G386-M389 PolarHBondContact O-N 2.78Å; I387-M389 PolarHBondContact O-N 2.69Å; M389-S392 PolarHBondContact O-OG 3.39Å; M389-S393 VanDerWaalsContact O-CB 3.25Å; M389-S393 WeakPolarHBondContact O-CB 3.36Å; M389-S393 PolarHBondContact O-N 2.91Å; M389-S393 VanDerWaalsContact O-N 3.11Å; M389-S393 PolarHBondContact O-OG 2.87Å
390V95.1Very high92.6Very high69 Ų6963.6 Ų63.642%0.41830%0.296SS..Hα-helixtrans-65.4-49.7174.6175.30000110L293 G386 I387 W388 S393 F394L293-V390 HydrophobicContact CD1-CG2 4.38Å; G386-V390 WeakPolarHBondContact O-CG2 3.48Å; G386-V390 PolarHBondContact O-N 2.86Å; G386-V390 VanDerWaalsContact O-N 3.12Å; I387-V390 PolarHBondContact O-N 2.84Å; W388-V390 VanDerWaalsContact C-N 3.34Å; W388-V390 PolarHBondContact O-N 3.48Å; V390-S393 PolarHBondContact O-N 3.36Å; V390-S393 PolarHBondContact O-OG 3.34Å; V390-F394 HydrophobicContact CG1-CD2 3.82Å; V390-F394 HydrophobicContact CG1-CE2 3.85Å; V390-F394 VanDerWaalsContact O-CD2 3.27Å; V390-F394 WeakPolarHBondContact O-CD2 3.48Å; V390-F394 PolarHBondContact O-N 3.38Å; V390-F394 VanDerWaalsContact O-N 3.14Å
391F95.4Very high92.1Very high117 Ų11757.8 Ų57.851%0.51327%0.274SS..Hα-helixtrans-59.8-50.8-179175.1-103.2000112.6I387 W388 S393 F394 L395I387-F391 VanDerWaalsContact O-CB 3.28Å; I387-F391 WeakPolarHBondContact O-CB 3.37Å; I387-F391 PolarHBondContact O-N 3.35Å; W388-F391 HydrophobicContact CE3-CD1 4.39Å; W388-F391 HydrophobicContact CZ3-CD1 4.38Å; W388-F391 PolarHBondContact O-N 2.94Å; F391-S393 PolarHBondContact O-N 3.33Å; F391-F394 PolarHBondContact O-N 3.3Å; F391-L395 HydrophobicContact CE1-CD2 3.87Å; F391-L395 HydrophobicContact CZ-CD2 4.09Å; F391-L395 VanDerWaalsContact O-CB 3.25Å; F391-L395 WeakPolarHBondContact O-CB 3.28Å; F391-L395 PolarHBondContact O-N 3.43Å
392S95.3Very high91.6Very high7 Ų763.7 Ų63.75%0.04929%0.294CS..Hα-helixtrans-65.4-38.5-177.769.70000111.8N193 W388 M389 L395 T396N193-S392 PolarHBondContact ND2-OG 3.04Å; N193-S392 PolarHBondContact OD1-OG 3.42Å; N193-S392 VanDerWaalsContact OD1-OG 3.06Å; W388-S392 VanDerWaalsContact O-CB 3.31Å; W388-S392 WeakPolarHBondContact O-CB 3.29Å; W388-S392 PolarHBondContact O-N 3.06Å; W388-S392 PolarHBondContact O-OG 3.19Å; W388-S392 VanDerWaalsContact O-OG 3.04Å; M389-S392 PolarHBondContact O-OG 3.39Å; S392-L395 PolarHBondContact O-N 3.21Å; S392-T396 VanDerWaalsContact O-CB 3.28Å; S392-T396 WeakPolarHBondContact O-CB 3.41Å; S392-T396 PolarHBondContact O-N 3.08Å; S392-T396 PolarHBondContact O-OG1 2.99Å
393S93.4Very high91.3Very high0 Ų063.7 Ų63.70%029%0.294CS..Hα-helixtrans-63.8-46.2176.561.90000112.3M389 V390 F391 T396 V397M389-S393 VanDerWaalsContact O-CB 3.25Å; M389-S393 WeakPolarHBondContact O-CB 3.36Å; M389-S393 PolarHBondContact O-N 2.91Å; M389-S393 VanDerWaalsContact O-N 3.11Å; M389-S393 PolarHBondContact O-OG 2.87Å; V390-S393 PolarHBondContact O-N 3.36Å; V390-S393 PolarHBondContact O-OG 3.34Å; F391-S393 PolarHBondContact O-N 3.33Å; S393-T396 PolarHBondContact O-N 2.92Å; S393-V397 WeakPolarHBondContact O-CG2 3.32Å; S393-V397 PolarHBondContact O-N 3.49Å
394F92.3Very high90.4Very high69 Ų6962.8 Ų62.830%0.30329%0.294SS..Hα-helixtrans-63.2-47.9173.7-84.3-73.8000111.6V286 V390 F391 T396 V397 W398V286-F394 HydrophobicContact CG2-CE1 3.93Å; V286-F394 HydrophobicContact CG2-CZ 4.2Å; V390-F394 HydrophobicContact CG1-CD2 3.82Å; V390-F394 HydrophobicContact CG1-CE2 3.85Å; V390-F394 VanDerWaalsContact O-CD2 3.27Å; V390-F394 WeakPolarHBondContact O-CD2 3.48Å; V390-F394 PolarHBondContact O-N 3.38Å; V390-F394 VanDerWaalsContact O-N 3.14Å; F391-F394 PolarHBondContact O-N 3.3Å; F394-T396 VanDerWaalsContact C-N 3.27Å; F394-T396 PolarHBondContact O-N 3.31Å; F394-V397 PolarHBondContact O-N 2.83Å; F394-V397 VanDerWaalsContact O-N 3.11Å; F394-W398 PolarHBondContact O-N 3.47Å
395L92.6Very high89.1Confident73 Ų7360.4 Ų60.438%0.38229%0.291SS..Hα-helixtrans-56-43.6179.9179.862.4000111.4F391 S392 V397 W398 I399F391-L395 HydrophobicContact CE1-CD2 3.87Å; F391-L395 HydrophobicContact CZ-CD2 4.09Å; F391-L395 VanDerWaalsContact O-CB 3.25Å; F391-L395 WeakPolarHBondContact O-CB 3.28Å; F391-L395 PolarHBondContact O-N 3.43Å; S392-L395 PolarHBondContact O-N 3.21Å; L395-V397 VanDerWaalsContact C-N 3.32Å; L395-V397 PolarHBondContact O-N 3.42Å; L395-W398 PolarHBondContact O-N 2.89Å; L395-I399 HydrophobicContact CD1-CD1 3.81Å; L395-I399 HydrophobicContact CD1-CG1 4.01Å; L395-I399 HydrophobicContact CD2-CD1 4.29Å; L395-I399 HydrophobicContact CG-CD1 3.68Å; L395-I399 HydrophobicContact CG-CG1 4.27Å; L395-I399 WeakPolarHBondContact O-CB 3.32Å; L395-I399 VanDerWaalsContact O-CG1 3.3Å; L395-I399 WeakPolarHBondContact O-CG1 3.5Å; L395-I399 PolarHBondContact O-N 3.16Å
396T90.7Very high87.5Confident10 Ų1061 Ų616%0.06131%0.311CS..Hα-helixtrans-57.9-44.9177.4-62.60000112I185 T189 I292 S392 S393 F394 G400I185-T396 HydrophobicContact CG2-CG2 3.7Å; T189-T396 HydrophobicContact CG2-CG2 4.09Å; T189-T396 WeakPolarHBondContact CG2-OG1 3.29Å; T189-T396 WeakPolarHBondContact OG1-CG2 3.37Å; T189-T396 PolarHBondContact OG1-OG1 3.46Å; T189-T396 VanDerWaalsContact OG1-OG1 3.06Å; I292-T396 HydrophobicContact CD1-CG2 4Å; S392-T396 VanDerWaalsContact O-CB 3.28Å; S392-T396 WeakPolarHBondContact O-CB 3.41Å; S392-T396 PolarHBondContact O-N 3.08Å; S392-T396 PolarHBondContact O-OG1 2.99Å; S393-T396 PolarHBondContact O-N 2.92Å; F394-T396 VanDerWaalsContact C-N 3.27Å; F394-T396 PolarHBondContact O-N 3.31Å; T396-G400 PolarHBondContact O-N 3.02Å
397V87.4Confident85.6Confident3 Ų364.6 Ų64.62%0.01832%0.32CS..Hα-helixtrans-67.5-42.5178.4173.80000111L276 L288 S393 F394 L395 G400 R401L276-V397 HydrophobicContact CD2-CB 4.08Å; L276-V397 HydrophobicContact CD2-CG1 3.71Å; L276-V397 HydrophobicContact CD2-CG2 4.26Å; L288-V397 HydrophobicContact CB-CG1 4.5Å; L288-V397 HydrophobicContact CB-CG2 3.66Å; L288-V397 HydrophobicContact CD1-CG1 4.35Å; S393-V397 WeakPolarHBondContact O-CG2 3.32Å; S393-V397 PolarHBondContact O-N 3.49Å; F394-V397 PolarHBondContact O-N 2.83Å; F394-V397 VanDerWaalsContact O-N 3.11Å; L395-V397 VanDerWaalsContact C-N 3.32Å; L395-V397 PolarHBondContact O-N 3.42Å; V397-G400 PolarHBondContact O-N 2.89Å; V397-R401 VanDerWaalsContact O-CG 3.28Å; V397-R401 WeakPolarHBondContact O-CG 3.39Å; V397-R401 PolarHBondContact O-N 3.34Å
398W86.2Confident83Confident138 Ų13864.9 Ų64.952%0.52333%0.329SS..Hα-helixtrans-64.6-46.2177.3-76.8110.3000112.8F394 L395 G400 R401 Y402F394-W398 PolarHBondContact O-N 3.47Å; L395-W398 PolarHBondContact O-N 2.89Å; W398-G400 VanDerWaalsContact C-N 3.33Å; W398-G400 PolarHBondContact O-N 3.08Å; W398-R401 PolarHBondContact O-N 3.41Å; W398-Y402 PolarHBondContact O-N 2.92Å
399I87Confident80.4Confident77 Ų7764.5 Ų64.540%0.39534%0.342SS..Hα-helixtrans-59.7-46.5174.2-70172.8000110L395 R401 Y402 L403L395-I399 HydrophobicContact CD1-CD1 3.81Å; L395-I399 HydrophobicContact CD1-CG1 4.01Å; L395-I399 HydrophobicContact CD2-CD1 4.29Å; L395-I399 HydrophobicContact CG-CD1 3.68Å; L395-I399 HydrophobicContact CG-CG1 4.27Å; L395-I399 WeakPolarHBondContact O-CB 3.32Å; L395-I399 VanDerWaalsContact O-CG1 3.3Å; L395-I399 WeakPolarHBondContact O-CG1 3.5Å; L395-I399 PolarHBondContact O-N 3.16Å; I399-R401 VanDerWaalsContact C-N 3.29Å; I399-R401 PolarHBondContact O-N 3.22Å; I399-Y402 PolarHBondContact O-N 3.43Å; I399-Y402 VanDerWaalsContact O-N 3.15Å; I399-L403 HydrophobicContact CG2-CD1 3.69Å; I399-L403 HydrophobicContact CG2-CG 4.14Å; I399-L403 WeakPolarHBondContact O-CG 3.35Å; I399-L403 PolarHBondContact O-N 3.42Å
400G84.1Confident77.3Confident5 Ų574 Ų745%0.05238%0.383CS..Hα-helixtrans-57.6-41178.200000113.2T396 V397 W398 A404T396-G400 PolarHBondContact O-N 3.02Å; V397-G400 PolarHBondContact O-N 2.89Å; W398-G400 VanDerWaalsContact C-N 3.33Å; W398-G400 PolarHBondContact O-N 3.08Å; G400-A404 WeakPolarHBondContact O-CB 3.32Å; G400-A404 PolarHBondContact O-N 3.46Å
401R81.7Confident74.4Confident39 Ų3980.6 Ų80.615%0.14740%0.4CS..Hα-helixtrans-66.4-44.7174.2-70.7177.967.1152.49.8112.4L276 P278 S280 S285 V397 W398 I399 A404 N405L276-R401 HydrophobicContact CD2-CG 4.44Å; P278-R401 PolarHBondContact O-NH2 3.19Å; S280-R401 PolarHBondContact O-NH1 3.35Å; S280-R401 PolarHBondContact O-NH2 3.34Å; S285-R401 PolarHBondContact OG-NH1 2.8Å; V397-R401 VanDerWaalsContact O-CG 3.28Å; V397-R401 WeakPolarHBondContact O-CG 3.39Å; V397-R401 PolarHBondContact O-N 3.34Å; W398-R401 PolarHBondContact O-N 3.41Å; I399-R401 VanDerWaalsContact C-N 3.29Å; I399-R401 PolarHBondContact O-N 3.22Å; R401-A404 PolarHBondContact O-N 2.92Å; R401-N405 PolarHBondContact O-N 3.02Å; R401-N405 VanDerWaalsContact O-N 3.09Å; R401-N405 PolarHBondContact O-OD1 3.06Å
402Y83Confident71.3Confident180 Ų18083.6 Ų83.671%0.70642%0.421SS*.Hα-helixtrans-62-46.2179.8-180-97.6000111.8W398 I399 A404 N405 G406W398-Y402 PolarHBondContact O-N 2.92Å; I399-Y402 PolarHBondContact O-N 3.43Å; I399-Y402 VanDerWaalsContact O-N 3.15Å; Y402-A404 VanDerWaalsContact C-N 3.28Å; Y402-A404 PolarHBondContact O-N 3.39Å; Y402-N405 WeakPolarHBondContact O-CB 3.33Å; Y402-N405 PolarHBondContact O-N 3.19Å; Y402-N405 VanDerWaalsContact O-N 3.15Å; Y402-G406 PolarHBondContact O-N 2.85Å
403L84.2Confident68.2Low65 Ų6588 Ų8834%0.3445%0.452SS..Hα-helixtrans-63.3-35.3178.1-68.3175.4000112.1I185 I399 G406 I458I185-L403 HydrophobicContact CD1-CD1 3.77Å; I399-L403 HydrophobicContact CG2-CD1 3.69Å; I399-L403 HydrophobicContact CG2-CG 4.14Å; I399-L403 WeakPolarHBondContact O-CG 3.35Å; I399-L403 PolarHBondContact O-N 3.42Å; L403-G406 PolarHBondContact O-N 3.41Å; L403-I458 HydrophobicContact CD1-CD1 4.22Å
404A75.2Confident65.2Low34 Ų3492.8 Ų92.828%0.28149%0.485SS..Hα-helixtrans-70-30.6175.700000113.1P278 G400 R401 Y402 G406P278-A404 HydrophobicContact CG-CB 3.73Å; G400-A404 WeakPolarHBondContact O-CB 3.32Å; G400-A404 PolarHBondContact O-N 3.46Å; R401-A404 PolarHBondContact O-N 2.92Å; Y402-A404 VanDerWaalsContact C-N 3.28Å; Y402-A404 PolarHBondContact O-N 3.39Å; A404-G406 VanDerWaalsContact C-N 3.3Å
405N68.6Low62.2Low98 Ų9895.2 Ų95.252%0.52451%0.51SS..Hα-helixtrans-69.6-28.3174.7-69.5-2.5000112.6P278 R401 Y402 H407P278-N405 WeakPolarHBondContact CA-OD1 3.41Å; P278-N405 WeakPolarHBondContact CB-OD1 3.23Å; P278-N405 VanDerWaalsContact CG-OD1 3.28Å; P278-N405 WeakPolarHBondContact CG-OD1 3.47Å; R401-N405 PolarHBondContact O-N 3.02Å; R401-N405 VanDerWaalsContact O-N 3.09Å; R401-N405 PolarHBondContact O-OD1 3.06Å; Y402-N405 WeakPolarHBondContact O-CB 3.33Å; Y402-N405 PolarHBondContact O-N 3.19Å; Y402-N405 VanDerWaalsContact O-N 3.15Å; N405-H407 PolarHBondContact O-N 2.73Å
406G61.7Low59.3Low56 Ų5697.6 Ų97.658%0.57753%0.533SS*.THydrogen-bonded Turntrans-72.4-7.8-178.800000114.7Y402 L403 A404 P408Y402-G406 PolarHBondContact O-N 2.85Å; L403-G406 PolarHBondContact O-N 3.41Å; A404-G406 VanDerWaalsContact C-N 3.3Å; G406-P408 VanDerWaalsContact C-CD 3.5Å; G406-P408 WeakPolarHBondContact O-CD 3.29Å
407H54.1Low56.7Low101 Ų101102.4 Ų102.447%0.46857%0.567SS.*  trans-99.590.2170.4-80.947000109.1N405 S409 D456N405-H407 PolarHBondContact O-N 2.73Å; H407-S409 PolarHBondContact O-N 3.11Å; H407-D456 IonicContact CD2-OD1 2.92Å; H407-D456 PolarHBondContact CD2-OD1 3.25Å; H407-D456 IonicContact CG-OD1 3.82Å; H407-D456 IonicContact NE2-OD1 3.85Å
408P41.5Very low54.2Low115 Ų115109.4 Ų109.475%0.74761%0.605SS**  trans-62.5107.4162.926.3-29.5000106G406 K410G406-P408 VanDerWaalsContact C-CD 3.5Å; G406-P408 WeakPolarHBondContact O-CD 3.29Å; P408-K410 PolarHBondContact O-N 3.4Å
409S42.4Very low51.7Low92 Ų92110.6 Ų110.664%0.64362%0.621SS**  trans-51.6123.5161.271.80000105.2H407 R411H407-S409 PolarHBondContact O-N 3.11Å; S409-R411 PolarHBondContact O-N 3.14Å
410K31.4Very low49.3Very low207 Ų207116.6 Ų116.690%0.965%0.648SS**  trans-57.689.2163.6-76.5179.8177.4177.40104.9P408 L412P408-K410 PolarHBondContact O-N 3.4Å; K410-L412 PolarHBondContact O-N 3.46Å
411R33.7Very low47Very low207 Ų207125.3 Ų125.378%0.78169%0.687SS**  trans-57.8117.1162.3-75.1-172.1-160.1-177.35.8103.5S409 S413S409-R411 PolarHBondContact O-N 3.14Å; R411-S413 PolarHBondContact O-N 2.92Å; R411-S413 PolarHBondContact O-OG 2.95Å
412L30.1Very low44.7Very low180 Ų180131.3 Ų131.394%0.94272%0.722SS**  trans-58.588.1161.4-151.878.7000105.7K410K410-L412 PolarHBondContact O-N 3.46Å
413S30.6Very low42.4Very low99 Ų99131.6 Ų131.669%0.69273%0.732SS**  trans-129.370.9173.460.40000107R411R411-S413 PolarHBondContact O-N 2.92Å; R411-S413 PolarHBondContact O-OG 2.95Å
414S30.5Very low39.9Very low101 Ų101135.8 Ų135.871%0.70676%0.755SS**SBendtrans-171.4121.9161.1540000108.7
415S29.7Very low38Very low119 Ų119141.6 Ų141.683%0.83278%0.781SS**SBendtrans84.769.6176.379.60000118.1
416S32.6Very low36.4Very low123 Ų123145.6 Ų145.686%0.8680%0.796SS**  trans-148.825.6144.647.80000113
417S34.5Very low35Very low111 Ų111150.1 Ų150.178%0.77681%0.807SS**SBendtrans-93.25-178.6-340000115.3
418D35.8Very low33.9Very low150 Ų150154.8 Ų154.880%0.80283%0.829SS**SBendtrans-126.821.3-168-65.8-30.9000115.3
419N33.9Very low33.5Very low164 Ų164154.4 Ų154.488%0.87783%0.83SS**SBendtrans-134.715.3-179.2-85.6-32.1000116.7
420E35.6Very low33.1Very low203 Ų203155.2 Ų155.295%0.94984%0.835SS**SBendtrans-98.611.9-179.6-118175.1-173.100115.3
421E35.2Very low33.1Very low187 Ų187151.4 Ų151.487%0.87483%0.833SS**SBendtrans-1077.9-173.8-124.8177.4-168.400116.5
422N34.6Very low33.2Very low165 Ų165148.7 Ų148.788%0.88283%0.832SS**SBendtrans-132.923.7-172.6-94.7-30.3000117.6
423M33.5Very low33.2Very low186 Ų186147 Ų14792%0.91682%0.824SS**  trans-127.231.1178.2-126.5176.778.300115.7
424N33Very low33.3Very low154 Ų154148.2 Ų148.282%0.82483%0.833SS**  trans-120.484166-85.9-22.2000109.5
425N33.9Very low33.2Very low155 Ų155153 Ų15383%0.82984%0.844SS**  trans173.184.2153.6-91.1-20.7000108.9
426H35.8Very low33.3Very low182 Ų182150.9 Ų150.984%0.84384%0.841SS**SBendtrans-177.7139.3136.6-101.3-59.8000110.6
427N33.2Very low33.2Very low152 Ų152153 Ų15381%0.81384%0.843SS**  trans90.563.8169.9-53.9-14.4000116.7
428Q30.4Very low32.9Very low198 Ų198153 Ų15393%0.92584%0.843SS**  trans-68.4121.9130.1-81.9174.9-15.400108.9
429S33.7Very low32.6Very low108 Ų108154.5 Ų154.576%0.75585%0.845SS**  trans171.5133.3130.4-168.10000111
430S33.5Very low32.4Very low108 Ų108154.7 Ų154.776%0.75585%0.846SS**  trans71.8124.4165.981.40000115.2
431C30.2Very low32.1Very low127 Ų127152.9 Ų152.986%0.85884%0.841SS**  cis-150.5161.732.3-78.40000112.4
432I36Very low31.9Very low150 Ų150151.2 Ų151.277%0.76984%0.838SS**  trans-90.3143.8-170.1-76162.6000111.6
433N30.4Very low31.6Very low145 Ų145151.3 Ų151.378%0.77584%0.839SS**  trans41.3123.4152.2-55.4-11.5000122.1
434S32.4Very low31.4Very low125 Ų125151 Ų15187%0.87484%0.84SS**  -166.9135.3116.2-930000111.9
435E29.9Very low31.3Very low202 Ų202150.2 Ų150.294%0.94484%0.836SS**  trans-62.3151.1176.3-62.5167.8135.500112.4
436G31.3Very low31Very low74 Ų74150.4 Ų150.476%0.76384%0.837SS**  trans157.8107.2162.400000116
437N30.4Very low30.6Very low167 Ų167150.1 Ų150.189%0.89383%0.833SS**  trans74.3111.6153.8-79.1-2.3000121.6
438S27.7Very low30.4Very low112 Ų112147.9 Ų147.978%0.78383%0.829SS**  trans-33.4160.1144.2-50.90000116.1
439E29.4Very low30.1Very low181 Ų181149.4 Ų149.485%0.84683%0.827SS**  trans96.289.6172.8-59.5-174.6164.800115
440N31.1Very low29.7Very low167 Ų167151.6 Ų151.689%0.89383%0.825SS**  trans-178.582.3137-90.4-35.5000109.4
441I29Very low29.3Very low166 Ų166151.1 Ų151.185%0.85182%0.817SS**  trans-104.291.2159.9-62.2174.5000104.8
442D29.6Very low29.1Very low151 Ų151151.8 Ų151.881%0.80782%0.817SS**  trans-174.575.5160.2-92.8-20.6000108.6
443N28.7Very low28.8Very low167 Ų167149.3 Ų149.389%0.89381%0.805SS**  trans-152.766.3163.4-97.6-25.7000108.3D445N443-D445 PolarHBondContact O-N 3.45Å
444L30.3Very low28.6Very low179 Ų179146.6 Ų146.694%0.93780%0.797SS**  trans-85.592.2162.6-106.9150.4000107.7N446L444-N446 PolarHBondContact O-N 3.48Å; L444-N446 VanDerWaalsContact O-N 3.14Å
445D30.3Very low28.4Very low138 Ų138146.8 Ų146.874%0.73879%0.788SS**  trans-47.6107.6176.6-140.41.3000110.7N443 K447N443-D445 PolarHBondContact O-N 3.45Å; D445-K447 PolarHBondContact O-N 3.18Å
446N27.8Very low28.5Very low160 Ų160142.5 Ų142.586%0.85677%0.772SS**  trans-79.260.4176.2-150.34.6000108.9L444 S448L444-N446 PolarHBondContact O-N 3.48Å; L444-N446 VanDerWaalsContact O-N 3.14Å; N446-S448 PolarHBondContact O-N 3.33Å
447K28Very low28.7Very low175 Ų175141.8 Ų141.876%0.76175%0.753SS**  trans-79.389.9178.9-154.2170.6-170171.30108.5D445 R449D445-K447 PolarHBondContact O-N 3.18Å; K447-R449 PolarHBondContact O-N 2.94Å
448S27.5Very low28.9Very low105 Ų105138 Ų13873%0.73473%0.732SS**  trans-48107.6166.950.90000109.9N446 Q450N446-S448 PolarHBondContact O-N 3.33Å; S448-Q450 PolarHBondContact O-N 3.33Å
449R25.2Very low29Very low231 Ų231135.9 Ų135.987%0.87271%0.714SS**  trans-73.292.8175.1-150.3177.3-163.21804.8107.1K447 V451K447-R449 PolarHBondContact O-N 2.94Å; R449-V451 HydrophobicContact CG-CG2 4.31Å; R449-V451 PolarHBondContact O-N 2.96Å
450Q25Very low29.1Very low153 Ų153134 Ų13472%0.71570%0.703SS**  trans-61.1101.4161.5-91.4-179.1-27.200107.3D242 S448D242-Q450 PolarHBondContact OD1-NE2 3.17Å; S448-Q450 PolarHBondContact O-N 3.33Å
451V25.8Very low29.3Very low99 Ų99131.5 Ų131.560%0.669%0.69SS**  trans-94.7102.1164.1-1730000106R449 I453R449-V451 HydrophobicContact CG-CG2 4.31Å; R449-V451 PolarHBondContact O-N 2.96Å; V451-I453 HydrophobicContact CB-CG1 4.46Å; V451-I453 HydrophobicContact CG1-CD1 3.88Å; V451-I453 HydrophobicContact CG1-CG1 3.56Å; V451-I453 PolarHBondContact O-N 3.32Å; V451-I453 VanDerWaalsContact O-N 3.14Å
452T25Very low29.5Very low140 Ų140131.8 Ų131.886%0.85968%0.68SS**  trans-63.6105.7166.7-32.90000107.4
453I29.1Very low29.7Very low99 Ų99128.7 Ų128.751%0.50866%0.663SS.*  trans-115.7107.1168.6-55.6-170.7000107.5V451V451-I453 HydrophobicContact CB-CG1 4.46Å; V451-I453 HydrophobicContact CG1-CD1 3.88Å; V451-I453 HydrophobicContact CG1-CG1 3.56Å; V451-I453 PolarHBondContact O-N 3.32Å; V451-I453 VanDerWaalsContact O-N 3.14Å
454S27.9Very low29.9Very low88 Ų88123.7 Ų123.762%0.61564%0.642SS**  trans-66136.6165.4-152.60000109.2
455D28Very low30.2Very low128 Ų128120.8 Ų120.868%0.68462%0.623SS**  trans65.682.2153.7-48.9-43.8000119.1
456D30.8Very low30.5Very low112 Ų112118 Ų11860%0.59961%0.611SS**  trans-130.275.3153.3-77.9-37.3000109.5H407H407-D456 IonicContact CD2-OD1 2.92Å; H407-D456 PolarHBondContact CD2-OD1 3.25Å; H407-D456 IonicContact CG-OD1 3.82Å; H407-D456 IonicContact NE2-OD1 3.85Å
457V35.1Very low31Very low60 Ų60113.9 Ų113.936%0.36460%0.595SS.*  trans-112.2106167.3-170.50000107.2R236 T459R236-V457 VanDerWaalsContact NH2-CG2 3.35Å; V457-T459 HydrophobicContact CG1-CG2 3.85Å; V457-T459 PolarHBondContact O-N 2.85Å
458I34.6Very low31.5Very low87 Ų87109.6 Ų109.645%0.44658%0.584SS.*  trans-68.889158.1-59.3172.6000105.5I185 L403I185-I458 HydrophobicContact CD1-CD1 4.29Å; L403-I458 HydrophobicContact CD1-CD1 4.22Å
459T30.3Very low32.1Very low67 Ų67108.7 Ų108.741%0.41157%0.573SS.*  trans-71.6135.7163.127.80000108.1V457 D461 R462V457-T459 HydrophobicContact CG1-CG2 3.85Å; V457-T459 PolarHBondContact O-N 2.85Å; T459-D461 PolarHBondContact O-N 3.33Å; T459-R462 PolarHBondContact O-N 3.39Å
460F32.9Very low32.8Very low142 Ų142104 Ų10462%0.62356%0.561SS**THydrogen-bonded Turntrans-53.8-19.6178.7-149.2-97000112.9R462 L463 S464F460-R462 PolarHBondContact O-N 3.47Å; F460-L463 PolarHBondContact O-N 2.84Å; F460-S464 PolarHBondContact O-N 3.28Å
461D34.8Very low33.4Very low115 Ų115104.1 Ų104.162%0.61556%0.564SS**Hα-helixtrans-56.9-30.9173.1-76.5-28000114.2T459 S464 Q465T459-D461 PolarHBondContact O-N 3.33Å; D461-S464 PolarHBondContact O-OG 2.88Å; D461-Q465 WeakPolarHBondContact O-CG 3.42Å; D461-Q465 PolarHBondContact O-N 3.47Å
462R33.6Very low34Very low171 Ų171103.1 Ų103.165%0.64556%0.561SS**Hα-helixtrans-79.6-26.1178.4-82.5-170-179175.93.4113.9T459 F460 Q465 T466T459-R462 PolarHBondContact O-N 3.39Å; F460-R462 PolarHBondContact O-N 3.47Å; R462-Q465 PolarHBondContact O-N 2.93Å; R462-T466 PolarHBondContact O-N 3.14Å; R462-T466 PolarHBondContact O-OG1 3.29Å
463L32.9Very low34.6Very low86 Ų86100.5 Ų100.545%0.4555%0.549SS..Hα-helixtrans-75.6-29.2176.7-77165.8000112.2F460 S467F460-L463 PolarHBondContact O-N 2.84Å; L463-S467 PolarHBondContact O-N 2.79Å; L463-S467 PolarHBondContact O-OG 3.06Å
464S33.7Very low34.8Very low63 Ų63102.8 Ų102.844%0.44156%0.561SS.*Hα-helixtrans-73.4-33.8170920000111.7F460 D461 T468F460-S464 PolarHBondContact O-N 3.28Å; D461-S464 PolarHBondContact O-OG 2.88Å; S464-T468 WeakPolarHBondContact O-CG2 3.42Å; S464-T468 PolarHBondContact O-N 2.72Å; S464-T468 VanDerWaalsContact O-N 3.14Å; S464-T468 PolarHBondContact O-OG1 3.06Å
465Q35.4Very low35.1Very low118 Ų118102.4 Ų102.455%0.55156%0.559SS**Hα-helixtrans-73.1-38.3178.7-76.1-178.5-0.100113.5D461 R462 S467 T468 T469D461-Q465 WeakPolarHBondContact O-CG 3.42Å; D461-Q465 PolarHBondContact O-N 3.47Å; R462-Q465 PolarHBondContact O-N 2.93Å; Q465-S467 VanDerWaalsContact C-N 3.32Å; Q465-S467 PolarHBondContact O-N 3.28Å; Q465-T468 WeakPolarHBondContact CA-OG1 3.49Å; Q465-T468 PolarHBondContact O-N 3.32Å; Q465-T468 PolarHBondContact O-OG1 3.31Å; Q465-T469 WeakPolarHBondContact O-CB 3.44Å; Q465-T469 PolarHBondContact O-N 3.11Å; Q465-T469 PolarHBondContact O-OG1 3.22Å
466T37.5Very low35.2Very low78 Ų78104.2 Ų104.248%0.47957%0.567SS.*Hα-helixtrans-72.6-24.6175.844.90000113.5R462R462-T466 PolarHBondContact O-N 3.14Å; R462-T466 PolarHBondContact O-OG1 3.29Å
467S37.4Very low35.2Very low74 Ų74104.6 Ų104.652%0.51758%0.579SS.*Hα-helixtrans-78-31173.9-51.90000111.9L463 Q465 M471L463-S467 PolarHBondContact O-N 2.79Å; L463-S467 PolarHBondContact O-OG 3.06Å; Q465-S467 VanDerWaalsContact C-N 3.32Å; Q465-S467 PolarHBondContact O-N 3.28Å; S467-M471 WeakPolarHBondContact O-CB 3.44Å; S467-M471 PolarHBondContact O-N 3.24Å
468T38.5Very low34.9Very low86 Ų86107.2 Ų107.253%0.52860%0.6SS.*Hα-helixtrans-87.9-25.5178.946.70000114S464 Q465 S472S464-T468 WeakPolarHBondContact O-CG2 3.42Å; S464-T468 PolarHBondContact O-N 2.72Å; S464-T468 VanDerWaalsContact O-N 3.14Å; S464-T468 PolarHBondContact O-OG1 3.06Å; Q465-T468 WeakPolarHBondContact CA-OG1 3.49Å; Q465-T468 PolarHBondContact O-N 3.32Å; Q465-T468 PolarHBondContact O-OG1 3.31Å; T468-S472 PolarHBondContact O-N 3.23Å; T468-S472 PolarHBondContact O-OG 2.95Å
469T40.1Very low34.9Very low85 Ų85108.8 Ų108.852%0.52162%0.618SS.*Hα-helixtrans-85.5-17.1176.643.80000114.6Q465Q465-T469 WeakPolarHBondContact O-CB 3.44Å; Q465-T469 PolarHBondContact O-N 3.11Å; Q465-T469 PolarHBondContact O-OG1 3.22Å
470H41Very low35Very low132 Ų132110.8 Ų110.861%0.61164%0.635SS**Hα-helixtrans-97.6-18.1169.8-84.9-69.1000114.4
471M36Very low34.9Very low156 Ų156108.7 Ų108.777%0.76864%0.644SS**Hα-helixtrans-80.5-19.3169.7-80.3-175.477.400113.7S467S467-M471 WeakPolarHBondContact O-CB 3.44Å; S467-M471 PolarHBondContact O-N 3.24Å
472S39.1Very low34.7Very low79 Ų79108.5 Ų108.555%0.55265%0.652SS**SBendtrans-88.2-10.6177.844.20000114.2T468T468-S472 PolarHBondContact O-N 3.23Å; T468-S472 PolarHBondContact O-OG 2.95Å
473S38.6Very low34.7Very low85 Ų85106.2 Ų106.259%0.59466%0.662SS**SBendtrans-103.61.2174.9670000114.2
474L33.3Very low34.9Very low147 Ų147106.9 Ų106.977%0.7767%0.674SS**SBendtrans-105.72.2175.8-87.9157.3000113.5L476L474-L476 PolarHBondContact O-N 3.09Å
475S33.3Very low34.9Very low80 Ų80111.9 Ų111.956%0.55970%0.695SS**SBendtrans-97.961.1174.962.70000111.5
476L30.7Very low35Very low165 Ų165110.9 Ų110.986%0.86471%0.707SS**SBendtrans-175.576.8167.2-100.4136.9000108.8L474L474-L476 PolarHBondContact O-N 3.09Å
477S30Very low35.2Very low120 Ų120114.8 Ų114.884%0.83973%0.725SS**  trans160.873.615447.40000112.3
478S29.9Very low35.2Very low115 Ų115118.5 Ų118.580%0.80474%0.737SS**  trans-159.851.2157.654.30000111.6S480S478-S480 VanDerWaalsContact C-N 3.34Å; S478-S480 PolarHBondContact O-N 2.92Å
479S33.1Very low35.1Very low120 Ų120119.5 Ų119.584%0.83975%0.748SS**  trans-8871162.455.30000109.7
480S33.4Very low35.1Very low110 Ų110123.2 Ų123.277%0.76976%0.764SS**SBendtrans178.162.2164.656.50000111.8S478S478-S480 VanDerWaalsContact C-N 3.34Å; S478-S480 PolarHBondContact O-N 2.92Å
481A30.4Very low35Very low98 Ų98125.1 Ų125.181%0.8177%0.773SS**  trans-159.149.5165.400000110.7
482S30.6Very low35.2Very low110 Ų110125.9 Ų125.977%0.76978%0.778SS**  trans-113.794.9175.650.10000108.5
483S34.4Very low35Very low123 Ų123131.8 Ų131.886%0.8679%0.794SS**SBendtrans175.4-8.115548.50000116.7
484S35.4Very low35Very low101 Ų101137.6 Ų137.671%0.70681%0.809SS**SBendtrans-114.23.9-162.7520000119.1
485L34.1Very low35.5Very low167 Ų167143.6 Ų143.687%0.87483%0.833SS**SBendtrans-121.512.4-177-74.9169.1000116.1
486A39Very low35.6Very low97 Ų97146.8 Ų146.880%0.80285%0.847SS**SBendtrans-91.311.2-178.600000115.7
487N40.4Very low35.9Very low161 Ų161145.8 Ų145.886%0.86185%0.846SS**SBendtrans-129.313.7-169.6-97.1-11.1000117.4
488I38.7Very low36.2Very low152 Ų152147.3 Ų147.378%0.77985%0.846SS**SBendtrans-121.65.3-169.5-66179.4000116.5
489S34.4Very low36.6Very low107 Ų107149.2 Ų149.275%0.74885%0.849SS**  trans-143.759.1169-154.70000114.1
490N40.5Very low36.8Very low162 Ų162151 Ų15187%0.86685%0.849SS**  trans-104.470.2149.5-91.8-26.6000107.4
491H39.8Very low37Very low173 Ų173153.7 Ų153.780%0.80185%0.854SS**  trans-16992.2164.1-111.3-70.8000107.3
492I39.3Very low37.5Very low171 Ų171157.7 Ų157.788%0.87786%0.858SS**  trans171.578.5151.7-80.2147.3000104.2
493K36.2Very low38Very low204 Ų204161.4 Ų161.489%0.88786%0.864SS**  trans-154.685.3166.7-120.7-173.5-176.5-178.90105.4
494K38.8Very low38.3Very low207 Ų207164.6 Ų164.690%0.987%0.865SS**  trans169.782.7162-99.3176.3-179.5-174.90108.1
495E43.3Very low38.6Very low273 Ų273170.4 Ų170.4100%1.27688%0.879SS**  trans-172.30133.2-101.7178.6-175.400108.5

Retrieved 495 of 495 residues in 228.2 ms (Link to these results)

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