A0A087Y874_POEFO Loading...

Rhodopsin

AlphaFold DB , UniProt , Accession A0A087Y874, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 353 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
1M70.1Confident92.2Very high183 Ų18355.8 Ų55.890%0.90130%0.302SS*.  0139.70-62.4178.8-17500108.1G3 S14M1-G3 WeakPolarHBondContact CB-O 3.47Å; M1-S14 WeakPolarHBondContact O-CB 3.45Å; M1-S14 PolarHBondContact O-OG 3.08Å
2N89.4Confident92.4Very high79 Ų7952 Ų5242%0.42228%0.282SS..  trans-76.6-32.1-178.7-62.4-23.4000111.8M13 S14 G280 E282N2-M13 CarbonylContact O-C 3.27Å; N2-M13 VanDerWaalsContact O-C 3.25Å; N2-S14 PolarHBondContact O-N 3.48Å; N2-G280 WeakPolarHBondContact CB-O 3.13Å; N2-G280 PolarHBondContact ND2-O 2.95Å; N2-E282 HydrophobicContact CB-CB 4.03Å
3G92.1Very high92.5Very high4 Ų452.4 Ų52.44%0.04128%0.282CS..SBendtrans-110179.4164.500000112.8M1 Y10 V11 M13M1-G3 WeakPolarHBondContact CB-O 3.47Å; G3-Y10 WeakPolarHBondContact CA-OH 3.45Å; G3-Y10 PolarHBondContact N-OH 3.37Å; G3-V11 CarbonylContact C-O 3.5Å; G3-V11 VanDerWaalsContact CA-O 3.32Å; G3-V11 WeakPolarHBondContact CA-O 3.46Å; G3-M13 CarbonylContact C-O 3.54Å
4T95.3Very high92.6Very high25 Ų2551.1 Ų51.115%0.15328%0.279CS..EExtended strand (participates in β ladder)trans-123.2109.5179.3-56.30000109.1V11 M13 N15 V20T4-V11 PolarHBondContact N-O 3.2Å; T4-V11 PolarHBondContact O-N 3.46Å; T4-M13 PolarHBondContact N-O 3.29Å; T4-M13 PolarHBondContact OG1-O 3.34Å; T4-N15 HydrophobicContact CG2-CB 3.99Å; T4-N15 WeakPolarHBondContact OG1-CB 3.36Å; T4-N15 PolarHBondContact OG1-N 3.37Å; T4-V20 HydrophobicContact CG2-CB 4.39Å; T4-V20 HydrophobicContact CG2-CG1 3.84Å
5E95.3Very high92.8Very high93 Ų9352.3 Ų52.344%0.43529%0.285SS..EExtended strand (participates in β ladder)trans-87.3136.2176.8-175.5174.4173.900110.9Y10 T193 K195E5-Y10 HydrophobicContact CB-CD2 4.13Å; E5-T193 HydrophobicContact CG-CG2 3.93Å; E5-K195 WeakPolarHBondContact OE1-CE 3.45Å; E5-K195 IonicContact OE1-NZ 2.95Å
6G94.3Very high92.9Very high12 Ų1263.2 Ų63.212%0.12432%0.32CS..  trans-121.1-178.9169.300000112N8 F9G6-N8 VanDerWaalsContact C-N 3.27Å; G6-N8 PolarHBondContact O-N 3.44Å; G6-F9 PolarHBondContact N-O 2.92Å
7P92.4Very high92.9Very high102 Ų10265 Ų6566%0.66234%0.335SS*.SBendtrans-56.3-41.8179.8-26.534.9000112.5R177 K195P7-R177 PolarHBondContact O-NH1 2.94Å; P7-K195 PolarHBondContact O-NZ 2.88Å
8N94.4Very high93Very high79 Ų7963.4 Ų63.442%0.42234%0.337SS..SBendtrans-122.210.7-172.6-65-34.9000114.6G6 F24 V107 I179G6-N8 VanDerWaalsContact C-N 3.27Å; G6-N8 PolarHBondContact O-N 3.44Å; N8-F24 HydrophobicContact CB-CD2 4.49Å; N8-F24 HydrophobicContact CB-CE2 3.81Å; N8-F24 WeakPolarHBondContact O-CE2 3.36Å; N8-V107 HydrophobicContact CB-CG2 4.15Å; N8-I179 WeakPolarHBondContact O-CG2 3.43Å
9F96.9Very high93.1Very high22 Ų2264.9 Ų64.910%0.09635%0.345CS..  trans-154.7166.4-174.162.9-96.2000112.5G6 V11 P23 F24G6-F9 PolarHBondContact N-O 2.92Å; F9-V11 HydrophobicContact CD2-CG2 3.82Å; F9-V11 HydrophobicContact CE2-CG2 3.98Å; F9-P23 HydrophobicContact CB-CG 3.66Å; F9-P23 HydrophobicContact CD1-CG 4.24Å; F9-P23 HydrophobicContact CD2-CG 4.18Å; F9-P23 VanDerWaalsContact CG-CD 3.45Å; F9-P23 HydrophobicContact CG-CG 3.78Å; F9-F24 HydrophobicContact CB-CE2 4.02Å; F9-F24 HydrophobicContact CD1-CD2 4.14Å; F9-F24 HydrophobicContact CD1-CE2 4.17Å
10Y96.8Very high93.3Very high15 Ų1562.2 Ų62.26%0.05933%0.331CS..EExtended strand (participates in β ladder)trans-135.5115.8166.3179.1-89000109.3G3 E5 P12 Y192 T193 F283G3-Y10 WeakPolarHBondContact CA-OH 3.45Å; G3-Y10 PolarHBondContact N-OH 3.37Å; E5-Y10 HydrophobicContact CB-CD2 4.13Å; Y10-P12 HydrophobicContact CE1-CB 4.41Å; Y10-Y192 AromaticContact CD1-CD1 3.4Å; Y10-Y192 HydrophobicContact CD1-CD1 3.4Å; Y10-Y192 HydrophobicContact CD1-CE1 4.14Å; Y10-Y192 AromaticContact CD1-CG 3.87Å; Y10-Y192 HydrophobicContact CD1-CG 3.87Å; Y10-Y192 AromaticContact CE1-CD1 3.79Å; Y10-Y192 HydrophobicContact CE1-CD1 3.79Å; Y10-Y192 HydrophobicContact CE1-CE1 4.5Å; Y10-Y192 HydrophobicContact CG-CD1 4.21Å; Y10-Y192 HydrophobicContact CG-CG 4.24Å; Y10-T193 HydrophobicContact CD2-CG2 3.84Å; Y10-T193 HydrophobicContact CG-CG2 4.25Å; Y10-F283 AromaticContact CE1-CZ 4Å; Y10-F283 HydrophobicContact CE1-CZ 4Å
11V97Very high93.5Very high0 Ų064.6 Ų64.60%034%0.336CS..EExtended strand (participates in β ladder)trans-91.6125175.4177.80000109G3 T4 F9 M13 V20 Y30 L31G3-V11 CarbonylContact C-O 3.5Å; G3-V11 VanDerWaalsContact CA-O 3.32Å; G3-V11 WeakPolarHBondContact CA-O 3.46Å; T4-V11 PolarHBondContact N-O 3.2Å; T4-V11 PolarHBondContact O-N 3.46Å; F9-V11 HydrophobicContact CD2-CG2 3.82Å; F9-V11 HydrophobicContact CE2-CG2 3.98Å; V11-M13 HydrophobicContact CG1-CB 4.1Å; V11-M13 PolarHBondContact O-N 3.04Å; V11-V20 HydrophobicContact CB-CG1 3.88Å; V11-V20 HydrophobicContact CG1-CG1 3.88Å; V11-V20 HydrophobicContact CG2-CG1 4Å; V11-Y30 HydrophobicContact CG1-CE2 4.22Å; V11-L31 HydrophobicContact CG1-CD1 4.1Å; V11-L31 HydrophobicContact CG1-CD2 3.78Å; V11-L31 HydrophobicContact CG1-CG 4.39Å
12P94.4Very high94.8Very high10 Ų1056.7 Ų56.77%0.06530%0.298CS..SBendtrans-78.654-179.435.2-37.7000111.8Y10 F283 P285Y10-P12 HydrophobicContact CE1-CB 4.41Å; P12-F283 HydrophobicContact CB-CD2 3.94Å; P12-F283 HydrophobicContact CB-CE2 3.43Å; P12-F283 VanDerWaalsContact CB-CE2 3.43Å; P12-F283 HydrophobicContact CB-CZ 4.04Å; P12-F283 HydrophobicContact CG-CE2 4.38Å; P12-P285 HydrophobicContact CG-CB 4.16Å
13M94.3Very high95.3Very high57 Ų5752.9 Ų52.928%0.28128%0.278SS..SBendtrans-152.8142176.5-174.8178.4-172.600110.1N2 G3 T4 V11 V20 Y30 L31N2-M13 CarbonylContact O-C 3.27Å; N2-M13 VanDerWaalsContact O-C 3.25Å; G3-M13 CarbonylContact C-O 3.54Å; T4-M13 PolarHBondContact N-O 3.29Å; T4-M13 PolarHBondContact OG1-O 3.34Å; V11-M13 HydrophobicContact CG1-CB 4.1Å; V11-M13 PolarHBondContact O-N 3.04Å; M13-V20 HydrophobicContact CB-CG2 4.32Å; M13-V20 HydrophobicContact CG-CG2 4.27Å; M13-V20 HydrophobicContact SD-CG2 4.39Å; M13-Y30 HydrophobicContact SD-CD2 3.55Å; M13-Y30 VanDerWaalsContact SD-CD2 3.55Å; M13-Y30 HydrophobicContact SD-CE2 4.06Å; M13-L31 HydrophobicContact CB-CD2 3.64Å; M13-L31 HydrophobicContact CG-CD2 4.38Å; M13-L31 HydrophobicContact SD-CD2 3.94Å
14S93.9Very high95.5Very high34 Ų3454 Ų5424%0.23828%0.281CS..  trans-73.8131.5177.1-165.80000111.6M1 N2 R16M1-S14 WeakPolarHBondContact O-CB 3.45Å; M1-S14 PolarHBondContact O-OG 3.08Å; N2-S14 PolarHBondContact O-N 3.48Å; S14-R16 PolarHBondContact O-N 2.87Å
15N95.4Very high95.6Very high69 Ų6958.9 Ų58.937%0.36930%0.303SS..G310 helixtrans-83.124.5176.3-160.622.7000114.6T4 T17 G18 L19 V20T4-N15 HydrophobicContact CG2-CB 3.99Å; T4-N15 WeakPolarHBondContact OG1-CB 3.36Å; T4-N15 PolarHBondContact OG1-N 3.37Å; N15-T17 PolarHBondContact O-N 3.29Å; N15-G18 PolarHBondContact O-N 3.18Å; N15-G18 VanDerWaalsContact O-N 3.09Å; N15-G18 VanDerWaalsContact OD1-C 3.3Å; N15-G18 VanDerWaalsContact OD1-CA 3.23Å; N15-G18 WeakPolarHBondContact OD1-CA 3.22Å; N15-L19 PolarHBondContact OD1-N 3.44Å; N15-V20 HydrophobicContact CB-CB 3.93Å; N15-V20 HydrophobicContact CB-CG2 3.93Å; N15-V20 WeakPolarHBondContact OD1-CB 3.27Å; N15-V20 PolarHBondContact OD1-N 3.25Å
16R93.9Very high95.8Very high227 Ų22758.5 Ų58.586%0.85730%0.301SS*.G310 helixtrans-60.5-30.7178.7-79.3179.4174.9174.11.3113.3S14 G18S14-R16 PolarHBondContact O-N 2.87Å; R16-G18 VanDerWaalsContact C-N 3.33Å
17T93.8Very high95.9Very high94 Ų9460.4 Ų60.458%0.57731%0.311SS*.G310 helixtrans-84-7.9178.855.60000113.3N15 L19N15-T17 PolarHBondContact O-N 3.29Å; T17-L19 PolarHBondContact O-N 3.28Å; T17-L19 WeakPolarHBondContact OG1-CB 3.37Å; T17-L19 WeakPolarHBondContact OG1-CG 3.38Å; T17-L19 PolarHBondContact OG1-N 3.44Å
18G94.6Very high96.2Very high36 Ų3655.6 Ų55.637%0.37128%0.279SS..SBendtrans69.214.9-172.700000114.2N15 R16 R21N15-G18 PolarHBondContact O-N 3.18Å; N15-G18 VanDerWaalsContact O-N 3.09Å; N15-G18 VanDerWaalsContact OD1-C 3.3Å; N15-G18 VanDerWaalsContact OD1-CA 3.23Å; N15-G18 WeakPolarHBondContact OD1-CA 3.22Å; R16-G18 VanDerWaalsContact C-N 3.33Å; G18-R21 PolarHBondContact O-NH1 3.01Å; G18-R21 PolarHBondContact O-NH2 3.02Å
19L95.2Very high96.3Very high93 Ų9356.2 Ų56.249%0.48728%0.277SS..  trans-84.4-25.8-179.3-70.4175000114N15 T17 R21N15-L19 PolarHBondContact OD1-N 3.44Å; T17-L19 PolarHBondContact O-N 3.28Å; T17-L19 WeakPolarHBondContact OG1-CB 3.37Å; T17-L19 WeakPolarHBondContact OG1-CG 3.38Å; T17-L19 PolarHBondContact OG1-N 3.44Å; L19-R21 PolarHBondContact O-N 3.43Å; L19-R21 PolarHBondContact O-NH1 2.78Å
20V97.1Very high96.3Very high9 Ų957.8 Ų57.86%0.05528%0.282CS..  trans-68.8135.5-171.7179.80000110T4 V11 M13 N15 Y30T4-V20 HydrophobicContact CG2-CB 4.39Å; T4-V20 HydrophobicContact CG2-CG1 3.84Å; V11-V20 HydrophobicContact CB-CG1 3.88Å; V11-V20 HydrophobicContact CG1-CG1 3.88Å; V11-V20 HydrophobicContact CG2-CG1 4Å; M13-V20 HydrophobicContact CB-CG2 4.32Å; M13-V20 HydrophobicContact CG-CG2 4.27Å; M13-V20 HydrophobicContact SD-CG2 4.39Å; N15-V20 HydrophobicContact CB-CB 3.93Å; N15-V20 HydrophobicContact CB-CG2 3.93Å; N15-V20 WeakPolarHBondContact OD1-CB 3.27Å; N15-V20 PolarHBondContact OD1-N 3.25Å; V20-Y30 HydrophobicContact CB-CE2 4.44Å; V20-Y30 HydrophobicContact CG1-CE2 4.42Å; V20-Y30 HydrophobicContact CG2-CE2 4.19Å
21R97.4Very high96.2Very high114 Ų11458.1 Ų58.143%0.4329%0.285SS..  trans-133157.7-179.4-64-67.3177-81.8-2.9110.2G18 L19 H26 Q28 Y30G18-R21 PolarHBondContact O-NH1 3.01Å; G18-R21 PolarHBondContact O-NH2 3.02Å; L19-R21 PolarHBondContact O-N 3.43Å; L19-R21 PolarHBondContact O-NH1 2.78Å; R21-H26 HydrophobicContact CB-CB 3.71Å; R21-H26 HydrophobicContact CG-CB 4.21Å; R21-Q28 PolarHBondContact O-NE2 3.5Å; R21-Y30 HydrophobicContact CB-CE1 4.35Å; R21-Y30 PolarHBondContact N-OH 2.92Å; R21-Y30 PolarHBondContact O-OH 2.9Å
22S97.9Very high96.2Very high16 Ų1658.6 Ų58.611%0.11229%0.289CS..  trans-55.5128.7175.6175.40000111F24 E25 H26 Q28S22-F24 PolarHBondContact O-N 3.43Å; S22-F24 VanDerWaalsContact O-N 3.12Å; S22-F24 PolarHBondContact OG-N 3.12Å; S22-E25 PolarHBondContact O-N 3.02Å; S22-E25 VanDerWaalsContact O-N 3.16Å; S22-H26 PolarHBondContact O-N 3.39Å; S22-H26 VanDerWaalsContact O-N 3.07Å; S22-Q28 PolarHBondContact O-NE2 3.28Å
23P98.1Very high96.3Very high0 Ų063 Ų630%031%0.308CS..THydrogen-bonded Turntrans-68.6-3.4173.931.1-36000112.8F9 Q28 Y102 F103 P180 Q184F9-P23 HydrophobicContact CB-CG 3.66Å; F9-P23 HydrophobicContact CD1-CG 4.24Å; F9-P23 HydrophobicContact CD2-CG 4.18Å; F9-P23 VanDerWaalsContact CG-CD 3.45Å; F9-P23 HydrophobicContact CG-CG 3.78Å; P23-Q28 HydrophobicContact CB-CG 4.17Å; P23-Y102 WeakPolarHBondContact O-CB 3.3Å; P23-F103 WeakPolarHBondContact O-CA 3.47Å; P23-F103 WeakPolarHBondContact O-CB 3.35Å; P23-F103 PolarHBondContact O-N 3.25Å; P23-P180 HydrophobicContact CB-CB 4.4Å; P23-P180 HydrophobicContact CB-CG 4.31Å; P23-P180 HydrophobicContact CG-CB 4.32Å; P23-P180 HydrophobicContact CG-CG 3.97Å; P23-Q184 HydrophobicContact CB-CB 3.84Å; P23-Q184 HydrophobicContact CB-CG 4.2Å
24F98.3Very high96.4Very high27 Ų2763.6 Ų63.612%0.11832%0.317CS..THydrogen-bonded Turntrans-97.7-11.2174.7-59.3-62.5000113.7N8 F9 S22 F103 G106 V107 C110 P180N8-F24 HydrophobicContact CB-CD2 4.49Å; N8-F24 HydrophobicContact CB-CE2 3.81Å; N8-F24 WeakPolarHBondContact O-CE2 3.36Å; F9-F24 HydrophobicContact CB-CE2 4.02Å; F9-F24 HydrophobicContact CD1-CD2 4.14Å; F9-F24 HydrophobicContact CD1-CE2 4.17Å; S22-F24 PolarHBondContact O-N 3.43Å; S22-F24 VanDerWaalsContact O-N 3.12Å; S22-F24 PolarHBondContact OG-N 3.12Å; F24-F103 HydrophobicContact CD1-CB 3.69Å; F24-F103 HydrophobicContact CE1-CB 4.01Å; F24-F103 HydrophobicContact CE1-CG 4.42Å; F24-G106 VanDerWaalsContact CD1-C 3.44Å; F24-V107 HydrophobicContact CD1-CG2 4.43Å; F24-V107 HydrophobicContact CD2-CG2 4.24Å; F24-V107 HydrophobicContact CE1-CG2 4.25Å; F24-V107 HydrophobicContact CE2-CG2 4.04Å; F24-V107 HydrophobicContact CG-CG2 4.41Å; F24-V107 HydrophobicContact CZ-CG2 4.03Å; F24-C110 HydrophobicContact CE1-CB 3.86Å; F24-C110 HydrophobicContact CZ-CB 4.38Å; F24-P180 HydrophobicContact CE1-CG 3.8Å; F24-P180 HydrophobicContact CE2-CG 4.34Å; F24-P180 HydrophobicContact CZ-CG 3.6Å
25E97.3Very high96.6Very high128 Ų12868.9 Ų68.960%0.59833%0.332SS*.THydrogen-bonded Turntrans-121.8-30.8-173.1-63.2174.5-177.700112.4S22S22-E25 PolarHBondContact O-N 3.02Å; S22-E25 VanDerWaalsContact O-N 3.16Å
26H97.7Very high96.6Very high85 Ų8568.7 Ų68.739%0.39433%0.327SS..SBendtrans-138.6147-171.3-63.8-67.2000113.5R21 S22 Q28 Y102R21-H26 HydrophobicContact CB-CB 3.71Å; R21-H26 HydrophobicContact CG-CB 4.21Å; S22-H26 PolarHBondContact O-N 3.39Å; S22-H26 VanDerWaalsContact O-N 3.07Å; H26-Q28 PolarHBondContact O-NE2 2.99Å; H26-Y102 VanDerWaalsContact C-CG 3.47Å; H26-Y102 WeakPolarHBondContact O-CB 3.47Å
27P97.9Very high96.8Very high52 Ų5258 Ų5834%0.33829%0.287SS..  trans-54.1142.2173-25.734000113.6Y29 Y102P27-Y29 HydrophobicContact CB-CD2 3.54Å; P27-Y29 HydrophobicContact CB-CE2 3.48Å; P27-Y29 VanDerWaalsContact CB-CE2 3.48Å; P27-Y29 HydrophobicContact CB-CG 4.27Å; P27-Y29 HydrophobicContact CG-CE2 4.18Å; P27-Y102 HydrophobicContact CB-CD1 4.18Å; P27-Y102 HydrophobicContact CG-CD1 3.77Å; P27-Y102 HydrophobicContact CG-CE1 3.93Å
28Q98.1Very high97Very high0 Ų057.1 Ų57.10%029%0.285CS..  trans-9924-174.5-58.5-67.8-62.200112.8R21 S22 P23 H26 Y30 L31 Y37 G101 Q184R21-Q28 PolarHBondContact O-NE2 3.5Å; S22-Q28 PolarHBondContact O-NE2 3.28Å; P23-Q28 HydrophobicContact CB-CG 4.17Å; H26-Q28 PolarHBondContact O-NE2 2.99Å; Q28-Y30 VanDerWaalsContact CD-OH 3.25Å; Q28-Y30 PolarHBondContact NE2-OH 2.72Å; Q28-Y30 PolarHBondContact O-N 2.99Å; Q28-Y30 VanDerWaalsContact OE1-CZ 3.26Å; Q28-Y30 PolarHBondContact OE1-OH 3.05Å; Q28-L31 HydrophobicContact CB-CD1 4Å; Q28-L31 HydrophobicContact CB-CG 4.41Å; Q28-L31 VanDerWaalsContact O-CB 3.31Å; Q28-L31 WeakPolarHBondContact O-CB 3.39Å; Q28-L31 PolarHBondContact O-N 3.49Å; Q28-Y37 WeakPolarHBondContact CB-OH 3.38Å; Q28-Y37 PolarHBondContact O-OH 3.4Å; Q28-G101 WeakPolarHBondContact CB-O 3.26Å; Q28-G101 PolarHBondContact N-O 3.37Å; Q28-Q184 HydrophobicContact CG-CB 3.95Å; Q28-Q184 HydrophobicContact CG-CG 4.13Å
29Y97.1Very high97.2Very high93 Ų9360.4 Ų60.437%0.36529%0.294SS..THydrogen-bonded Turntrans-61.8-8.2-176.7-59.3-46.4000115.4P27 L31 A32 P34 Y37 H100P27-Y29 HydrophobicContact CB-CD2 3.54Å; P27-Y29 HydrophobicContact CB-CE2 3.48Å; P27-Y29 VanDerWaalsContact CB-CE2 3.48Å; P27-Y29 HydrophobicContact CB-CG 4.27Å; P27-Y29 HydrophobicContact CG-CE2 4.18Å; Y29-L31 VanDerWaalsContact C-N 3.34Å; Y29-A32 CarbonylContact C-O 3.36Å; Y29-A32 WeakPolarHBondContact CA-O 3.15Å; Y29-P34 HydrophobicContact CD1-CB 4.07Å; Y29-P34 HydrophobicContact CD1-CG 4Å; Y29-P34 HydrophobicContact CE1-CB 4.18Å; Y29-P34 HydrophobicContact CG-CG 4.06Å; Y29-Y37 AromaticContact CD1-CD2 3.6Å; Y29-Y37 HydrophobicContact CD1-CD2 3.6Å; Y29-Y37 AromaticContact CD1-CE2 3.77Å; Y29-Y37 HydrophobicContact CD1-CE2 3.77Å; Y29-Y37 HydrophobicContact CD1-CG 4.17Å; Y29-Y37 HydrophobicContact CE1-CD1 4.49Å; Y29-Y37 AromaticContact CE1-CD2 3.8Å; Y29-Y37 HydrophobicContact CE1-CD2 3.8Å; Y29-Y37 HydrophobicContact CE1-CE2 4.34Å; Y29-Y37 AromaticContact CE1-CG 3.9Å; Y29-Y37 HydrophobicContact CE1-CG 3.9Å; Y29-H100 PolarHBondContact OH-O 3.49Å
30Y95.8Very high97.3Very high55 Ų5557 Ų5722%0.21628%0.275CS..THydrogen-bonded Turntrans-78.5-17169.658.5-101.2000113.1V11 M13 V20 R21 Q28V11-Y30 HydrophobicContact CG1-CE2 4.22Å; M13-Y30 HydrophobicContact SD-CD2 3.55Å; M13-Y30 VanDerWaalsContact SD-CD2 3.55Å; M13-Y30 HydrophobicContact SD-CE2 4.06Å; V20-Y30 HydrophobicContact CB-CE2 4.44Å; V20-Y30 HydrophobicContact CG1-CE2 4.42Å; V20-Y30 HydrophobicContact CG2-CE2 4.19Å; R21-Y30 HydrophobicContact CB-CE1 4.35Å; R21-Y30 PolarHBondContact N-OH 2.92Å; R21-Y30 PolarHBondContact O-OH 2.9Å; Q28-Y30 VanDerWaalsContact CD-OH 3.25Å; Q28-Y30 PolarHBondContact NE2-OH 2.72Å; Q28-Y30 PolarHBondContact O-N 2.99Å; Q28-Y30 VanDerWaalsContact OE1-CZ 3.26Å; Q28-Y30 PolarHBondContact OE1-OH 3.05Å
31L96.1Very high97.3Very high21 Ų2156.8 Ų56.811%0.1128%0.275CS..THydrogen-bonded Turntrans-80.7-32.7175.2-67.9-178.4000112.2V11 M13 Q28 Y29 Q184 P285V11-L31 HydrophobicContact CG1-CD1 4.1Å; V11-L31 HydrophobicContact CG1-CD2 3.78Å; V11-L31 HydrophobicContact CG1-CG 4.39Å; M13-L31 HydrophobicContact CB-CD2 3.64Å; M13-L31 HydrophobicContact CG-CD2 4.38Å; M13-L31 HydrophobicContact SD-CD2 3.94Å; Q28-L31 HydrophobicContact CB-CD1 4Å; Q28-L31 HydrophobicContact CB-CG 4.41Å; Q28-L31 VanDerWaalsContact O-CB 3.31Å; Q28-L31 WeakPolarHBondContact O-CB 3.39Å; Q28-L31 PolarHBondContact O-N 3.49Å; Y29-L31 VanDerWaalsContact C-N 3.34Å; L31-Q184 HydrophobicContact CD1-CG 3.53Å; L31-P285 HydrophobicContact CB-CB 4.22Å; L31-P285 HydrophobicContact CB-CG 3.99Å; L31-P285 HydrophobicContact CD1-CB 4.47Å; L31-P285 VanDerWaalsContact O-CG 3.28Å; L31-P285 WeakPolarHBondContact O-CG 3.31Å
32A96.1Very high97.4Very high10 Ų1054 Ų548%0.08328%0.276CS..SBendtrans-160.6153.1-176.100000110.2Y29 K36 Y37 M183Y29-A32 CarbonylContact C-O 3.36Å; Y29-A32 WeakPolarHBondContact CA-O 3.15Å; A32-K36 HydrophobicContact CB-CB 4.42Å; A32-K36 HydrophobicContact CB-CD 3.87Å; A32-Y37 HydrophobicContact CB-CE2 3.91Å; A32-Y37 WeakPolarHBondContact O-CE2 3.4Å; A32-M183 HydrophobicContact CB-CE 3.63Å; A32-M183 HydrophobicContact CB-CG 4.16Å; A32-M183 HydrophobicContact CB-SD 3.98Å
33E96.5Very high97.4Very high102 Ų10256.2 Ų56.248%0.47728%0.283SS..  trans-60.1142179.4-62.3168.6131.200111.5W35 K36E33-W35 VanDerWaalsContact CB-CD1 3.45Å; E33-W35 HydrophobicContact CB-CG 4.44Å; E33-W35 PolarHBondContact O-N 3.12Å; E33-W35 VanDerWaalsContact O-N 3.08Å; E33-W35 PolarHBondContact OE2-NE1 3.47Å; E33-K36 HydrophobicContact CB-CD 4.49Å; E33-K36 VanDerWaalsContact O-CB 3.32Å; E33-K36 WeakPolarHBondContact O-CB 3.15Å; E33-K36 PolarHBondContact O-N 3.34Å; E33-K36 WeakPolarHBondContact OE2-CE 3.41Å; E33-K36 IonicContact OE2-NZ 3.82Å
34P96.9Very high97.4Very high71 Ų7156.2 Ų56.246%0.46128%0.283SS..Hα-helixtrans-52.7-34.6-176-30.135.2000115.1Y29 K36 Y37 S38Y29-P34 HydrophobicContact CD1-CB 4.07Å; Y29-P34 HydrophobicContact CD1-CG 4Å; Y29-P34 HydrophobicContact CE1-CB 4.18Å; Y29-P34 HydrophobicContact CG-CG 4.06Å; P34-K36 PolarHBondContact O-N 2.98Å; P34-Y37 WeakPolarHBondContact O-CB 3.31Å; P34-Y37 PolarHBondContact O-N 2.75Å; P34-S38 PolarHBondContact O-N 2.95Å; P34-S38 VanDerWaalsContact O-N 3.14Å; P34-S38 PolarHBondContact O-OG 3.21Å
35W97Very high97.4Very high145 Ų14558.8 Ų58.855%0.54930%0.297SS..Hα-helixtrans-62.8-26.4178.471.7-96.7000112.9E33 Y37 S38 L39E33-W35 VanDerWaalsContact CB-CD1 3.45Å; E33-W35 HydrophobicContact CB-CG 4.44Å; E33-W35 PolarHBondContact O-N 3.12Å; E33-W35 VanDerWaalsContact O-N 3.08Å; E33-W35 PolarHBondContact OE2-NE1 3.47Å; W35-Y37 VanDerWaalsContact C-N 3.34Å; W35-S38 PolarHBondContact O-N 3.28Å; W35-L39 HydrophobicContact CZ3-CD2 4.1Å; W35-L39 WeakPolarHBondContact O-CB 3.23Å; W35-L39 PolarHBondContact O-N 3.22Å
36K97.1Very high97.5Very high64 Ų6457.8 Ų57.828%0.27829%0.291SS..Hα-helixtrans-68.3-36175.2-62.3176.5-178.5171.10111A32 E33 P34 L39 L40 M183A32-K36 HydrophobicContact CB-CB 4.42Å; A32-K36 HydrophobicContact CB-CD 3.87Å; E33-K36 HydrophobicContact CB-CD 4.49Å; E33-K36 VanDerWaalsContact O-CB 3.32Å; E33-K36 WeakPolarHBondContact O-CB 3.15Å; E33-K36 PolarHBondContact O-N 3.34Å; E33-K36 WeakPolarHBondContact OE2-CE 3.41Å; E33-K36 IonicContact OE2-NZ 3.82Å; P34-K36 PolarHBondContact O-N 2.98Å; K36-L39 WeakPolarHBondContact O-CB 3.27Å; K36-L39 PolarHBondContact O-N 2.94Å; K36-L40 WeakPolarHBondContact O-CG 3.47Å; K36-L40 PolarHBondContact O-N 3.17Å; K36-M183 HydrophobicContact CB-CE 3.76Å; K36-M183 HydrophobicContact CB-SD 4.46Å
37Y97.8Very high97.5Very high2 Ų253.8 Ų53.81%0.00827%0.273CS..Hα-helixtrans-67.6-42.7172.8-68.3-93.6000111.2Q28 Y29 A32 P34 W35 L39 L40 A41 M183 C185Q28-Y37 WeakPolarHBondContact CB-OH 3.38Å; Q28-Y37 PolarHBondContact O-OH 3.4Å; Y29-Y37 AromaticContact CD1-CD2 3.6Å; Y29-Y37 HydrophobicContact CD1-CD2 3.6Å; Y29-Y37 AromaticContact CD1-CE2 3.77Å; Y29-Y37 HydrophobicContact CD1-CE2 3.77Å; Y29-Y37 HydrophobicContact CD1-CG 4.17Å; Y29-Y37 HydrophobicContact CE1-CD1 4.49Å; Y29-Y37 AromaticContact CE1-CD2 3.8Å; Y29-Y37 HydrophobicContact CE1-CD2 3.8Å; Y29-Y37 HydrophobicContact CE1-CE2 4.34Å; Y29-Y37 AromaticContact CE1-CG 3.9Å; Y29-Y37 HydrophobicContact CE1-CG 3.9Å; A32-Y37 HydrophobicContact CB-CE2 3.91Å; A32-Y37 WeakPolarHBondContact O-CE2 3.4Å; P34-Y37 WeakPolarHBondContact O-CB 3.31Å; P34-Y37 PolarHBondContact O-N 2.75Å; W35-Y37 VanDerWaalsContact C-N 3.34Å; Y37-L39 VanDerWaalsContact C-N 3.28Å; Y37-L39 PolarHBondContact O-N 3.45Å; Y37-L40 PolarHBondContact O-N 2.69Å; Y37-A41 PolarHBondContact O-N 3.44Å; Y37-M183 HydrophobicContact CD1-CE 3.95Å; Y37-M183 HydrophobicContact CD2-CE 3.62Å; Y37-M183 HydrophobicContact CE1-CB 4.23Å; Y37-M183 HydrophobicContact CE1-CE 3.83Å; Y37-M183 WeakPolarHBondContact CE1-O 3.27Å; Y37-M183 HydrophobicContact CE2-CE 3.48Å; Y37-M183 VanDerWaalsContact CE2-CE 3.48Å; Y37-M183 HydrophobicContact CG-CE 3.85Å; Y37-M183 PolarHBondContact OH-O 3.43Å; Y37-M183 VanDerWaalsContact OH-O 3.11Å; Y37-C185 WeakPolarHBondContact CD1-SG 3.2Å; Y37-C185 WeakPolarHBondContact CE1-SG 3.18Å
38S97.8Very high97.5Very high77 Ų7752.8 Ų52.854%0.53826%0.264SS..Hα-helixtrans-60.3-37.6172.6-51.30000112.3P34 W35 A41 A42P34-S38 PolarHBondContact O-N 2.95Å; P34-S38 VanDerWaalsContact O-N 3.14Å; P34-S38 PolarHBondContact O-OG 3.21Å; W35-S38 PolarHBondContact O-N 3.28Å; S38-A41 PolarHBondContact O-N 3.07Å; S38-A42 WeakPolarHBondContact O-CB 3.32Å; S38-A42 PolarHBondContact O-N 2.92Å
39L97.8Very high97.5Very high105 Ų10557.8 Ų57.855%0.5529%0.29SS..Hα-helixtrans-64.5-44.4174.4-179.864.6000111.7W35 K36 Y37 A41 A42 Y43W35-L39 HydrophobicContact CZ3-CD2 4.1Å; W35-L39 WeakPolarHBondContact O-CB 3.23Å; W35-L39 PolarHBondContact O-N 3.22Å; K36-L39 WeakPolarHBondContact O-CB 3.27Å; K36-L39 PolarHBondContact O-N 2.94Å; Y37-L39 VanDerWaalsContact C-N 3.28Å; Y37-L39 PolarHBondContact O-N 3.45Å; L39-A41 VanDerWaalsContact C-N 3.34Å; L39-A41 PolarHBondContact O-N 3.36Å; L39-A42 PolarHBondContact O-N 3.01Å; L39-Y43 WeakPolarHBondContact O-CB 3.44Å; L39-Y43 PolarHBondContact O-N 3.49Å
40L97.6Very high97.4Very high20 Ų2055.6 Ų55.611%0.10529%0.286CS..Hα-helixtrans-61.2-42.8174.3-68.2178.4000111.4K36 Y37 Y43 M44 A98 M183 C185 T289 F293K36-L40 WeakPolarHBondContact O-CG 3.47Å; K36-L40 PolarHBondContact O-N 3.17Å; Y37-L40 PolarHBondContact O-N 2.69Å; L40-Y43 PolarHBondContact O-N 2.84Å; L40-M44 WeakPolarHBondContact O-CG 3.44Å; L40-M44 PolarHBondContact O-N 2.93Å; L40-A98 HydrophobicContact CB-CB 4.22Å; L40-M183 HydrophobicContact CD1-CB 4.49Å; L40-M183 HydrophobicContact CD1-CE 3.81Å; L40-M183 HydrophobicContact CD1-SD 3.96Å; L40-C185 HydrophobicContact CD1-CB 4.47Å; L40-T289 HydrophobicContact CD1-CG2 3.9Å; L40-T289 HydrophobicContact CD2-CG2 3.95Å; L40-F293 HydrophobicContact CB-CE1 4.12Å; L40-F293 HydrophobicContact CB-CZ 4.38Å; L40-F293 HydrophobicContact CD1-CE1 4.42Å; L40-F293 HydrophobicContact CD1-CE2 4.16Å; L40-F293 HydrophobicContact CD1-CZ 3.95Å; L40-F293 HydrophobicContact CD2-CD1 3.78Å; L40-F293 HydrophobicContact CD2-CD2 4.14Å; L40-F293 HydrophobicContact CD2-CE1 3.86Å; L40-F293 HydrophobicContact CD2-CE2 4.22Å; L40-F293 HydrophobicContact CD2-CG 3.91Å; L40-F293 HydrophobicContact CD2-CZ 4.09Å; L40-F293 HydrophobicContact CG-CE1 4.35Å; L40-F293 HydrophobicContact CG-CZ 4.37Å
41A98.3Very high97.4Very high5 Ų553 Ų534%0.04128%0.276CS..Hα-helixtrans-61.7-46.717600000111.6Y37 S38 L39 Y43 M44 L45 L95 A98 L99Y37-A41 PolarHBondContact O-N 3.44Å; S38-A41 PolarHBondContact O-N 3.07Å; L39-A41 VanDerWaalsContact C-N 3.34Å; L39-A41 PolarHBondContact O-N 3.36Å; A41-Y43 VanDerWaalsContact C-N 3.31Å; A41-Y43 PolarHBondContact O-N 3.21Å; A41-M44 PolarHBondContact O-N 3.4Å; A41-L45 WeakPolarHBondContact O-CB 3.3Å; A41-L45 PolarHBondContact O-N 3.31Å; A41-L95 HydrophobicContact CB-CD1 4.05Å; A41-L95 WeakPolarHBondContact O-CD1 3.34Å; A41-A98 HydrophobicContact CB-CB 3.91Å; A41-L99 HydrophobicContact CB-CD2 3.76Å; A41-L99 HydrophobicContact CB-CG 4.03Å
42A98.4Very high97.4Very high56 Ų5656.2 Ų56.246%0.46329%0.289SS..Hα-helixtrans-60.7-40.4176.200000112.1S38 L39 L45 F46S38-A42 WeakPolarHBondContact O-CB 3.32Å; S38-A42 PolarHBondContact O-N 2.92Å; L39-A42 PolarHBondContact O-N 3.01Å; A42-L45 PolarHBondContact O-N 2.91Å; A42-F46 WeakPolarHBondContact O-CB 3.42Å; A42-F46 PolarHBondContact O-N 3.35Å
43Y98.3Very high97.4Very high63 Ų6359 Ų5925%0.24731%0.306CS..Hα-helixtrans-64.5-46.5175.8174.1-106.3000112.5L39 L40 A41 L45 F46 L47 F293 S297L39-Y43 WeakPolarHBondContact O-CB 3.44Å; L39-Y43 PolarHBondContact O-N 3.49Å; L40-Y43 PolarHBondContact O-N 2.84Å; A41-Y43 VanDerWaalsContact C-N 3.31Å; A41-Y43 PolarHBondContact O-N 3.21Å; Y43-L45 VanDerWaalsContact C-N 3.32Å; Y43-L45 PolarHBondContact O-N 3.4Å; Y43-F46 WeakPolarHBondContact O-CB 3.42Å; Y43-F46 PolarHBondContact O-N 3.08Å; Y43-L47 HydrophobicContact CD1-CD1 4.21Å; Y43-L47 HydrophobicContact CE1-CD1 3.5Å; Y43-L47 HydrophobicContact CE1-CG 4.12Å; Y43-L47 HydrophobicContact CE2-CD1 4.37Å; Y43-L47 HydrophobicContact CE2-CD2 4.29Å; Y43-L47 HydrophobicContact CE2-CG 4.2Å; Y43-L47 PolarHBondContact O-N 2.74Å; Y43-F293 HydrophobicContact CD1-CB 4.48Å; Y43-F293 AromaticContact CD1-CD1 3.96Å; Y43-F293 HydrophobicContact CD1-CD1 3.96Å; Y43-F293 HydrophobicContact CE1-CB 4.05Å; Y43-F293 HydrophobicContact CE1-CD1 4.16Å; Y43-F293 PolarHBondContact OH-O 3.46Å; Y43-F293 VanDerWaalsContact OH-O 3.1Å; Y43-S297 WeakPolarHBondContact OH-CB 3.4Å
44M98.3Very high97.3Very high0 Ų055.7 Ų55.70%029%0.291CS..Hα-helixtrans-64.1-38.5176.6-67.9-48.8-62.200111.8L40 A41 L47 I48 F91 T94 L95 F293 K296L40-M44 WeakPolarHBondContact O-CG 3.44Å; L40-M44 PolarHBondContact O-N 2.93Å; A41-M44 PolarHBondContact O-N 3.4Å; M44-L47 HydrophobicContact CE-CD1 4.39Å; M44-L47 PolarHBondContact O-N 2.83Å; M44-L47 HydrophobicContact SD-CD1 4.15Å; M44-I48 WeakPolarHBondContact O-CD1 3.41Å; M44-I48 VanDerWaalsContact O-CG1 3.27Å; M44-I48 WeakPolarHBondContact O-CG1 3.35Å; M44-I48 PolarHBondContact O-N 3.12Å; M44-F91 HydrophobicContact CE-CB 3.57Å; M44-F91 HydrophobicContact CE-CD1 3.46Å; M44-F91 VanDerWaalsContact CE-CD1 3.46Å; M44-F91 HydrophobicContact CE-CD2 4.04Å; M44-F91 HydrophobicContact CE-CE1 4.13Å; M44-F91 HydrophobicContact CE-CG 3.42Å; M44-F91 VanDerWaalsContact CE-CG 3.42Å; M44-T94 HydrophobicContact CE-CG2 3.92Å; M44-T94 HydrophobicContact CG-CG2 3.76Å; M44-T94 HydrophobicContact SD-CG2 3.94Å; M44-L95 HydrophobicContact CB-CB 4.06Å; M44-L95 HydrophobicContact CB-CD1 4.33Å; M44-F293 HydrophobicContact CG-CD1 4.22Å; M44-F293 HydrophobicContact CG-CE1 3.75Å; M44-F293 HydrophobicContact SD-CD1 3.61Å; M44-F293 HydrophobicContact SD-CE1 3.63Å; M44-K296 HydrophobicContact CE-CD 3.78Å; M44-K296 HydrophobicContact SD-CD 3.98Å
45L98.3Very high97.1Very high80 Ų8052.3 Ų52.342%0.41927%0.269SS..Hα-helixtrans-61.9-45.2173.9-177.163.1000111.2A41 A42 Y43 L47 I48 I49 L95A41-L45 WeakPolarHBondContact O-CB 3.3Å; A41-L45 PolarHBondContact O-N 3.31Å; A42-L45 PolarHBondContact O-N 2.91Å; Y43-L45 VanDerWaalsContact C-N 3.32Å; Y43-L45 PolarHBondContact O-N 3.4Å; L45-L47 VanDerWaalsContact C-N 3.35Å; L45-L47 PolarHBondContact O-N 3.3Å; L45-I48 PolarHBondContact O-N 3.28Å; L45-I49 HydrophobicContact CD1-CD1 3.69Å; L45-I49 HydrophobicContact CD1-CG1 4.1Å; L45-I49 HydrophobicContact CD2-CD1 4.36Å; L45-I49 HydrophobicContact CG-CD1 3.64Å; L45-I49 HydrophobicContact CG-CG1 4.39Å; L45-I49 VanDerWaalsContact O-CG1 3.24Å; L45-I49 WeakPolarHBondContact O-CG1 3.47Å; L45-I49 PolarHBondContact O-N 3.49Å; L45-L95 HydrophobicContact CB-CD1 4.17Å; L45-L95 HydrophobicContact CD1-CD2 4.12Å
46F98.1Very high97Very high108 Ų10850.5 Ų50.547%0.47427%0.266SS..Hα-helixtrans-56.3-48173.2163.7-97.2000111.7A42 Y43 I48 I49 T50 L300A42-F46 WeakPolarHBondContact O-CB 3.42Å; A42-F46 PolarHBondContact O-N 3.35Å; Y43-F46 WeakPolarHBondContact O-CB 3.42Å; Y43-F46 PolarHBondContact O-N 3.08Å; F46-I48 PolarHBondContact O-N 3.36Å; F46-I49 PolarHBondContact O-N 2.93Å; F46-T50 HydrophobicContact CD2-CG2 3.94Å; F46-T50 HydrophobicContact CE2-CG2 3.65Å; F46-T50 HydrophobicContact CZ-CG2 4.17Å; F46-T50 WeakPolarHBondContact O-CB 3.3Å; F46-T50 WeakPolarHBondContact O-CG2 3.36Å; F46-T50 PolarHBondContact O-N 2.93Å; F46-T50 PolarHBondContact O-OG1 3.12Å; F46-L300 HydrophobicContact CE1-CD2 3.76Å; F46-L300 HydrophobicContact CZ-CD2 3.87Å
47L97.8Very high96.8Very high1 Ų149.7 Ų49.71%0.00526%0.264CS..Hα-helixtrans-60.6-44.6177.4-71.1-175.1000111.7Y43 M44 L45 T50 A51 F91 K296 L300Y43-L47 HydrophobicContact CD1-CD1 4.21Å; Y43-L47 HydrophobicContact CE1-CD1 3.5Å; Y43-L47 HydrophobicContact CE1-CG 4.12Å; Y43-L47 HydrophobicContact CE2-CD1 4.37Å; Y43-L47 HydrophobicContact CE2-CD2 4.29Å; Y43-L47 HydrophobicContact CE2-CG 4.2Å; Y43-L47 PolarHBondContact O-N 2.74Å; M44-L47 HydrophobicContact CE-CD1 4.39Å; M44-L47 PolarHBondContact O-N 2.83Å; M44-L47 HydrophobicContact SD-CD1 4.15Å; L45-L47 VanDerWaalsContact C-N 3.35Å; L45-L47 PolarHBondContact O-N 3.3Å; L47-T50 PolarHBondContact O-N 3.48Å; L47-T50 PolarHBondContact O-OG1 3.41Å; L47-A51 WeakPolarHBondContact O-CA 3.35Å; L47-A51 WeakPolarHBondContact O-CB 3.35Å; L47-A51 PolarHBondContact O-N 2.97Å; L47-F91 HydrophobicContact CB-CD2 4.24Å; L47-F91 HydrophobicContact CB-CE2 4.18Å; L47-F91 HydrophobicContact CD1-CE2 4.24Å; L47-K296 HydrophobicContact CD1-CB 4.06Å; L47-L300 HydrophobicContact CD2-CB 4.28Å; L47-L300 HydrophobicContact CD2-CD2 4.26Å
48I98.1Very high96.4Very high30 Ų3049.9 Ų49.915%0.15427%0.265CS..Hα-helixtrans-62.4-49.1179.5-68.8161.6000110.8M44 L45 F46 T50 F52 I87 F91 L95M44-I48 WeakPolarHBondContact O-CD1 3.41Å; M44-I48 VanDerWaalsContact O-CG1 3.27Å; M44-I48 WeakPolarHBondContact O-CG1 3.35Å; M44-I48 PolarHBondContact O-N 3.12Å; L45-I48 PolarHBondContact O-N 3.28Å; F46-I48 PolarHBondContact O-N 3.36Å; I48-T50 VanDerWaalsContact C-N 3.27Å; I48-T50 PolarHBondContact O-N 3.01Å; I48-F52 WeakPolarHBondContact O-CB 3.44Å; I48-F52 PolarHBondContact O-N 2.96Å; I48-F52 VanDerWaalsContact O-N 3.1Å; I48-I87 HydrophobicContact CG1-CG2 4.27Å; I48-I87 HydrophobicContact CG2-CG2 4.34Å; I48-F91 HydrophobicContact CD1-CB 3.97Å; I48-F91 HydrophobicContact CG1-CB 3.68Å; I48-F91 HydrophobicContact CG1-CD2 4.3Å; I48-L95 HydrophobicContact CD1-CB 4.11Å; I48-L95 HydrophobicContact CD1-CD2 3.79Å
49I97.7Very high96.1Very high106 Ų10648.3 Ų48.354%0.54425%0.251SS..Hα-helixtrans-67.9-29-175.4-60.9167.4000111.6L45 F46 P53L45-I49 HydrophobicContact CD1-CD1 3.69Å; L45-I49 HydrophobicContact CD1-CG1 4.1Å; L45-I49 HydrophobicContact CD2-CD1 4.36Å; L45-I49 HydrophobicContact CG-CD1 3.64Å; L45-I49 HydrophobicContact CG-CG1 4.39Å; L45-I49 VanDerWaalsContact O-CG1 3.24Å; L45-I49 WeakPolarHBondContact O-CG1 3.47Å; L45-I49 PolarHBondContact O-N 3.49Å; F46-I49 PolarHBondContact O-N 2.93Å; I49-P53 WeakPolarHBondContact O-CD 3.42Å; I49-P53 WeakPolarHBondContact O-CG 3.31Å
50T96Very high95.8Very high46 Ų4647.3 Ų47.328%0.28224%0.243SC..Hα-helixtrans-95.2-41.8-17956.40000113.4F46 L47 I48 I54 L300F46-T50 HydrophobicContact CD2-CG2 3.94Å; F46-T50 HydrophobicContact CE2-CG2 3.65Å; F46-T50 HydrophobicContact CZ-CG2 4.17Å; F46-T50 WeakPolarHBondContact O-CB 3.3Å; F46-T50 WeakPolarHBondContact O-CG2 3.36Å; F46-T50 PolarHBondContact O-N 2.93Å; F46-T50 PolarHBondContact O-OG1 3.12Å; L47-T50 PolarHBondContact O-N 3.48Å; L47-T50 PolarHBondContact O-OG1 3.41Å; I48-T50 VanDerWaalsContact C-N 3.27Å; I48-T50 PolarHBondContact O-N 3.01Å; T50-I54 WeakPolarHBondContact O-CG2 3.46Å; T50-L300 WeakPolarHBondContact OG1-CD2 3.38Å
51A96.1Very high95.4Very high0 Ų046.4 Ų46.40%024%0.238CC..Hα-helixtrans-77.1-33.3-17700000112.5L47 I54 N55 I87 A299 L300L47-A51 WeakPolarHBondContact O-CA 3.35Å; L47-A51 WeakPolarHBondContact O-CB 3.35Å; L47-A51 PolarHBondContact O-N 2.97Å; A51-I54 WeakPolarHBondContact O-CG2 3.39Å; A51-N55 WeakPolarHBondContact O-CB 3.27Å; A51-N55 PolarHBondContact O-N 3.33Å; A51-N55 VanDerWaalsContact O-N 3.13Å; A51-N55 PolarHBondContact O-ND2 3.47Å; A51-I87 HydrophobicContact CB-CD1 3.65Å; A51-I87 HydrophobicContact CB-CG1 4.27Å; A51-A299 HydrophobicContact CB-CB 4.25Å; A51-L300 HydrophobicContact CB-CB 4.15Å; A51-L300 HydrophobicContact CB-CD1 4.41Å
52F96.5Very high94.9Very high89 Ų8946.4 Ų46.439%0.3924%0.238SC..Hα-helixtrans-63.7-52179.5-177.2-87.8000112I48 I54 N55 F56 L84 I87 V88I48-F52 WeakPolarHBondContact O-CB 3.44Å; I48-F52 PolarHBondContact O-N 2.96Å; I48-F52 VanDerWaalsContact O-N 3.1Å; F52-I54 PolarHBondContact O-N 3.4Å; F52-N55 PolarHBondContact O-N 3.25Å; F52-F56 VanDerWaalsContact O-CB 3.28Å; F52-F56 WeakPolarHBondContact O-CB 3.14Å; F52-F56 PolarHBondContact O-N 3.23Å; F52-L84 HydrophobicContact CD2-CD2 3.71Å; F52-L84 HydrophobicContact CE2-CD2 3.82Å; F52-L84 HydrophobicContact CG-CD2 4.39Å; F52-I87 HydrophobicContact CB-CG2 4.19Å; F52-I87 HydrophobicContact CD2-CG2 4.22Å; F52-V88 HydrophobicContact CD2-CG2 4.4Å; F52-V88 HydrophobicContact CE2-CG2 4.07Å
53P95.3Very high94.4Very high69 Ų6947.8 Ų47.845%0.44824%0.241SC..Hα-helixtrans-63.7-39.4-178.6-23.536.1000113.1I49 L57I49-P53 WeakPolarHBondContact O-CD 3.42Å; I49-P53 WeakPolarHBondContact O-CG 3.31Å; P53-L57 WeakPolarHBondContact O-CB 3.31Å; P53-L57 PolarHBondContact O-N 3.03Å
54I93.4Very high93.9Very high32 Ų3250.6 Ų50.616%0.16425%0.254CS..Hα-helixtrans-69.9-39-177.6-165.1168.1000112.2T50 A51 F52 T58 L300 P303 V304 I307T50-I54 WeakPolarHBondContact O-CG2 3.46Å; A51-I54 WeakPolarHBondContact O-CG2 3.39Å; F52-I54 PolarHBondContact O-N 3.4Å; I54-T58 VanDerWaalsContact O-CB 3.32Å; I54-T58 WeakPolarHBondContact O-CB 3.47Å; I54-T58 PolarHBondContact O-N 3.24Å; I54-T58 PolarHBondContact O-OG1 3.28Å; I54-L300 HydrophobicContact CG2-CD1 4.28Å; I54-P303 HydrophobicContact CD1-CB 4.07Å; I54-P303 HydrophobicContact CG1-CB 3.91Å; I54-P303 HydrophobicContact CG2-CB 4.19Å; I54-P303 HydrophobicContact CG2-CG 4.34Å; I54-V304 HydrophobicContact CD1-CG2 3.5Å; I54-I307 HydrophobicContact CD1-CD1 3.73Å; I54-I307 HydrophobicContact CG1-CD1 3.62Å
55N94.6Very high93.4Very high0 Ų052.6 Ų52.60%026%0.263CS..Hα-helixtrans-70.1-43.3174.9-78.1-66.7000111.6A51 F52 L57 T58 L59 A80 D83 L84 A299 P303A51-N55 WeakPolarHBondContact O-CB 3.27Å; A51-N55 PolarHBondContact O-N 3.33Å; A51-N55 VanDerWaalsContact O-N 3.13Å; A51-N55 PolarHBondContact O-ND2 3.47Å; F52-N55 PolarHBondContact O-N 3.25Å; N55-L57 PolarHBondContact O-N 3.2Å; N55-T58 WeakPolarHBondContact O-CB 3.44Å; N55-T58 PolarHBondContact O-N 2.83Å; N55-L59 PolarHBondContact O-N 3.27Å; N55-A80 HydrophobicContact CB-CB 4.45Å; N55-A80 WeakPolarHBondContact OD1-CA 3.33Å; N55-D83 HydrophobicContact CB-CB 4.5Å; N55-D83 WeakPolarHBondContact OD1-CB 3.11Å; N55-D83 PolarHBondContact OD1-OD2 2.96Å; N55-L84 HydrophobicContact CB-CD2 4.03Å; N55-L84 HydrophobicContact CB-CG 3.95Å; N55-A299 PolarHBondContact ND2-O 3.29Å; N55-P303 WeakPolarHBondContact OD1-CG 3.38Å
56F94.3Very high92.7Very high108 Ų10856.4 Ų56.447%0.47428%0.277SS..Hα-helixtrans-61.2-43.9175.4-177.1-96.3000112.1F52 T58 L59 H60 L84F52-F56 VanDerWaalsContact O-CB 3.28Å; F52-F56 WeakPolarHBondContact O-CB 3.14Å; F52-F56 PolarHBondContact O-N 3.23Å; F56-T58 VanDerWaalsContact C-N 3.32Å; F56-T58 PolarHBondContact O-N 3.19Å; F56-L59 WeakPolarHBondContact O-CB 3.46Å; F56-L59 PolarHBondContact O-N 3.48Å; F56-H60 WeakPolarHBondContact O-CB 3.26Å; F56-H60 PolarHBondContact O-N 3.49Å; F56-L84 HydrophobicContact CB-CD2 4.49Å
57L92Very high91.9Very high46 Ų4659.3 Ų59.324%0.24129%0.289CS..Hα-helixtrans-64.3-39.4176.2-174.863.9000111.2P53 N55 L59 H60 V61 M317 V321P53-L57 WeakPolarHBondContact O-CB 3.31Å; P53-L57 PolarHBondContact O-N 3.03Å; N55-L57 PolarHBondContact O-N 3.2Å; L57-L59 VanDerWaalsContact C-N 3.35Å; L57-L59 PolarHBondContact O-N 3.24Å; L57-H60 PolarHBondContact O-N 3.37Å; L57-V61 HydrophobicContact CD1-CG2 3.9Å; L57-V61 HydrophobicContact CG-CG2 4.08Å; L57-V61 WeakPolarHBondContact O-CB 3.25Å; L57-V61 WeakPolarHBondContact O-CG2 3.25Å; L57-V61 PolarHBondContact O-N 3.12Å; L57-M317 HydrophobicContact CB-CE 4.35Å; L57-M317 HydrophobicContact CD2-CE 3.81Å; L57-M317 HydrophobicContact CD2-CG 3.75Å; L57-M317 HydrophobicContact CD2-SD 3.88Å; L57-M317 HydrophobicContact CG-CE 3.81Å; L57-M317 HydrophobicContact CG-CG 4.23Å; L57-M317 HydrophobicContact CG-SD 4.48Å; L57-V321 HydrophobicContact CD1-CG2 4.28Å; L57-V321 HydrophobicContact CD2-CG2 3.81Å
58T90.6Very high91.1Very high6 Ų659.2 Ų59.24%0.03729%0.289CS..Hα-helixtrans-59.9-46.5176.6-64.40000111.2I54 N55 F56 T62 A80 F313I54-T58 VanDerWaalsContact O-CB 3.32Å; I54-T58 WeakPolarHBondContact O-CB 3.47Å; I54-T58 PolarHBondContact O-N 3.24Å; I54-T58 PolarHBondContact O-OG1 3.28Å; N55-T58 WeakPolarHBondContact O-CB 3.44Å; N55-T58 PolarHBondContact O-N 2.83Å; F56-T58 VanDerWaalsContact C-N 3.32Å; F56-T58 PolarHBondContact O-N 3.19Å; T58-T62 WeakPolarHBondContact O-CB 3.34Å; T58-T62 PolarHBondContact O-N 2.98Å; T58-T62 PolarHBondContact O-OG1 3.4Å; T58-A80 HydrophobicContact CG2-CB 3.94Å; T58-F313 HydrophobicContact CG2-CE1 4.27Å; T58-F313 HydrophobicContact CG2-CZ 3.7Å
59L90.9Very high90.3Very high45 Ų4563.8 Ų63.824%0.23630%0.304CS..Hα-helixtrans-58.6-52.8173.5176.461.1000111.3N55 F56 L57 V61 T62 V63 L77 V81 L84N55-L59 PolarHBondContact O-N 3.27Å; F56-L59 WeakPolarHBondContact O-CB 3.46Å; F56-L59 PolarHBondContact O-N 3.48Å; L57-L59 VanDerWaalsContact C-N 3.35Å; L57-L59 PolarHBondContact O-N 3.24Å; L59-V61 PolarHBondContact O-N 2.92Å; L59-T62 PolarHBondContact O-N 3.41Å; L59-V63 HydrophobicContact CD1-CG2 4.38Å; L59-V63 WeakPolarHBondContact O-CG2 3.42Å; L59-V63 PolarHBondContact O-N 2.9Å; L59-V63 VanDerWaalsContact O-N 3.13Å; L59-L77 HydrophobicContact CD1-CD1 3.38Å; L59-L77 HydrophobicContact CD1-CG 4.19Å; L59-V81 HydrophobicContact CD1-CG2 4.12Å; L59-L84 HydrophobicContact CD2-CD1 3.97Å
60H90.8Very high89.3Confident84 Ų8461.1 Ų61.139%0.38929%0.292SS..Hα-helixtrans-60.5-47.1-177.3-178.574.5000113F56 L57 T62 V63 K64F56-H60 WeakPolarHBondContact O-CB 3.26Å; F56-H60 PolarHBondContact O-N 3.49Å; L57-H60 PolarHBondContact O-N 3.37Å; H60-T62 PolarHBondContact O-N 3.45Å; H60-V63 PolarHBondContact O-N 3.48Å; H60-K64 VanDerWaalsContact O-CB 3.29Å; H60-K64 WeakPolarHBondContact O-CB 3.24Å; H60-K64 PolarHBondContact O-N 2.93Å
61V90.1Very high88.1Confident0 Ų060.8 Ų60.80%029%0.291CS..Hα-helixtrans-63.3-43-179170.10000110.9L57 L59 V63 K64 H65 L68 F313 C316 M317 T320L57-V61 HydrophobicContact CD1-CG2 3.9Å; L57-V61 HydrophobicContact CG-CG2 4.08Å; L57-V61 WeakPolarHBondContact O-CB 3.25Å; L57-V61 WeakPolarHBondContact O-CG2 3.25Å; L57-V61 PolarHBondContact O-N 3.12Å; L59-V61 PolarHBondContact O-N 2.92Å; V61-V63 PolarHBondContact O-N 2.89Å; V61-K64 PolarHBondContact O-N 3.3Å; V61-H65 PolarHBondContact O-CD2 2.99Å; V61-H65 PolarHBondContact O-N 3.31Å; V61-L68 HydrophobicContact CG1-CD1 3.73Å; V61-F313 HydrophobicContact CB-CZ 4.37Å; V61-F313 HydrophobicContact CG1-CE2 4.24Å; V61-F313 HydrophobicContact CG1-CZ 4.24Å; V61-C316 HydrophobicContact CG1-CB 3.99Å; V61-M317 HydrophobicContact CG1-CB 4.38Å; V61-M317 HydrophobicContact CG2-CB 4.29Å; V61-M317 HydrophobicContact CG2-CG 4.34Å; V61-T320 HydrophobicContact CG2-CG2 4.02Å
62T87.4Confident86.9Confident6 Ų661.7 Ų61.74%0.03730%0.296CS..Hα-helixtrans-64.2-41.7180-520000111.8T58 L59 H60 L68 N73 L77 F313T58-T62 WeakPolarHBondContact O-CB 3.34Å; T58-T62 PolarHBondContact O-N 2.98Å; T58-T62 PolarHBondContact O-OG1 3.4Å; L59-T62 PolarHBondContact O-N 3.41Å; H60-T62 PolarHBondContact O-N 3.45Å; T62-L68 HydrophobicContact CG2-CB 4.48Å; T62-N73 HydrophobicContact CG2-CB 4.48Å; T62-L77 HydrophobicContact CG2-CB 4.42Å; T62-L77 HydrophobicContact CG2-CD1 3.95Å; T62-F313 WeakPolarHBondContact OG1-CE2 3.19Å
63V87.5Confident86.1Confident85 Ų8557.4 Ų57.452%0.51528%0.277SS..Hα-helixtrans-67.1-43.9177.9172.60000111.2L59 H60 V61 R69 L77L59-V63 HydrophobicContact CD1-CG2 4.38Å; L59-V63 WeakPolarHBondContact O-CG2 3.42Å; L59-V63 PolarHBondContact O-N 2.9Å; L59-V63 VanDerWaalsContact O-N 3.13Å; H60-V63 PolarHBondContact O-N 3.48Å; V61-V63 PolarHBondContact O-N 2.89Å; V63-R69 PolarHBondContact O-NH2 2.93Å; V63-L77 HydrophobicContact CG2-CD1 4.36Å
64K88.8Confident85.5Confident122 Ų12255.6 Ų55.653%0.5326%0.262SS..Hα-helixtrans-65.6-43.7-177.6-174.7176.2-176.2175.60112.7H60 V61 T320H60-K64 VanDerWaalsContact O-CB 3.29Å; H60-K64 WeakPolarHBondContact O-CB 3.24Å; H60-K64 PolarHBondContact O-N 2.93Å; V61-K64 PolarHBondContact O-N 3.3Å; K64-T320 HydrophobicContact CD-CG2 4.21Å
65H86.6Confident84.9Confident42 Ų4254.4 Ų54.419%0.19426%0.256CS..  trans-98100.4-173.8-70-87.5000111.7V61 K67 L68 C316 T320V61-H65 PolarHBondContact O-CD2 2.99Å; V61-H65 PolarHBondContact O-N 3.31Å; H65-K67 PolarHBondContact O-N 2.97Å; H65-L68 HydrophobicContact CB-CD1 3.91Å; H65-L68 HydrophobicContact CB-CG 3.99Å; H65-L68 WeakPolarHBondContact O-CB 3.47Å; H65-L68 PolarHBondContact O-N 3.42Å; H65-C316 HydrophobicContact CB-CB 4.49Å; H65-C316 PolarHBondContact NE2-O 3.23Å; H65-T320 PolarHBondContact NE2-OG1 2.9Å
66K83.8Confident84.1Confident160 Ų16054.8 Ų54.870%0.69626%0.258SS*.G310 helixtrans-52.7-30.9177.4-66.2-173.9-179.7-178.40113.9L68 R69K66-L68 PolarHBondContact O-N 3.28Å; K66-L68 VanDerWaalsContact O-N 3.16Å; K66-R69 WeakPolarHBondContact O-CB 3.29Å; K66-R69 WeakPolarHBondContact O-CG 3.43Å; K66-R69 PolarHBondContact O-N 3.44Å
67K81.3Confident83.8Confident168 Ų16851.3 Ų51.373%0.7324%0.244SC*.G310 helixtrans-60.5-22176.8-62.8-175.9-179.6-178.90113.1H65 R69 Q312H65-K67 PolarHBondContact O-N 2.97Å; K67-R69 VanDerWaalsContact C-N 3.34Å; K67-Q312 PolarHBondContact O-NE2 3.32Å
68L80.9Confident83.7Confident0 Ų049.6 Ų49.60%024%0.235CC..G310 helixtrans-88.16177.7-60.4178000112.8V61 T62 H65 K66 T70 N73 Q312 F313 C316V61-L68 HydrophobicContact CG1-CD1 3.73Å; T62-L68 HydrophobicContact CG2-CB 4.48Å; H65-L68 HydrophobicContact CB-CD1 3.91Å; H65-L68 HydrophobicContact CB-CG 3.99Å; H65-L68 WeakPolarHBondContact O-CB 3.47Å; H65-L68 PolarHBondContact O-N 3.42Å; K66-L68 PolarHBondContact O-N 3.28Å; K66-L68 VanDerWaalsContact O-N 3.16Å; L68-T70 PolarHBondContact O-N 2.89Å; L68-N73 VanDerWaalsContact C-ND2 3.34Å; L68-N73 VanDerWaalsContact CA-ND2 3.33Å; L68-N73 WeakPolarHBondContact CA-ND2 3.37Å; L68-N73 WeakPolarHBondContact O-CB 3.06Å; L68-N73 VanDerWaalsContact O-CG 3.25Å; L68-N73 PolarHBondContact O-ND2 3.2Å; L68-Q312 HydrophobicContact CD2-CG 3.91Å; L68-F313 HydrophobicContact CD1-CD2 3.68Å; L68-F313 HydrophobicContact CD1-CE2 3.87Å; L68-F313 HydrophobicContact CD2-CD2 4.17Å; L68-F313 HydrophobicContact CG-CD2 4.49Å; L68-C316 HydrophobicContact CD1-CB 3.83Å; L68-C316 HydrophobicContact CG-CB 4.42Å
69R81.4Confident83.6Confident125 Ų12549.6 Ų49.647%0.47224%0.235SC..  trans-83.967.4178.7-62.9179.6-171.4-173.4-1.7111.7V63 K66 K67V63-R69 PolarHBondContact O-NH2 2.93Å; K66-R69 WeakPolarHBondContact O-CB 3.29Å; K66-R69 WeakPolarHBondContact O-CG 3.43Å; K66-R69 PolarHBondContact O-N 3.44Å; K67-R69 VanDerWaalsContact C-N 3.34Å
70T76.9Confident83.7Confident50 Ų5047.6 Ų47.631%0.30722%0.224SC..SBendtrans-115.4157.5176.169.10000109.9L68 L72 N73 Y74L68-T70 PolarHBondContact O-N 2.89Å; T70-L72 VanDerWaalsContact C-N 3.27Å; T70-L72 PolarHBondContact O-N 3.35Å; T70-N73 PolarHBondContact O-N 3.5Å; T70-N73 PolarHBondContact OG1-ND2 3Å; T70-N73 VanDerWaalsContact OG1-ND2 3.07Å; T70-Y74 WeakPolarHBondContact O-CD2 3.29Å; T70-Y74 PolarHBondContact O-N 2.91Å
71P69.8Low83.8Confident39 Ų3945.3 Ų45.325%0.25322%0.217SC..Hα-helixtrans-49.8-43178.1-31.137.3000114.5N73 Y74 V75 E134 F148P71-N73 VanDerWaalsContact C-N 3.33Å; P71-N73 PolarHBondContact O-N 3.45Å; P71-Y74 PolarHBondContact O-N 3.03Å; P71-V75 PolarHBondContact O-N 3.42Å; P71-E134 HydrophobicContact CB-CG 4.26Å; P71-F148 HydrophobicContact CB-CD1 4.1Å; P71-F148 HydrophobicContact CB-CE1 3.79Å; P71-F148 HydrophobicContact CG-CD1 3.66Å; P71-F148 HydrophobicContact CG-CE1 3.78Å
72L71.2Confident84Confident19 Ų1945.3 Ų45.310%0.09922%0.217CC..Hα-helixtrans-57-47.6175.1-176.6164.1000111.2T70 Y74 V75 L76 M253T70-L72 VanDerWaalsContact C-N 3.27Å; T70-L72 PolarHBondContact O-N 3.35Å; L72-Y74 VanDerWaalsContact C-N 3.34Å; L72-Y74 PolarHBondContact O-N 3.45Å; L72-V75 WeakPolarHBondContact O-CB 3.43Å; L72-V75 PolarHBondContact O-N 2.94Å; L72-L76 HydrophobicContact CD2-CD1 3.67Å; L72-L76 HydrophobicContact CD2-CG 3.96Å; L72-L76 WeakPolarHBondContact O-CG 3.34Å; L72-L76 PolarHBondContact O-N 2.96Å; L72-L76 VanDerWaalsContact O-N 3.16Å; L72-M253 HydrophobicContact CD1-CE 3.45Å; L72-M253 VanDerWaalsContact CD1-CE 3.45Å; L72-M253 HydrophobicContact CD1-SD 3.63Å; L72-M253 HydrophobicContact CG-CE 3.92Å
73N81.2Confident84.3Confident0 Ų045.1 Ų45.10%022%0.215CC..Hα-helixtrans-75.5-23.1-175.9-64.6-26.5000112.7T62 L68 T70 P71 V75 L76 L77 N310T62-N73 HydrophobicContact CG2-CB 4.48Å; L68-N73 VanDerWaalsContact C-ND2 3.34Å; L68-N73 VanDerWaalsContact CA-ND2 3.33Å; L68-N73 WeakPolarHBondContact CA-ND2 3.37Å; L68-N73 WeakPolarHBondContact O-CB 3.06Å; L68-N73 VanDerWaalsContact O-CG 3.25Å; L68-N73 PolarHBondContact O-ND2 3.2Å; T70-N73 PolarHBondContact O-N 3.5Å; T70-N73 PolarHBondContact OG1-ND2 3Å; T70-N73 VanDerWaalsContact OG1-ND2 3.07Å; P71-N73 VanDerWaalsContact C-N 3.33Å; P71-N73 PolarHBondContact O-N 3.45Å; N73-V75 VanDerWaalsContact C-N 3.32Å; N73-L76 PolarHBondContact O-N 3.47Å; N73-L77 WeakPolarHBondContact O-CB 3.41Å; N73-L77 PolarHBondContact O-N 3.01Å; N73-N310 PolarHBondContact OD1-ND2 3.4Å; N73-N310 VanDerWaalsContact OD1-ND2 3.13Å
74Y81.7Confident84.8Confident31 Ų3142.2 Ų42.212%0.12220%0.197CC..Hα-helixtrans-65.1-37168.6-80.2-57.6000111.7T70 P71 L72 L77 N78 E150 A153T70-Y74 WeakPolarHBondContact O-CD2 3.29Å; T70-Y74 PolarHBondContact O-N 2.91Å; P71-Y74 PolarHBondContact O-N 3.03Å; L72-Y74 VanDerWaalsContact C-N 3.34Å; L72-Y74 PolarHBondContact O-N 3.45Å; Y74-L77 HydrophobicContact CD1-CD2 4.37Å; Y74-L77 WeakPolarHBondContact O-CB 3.41Å; Y74-L77 PolarHBondContact O-N 3.04Å; Y74-N78 WeakPolarHBondContact O-CB 3.23Å; Y74-N78 PolarHBondContact O-N 3.05Å; Y74-E150 HydrophobicContact CE2-CG 4.13Å; Y74-E150 PolarHBondContact OH-OE1 3.47Å; Y74-A153 HydrophobicContact CD2-CB 4Å
75V80.6Confident85Confident7 Ų740.5 Ų40.54%0.04219%0.189CC..Hα-helixtrans-65.8-41.7171.9165.60000111.2P71 L72 N73 L77 N78 L79 L131P71-V75 PolarHBondContact O-N 3.42Å; L72-V75 WeakPolarHBondContact O-CB 3.43Å; L72-V75 PolarHBondContact O-N 2.94Å; N73-V75 VanDerWaalsContact C-N 3.32Å; V75-L77 VanDerWaalsContact C-N 3.32Å; V75-L77 PolarHBondContact O-N 3.49Å; V75-N78 PolarHBondContact O-N 2.96Å; V75-L79 WeakPolarHBondContact O-CB 3.45Å; V75-L79 PolarHBondContact O-N 3.38Å; V75-L131 HydrophobicContact CG1-CB 4.48Å; V75-L131 HydrophobicContact CG1-CD2 4.46Å; V75-L131 HydrophobicContact CG2-CB 4.25Å; V75-L131 HydrophobicContact CG2-CD1 4.45Å
76L79.3Confident85.5Confident8 Ų838.7 Ų38.74%0.04218%0.181CC..Hα-helixtrans-61.7-40.7174.5-59.4-174.7000112.5L72 N73 L79 A80 Y306L72-L76 HydrophobicContact CD2-CD1 3.67Å; L72-L76 HydrophobicContact CD2-CG 3.96Å; L72-L76 WeakPolarHBondContact O-CG 3.34Å; L72-L76 PolarHBondContact O-N 2.96Å; L72-L76 VanDerWaalsContact O-N 3.16Å; N73-L76 PolarHBondContact O-N 3.47Å; L76-L79 PolarHBondContact O-N 3.29Å; L76-A80 WeakPolarHBondContact O-CB 3.49Å; L76-A80 PolarHBondContact O-N 3.02Å; L76-Y306 VanDerWaalsContact CD2-CB 3.5Å; L76-Y306 HydrophobicContact CD2-CD1 3.33Å; L76-Y306 HydrophobicContact CD2-CD2 3.48Å; L76-Y306 VanDerWaalsContact CD2-CD2 3.48Å; L76-Y306 HydrophobicContact CD2-CE1 3.82Å; L76-Y306 HydrophobicContact CD2-CE2 4.04Å; L76-Y306 HydrophobicContact CD2-CG 3.13Å; L76-Y306 HydrophobicContact CG-CG 4.44Å
77L86.7Confident86.1Confident35 Ų3531.2 Ų31.218%0.18315%0.149CC..Hα-helixtrans-60.3-47.8175-17178.8000110.7L59 T62 V63 N73 Y74 V75 L79 A80 V81L59-L77 HydrophobicContact CD1-CD1 3.38Å; L59-L77 HydrophobicContact CD1-CG 4.19Å; T62-L77 HydrophobicContact CG2-CB 4.42Å; T62-L77 HydrophobicContact CG2-CD1 3.95Å; V63-L77 HydrophobicContact CG2-CD1 4.36Å; N73-L77 WeakPolarHBondContact O-CB 3.41Å; N73-L77 PolarHBondContact O-N 3.01Å; Y74-L77 HydrophobicContact CD1-CD2 4.37Å; Y74-L77 WeakPolarHBondContact O-CB 3.41Å; Y74-L77 PolarHBondContact O-N 3.04Å; V75-L77 VanDerWaalsContact C-N 3.32Å; V75-L77 PolarHBondContact O-N 3.49Å; L77-L79 VanDerWaalsContact C-N 3.33Å; L77-L79 PolarHBondContact O-N 3Å; L77-A80 PolarHBondContact O-N 2.92Å; L77-V81 WeakPolarHBondContact O-CG2 3.4Å; L77-V81 PolarHBondContact O-N 2.94Å
78N90.5Very high86.8Confident9 Ų927.4 Ų27.45%0.04814%0.139CC..Hα-helixtrans-63-42.2-179.3-161.844000111.8Y74 V75 V81 A82 I123 S127 L157 S160 W161Y74-N78 WeakPolarHBondContact O-CB 3.23Å; Y74-N78 PolarHBondContact O-N 3.05Å; V75-N78 PolarHBondContact O-N 2.96Å; N78-V81 PolarHBondContact O-N 2.7Å; N78-A82 WeakPolarHBondContact O-CB 3.37Å; N78-A82 PolarHBondContact O-N 3.39Å; N78-I123 WeakPolarHBondContact ND2-CG2 3.39Å; N78-S127 PolarHBondContact ND2-OG 3.42Å; N78-L157 HydrophobicContact CB-CD1 4.3Å; N78-L157 HydrophobicContact CB-CD2 3.64Å; N78-S160 PolarHBondContact ND2-OG 3.24Å; N78-W161 PolarHBondContact OD1-NE1 3.17Å
79L88.3Confident87.4Confident7 Ų727.8 Ų27.84%0.03714%0.144CC..Hα-helixtrans-64.4-43.6176.2-172.861.7000111.9V75 L76 L77 V81 A82 D83 A124 N302 Y306V75-L79 WeakPolarHBondContact O-CB 3.45Å; V75-L79 PolarHBondContact O-N 3.38Å; L76-L79 PolarHBondContact O-N 3.29Å; L77-L79 VanDerWaalsContact C-N 3.33Å; L77-L79 PolarHBondContact O-N 3Å; L79-V81 VanDerWaalsContact C-N 3.28Å; L79-V81 PolarHBondContact O-N 2.98Å; L79-A82 WeakPolarHBondContact O-CB 3.38Å; L79-A82 PolarHBondContact O-N 2.95Å; L79-D83 WeakPolarHBondContact O-CB 3.22Å; L79-D83 PolarHBondContact O-N 3.39Å; L79-A124 HydrophobicContact CD1-CB 3.29Å; L79-N302 HydrophobicContact CD2-CB 3.88Å; L79-Y306 HydrophobicContact CD2-CD2 4.08Å; L79-Y306 HydrophobicContact CD2-CE2 3.31Å
80A92.3Very high88.1Confident2 Ų221.9 Ų21.92%0.01712%0.121CC..Hα-helixtrans-61-37.9175.900000112.2N55 T58 L76 L77 L84N55-A80 HydrophobicContact CB-CB 4.45Å; N55-A80 WeakPolarHBondContact OD1-CA 3.33Å; T58-A80 HydrophobicContact CG2-CB 3.94Å; L76-A80 WeakPolarHBondContact O-CB 3.49Å; L76-A80 PolarHBondContact O-N 3.02Å; L77-A80 PolarHBondContact O-N 2.92Å; A80-L84 WeakPolarHBondContact O-CB 3.24Å; A80-L84 WeakPolarHBondContact O-CG 3.44Å; A80-L84 PolarHBondContact O-N 3.5Å
81V93.8Very high89.1Confident37 Ų3719.5 Ų19.522%0.22411%0.107CC..Hα-helixtrans-66.4-46.2174.1173.10000110.9L59 L77 N78 L79 D83 L84 F85 W161L59-V81 HydrophobicContact CD1-CG2 4.12Å; L77-V81 WeakPolarHBondContact O-CG2 3.4Å; L77-V81 PolarHBondContact O-N 2.94Å; N78-V81 PolarHBondContact O-N 2.7Å; L79-V81 VanDerWaalsContact C-N 3.28Å; L79-V81 PolarHBondContact O-N 2.98Å; V81-D83 PolarHBondContact O-N 3.4Å; V81-L84 PolarHBondContact O-N 3.09Å; V81-F85 HydrophobicContact CG1-CD2 3.85Å; V81-F85 HydrophobicContact CG1-CE2 3.65Å; V81-F85 VanDerWaalsContact O-CD2 3.25Å; V81-F85 WeakPolarHBondContact O-CD2 3.24Å; V81-F85 PolarHBondContact O-N 3.16Å; V81-W161 HydrophobicContact CG1-CH2 4.29Å; V81-W161 HydrophobicContact CG1-CZ2 3.87Å
82A94.1Very high90.4Very high0 Ų020.6 Ų20.60%011%0.113CC..Hα-helixtrans-59.1-44.8177.400000112.4N78 L79 L84 F85 M86 I123N78-A82 WeakPolarHBondContact O-CB 3.37Å; N78-A82 PolarHBondContact O-N 3.39Å; L79-A82 WeakPolarHBondContact O-CB 3.38Å; L79-A82 PolarHBondContact O-N 2.95Å; A82-L84 PolarHBondContact O-N 2.81Å; A82-F85 WeakPolarHBondContact O-CB 3.45Å; A82-F85 PolarHBondContact O-N 2.94Å; A82-M86 PolarHBondContact O-N 3.08Å; A82-I123 HydrophobicContact CB-CB 3.75Å; A82-I123 HydrophobicContact CB-CD1 4.15Å; A82-I123 HydrophobicContact CB-CG2 3.64Å
83D94.8Very high91.7Very high2 Ų220.3 Ų20.31%0.01111%0.112CC..Hα-helixtrans-64.4-39.5177.4-73-25.5000111.1N55 L79 V81 F85 M86 I87 A299N55-D83 HydrophobicContact CB-CB 4.5Å; N55-D83 WeakPolarHBondContact OD1-CB 3.11Å; N55-D83 PolarHBondContact OD1-OD2 2.96Å; L79-D83 WeakPolarHBondContact O-CB 3.22Å; L79-D83 PolarHBondContact O-N 3.39Å; V81-D83 PolarHBondContact O-N 3.4Å; D83-F85 PolarHBondContact O-N 2.97Å; D83-M86 PolarHBondContact O-N 3.07Å; D83-I87 WeakPolarHBondContact O-CB 3.3Å; D83-I87 VanDerWaalsContact O-CD1 3.3Å; D83-I87 WeakPolarHBondContact O-CD1 3.2Å; D83-I87 WeakPolarHBondContact O-CG1 3.28Å; D83-I87 PolarHBondContact O-N 3.35Å; D83-A299 HydrophobicContact CB-CB 4.01Å
84L95.9Very high92.5Very high24 Ų2420.3 Ų20.313%0.12611%0.112CC..Hα-helixtrans-62.6-39.5174-73.4168.9000112.5F52 N55 F56 L59 A80 V81 A82 I87 V88F52-L84 HydrophobicContact CD2-CD2 3.71Å; F52-L84 HydrophobicContact CE2-CD2 3.82Å; F52-L84 HydrophobicContact CG-CD2 4.39Å; N55-L84 HydrophobicContact CB-CD2 4.03Å; N55-L84 HydrophobicContact CB-CG 3.95Å; F56-L84 HydrophobicContact CB-CD2 4.49Å; L59-L84 HydrophobicContact CD2-CD1 3.97Å; A80-L84 WeakPolarHBondContact O-CB 3.24Å; A80-L84 WeakPolarHBondContact O-CG 3.44Å; A80-L84 PolarHBondContact O-N 3.5Å; V81-L84 PolarHBondContact O-N 3.09Å; A82-L84 PolarHBondContact O-N 2.81Å; L84-I87 PolarHBondContact O-N 3.45Å; L84-V88 WeakPolarHBondContact O-CB 3.48Å; L84-V88 WeakPolarHBondContact O-CG2 3.3Å; L84-V88 PolarHBondContact O-N 3.48Å
85F94.6Very high93.3Very high85 Ų8520.2 Ų20.237%0.37311%0.113SC..Hα-helixtrans-62.1-45.3172.9-86-71.4000111.7V81 A82 D83 I87 G89 F116 W161V81-F85 HydrophobicContact CG1-CD2 3.85Å; V81-F85 HydrophobicContact CG1-CE2 3.65Å; V81-F85 VanDerWaalsContact O-CD2 3.25Å; V81-F85 WeakPolarHBondContact O-CD2 3.24Å; V81-F85 PolarHBondContact O-N 3.16Å; A82-F85 WeakPolarHBondContact O-CB 3.45Å; A82-F85 PolarHBondContact O-N 2.94Å; D83-F85 PolarHBondContact O-N 2.97Å; F85-I87 VanDerWaalsContact C-N 3.34Å; F85-I87 PolarHBondContact O-N 3.37Å; F85-G89 WeakPolarHBondContact O-CA 3.34Å; F85-G89 PolarHBondContact O-N 3.32Å; F85-F116 HydrophobicContact CB-CD1 4.08Å; F85-F116 HydrophobicContact CB-CE1 4.48Å; F85-F116 HydrophobicContact CD1-CD1 4.03Å; F85-F116 AromaticContact CD1-CE1 3.57Å; F85-F116 HydrophobicContact CD1-CE1 3.57Å; F85-F116 HydrophobicContact CE1-CE1 4.27Å; F85-F116 HydrophobicContact CG-CE1 4.43Å; F85-W161 AromaticContact CD2-CH2 3.86Å; F85-W161 HydrophobicContact CD2-CH2 3.86Å; F85-W161 AromaticContact CE2-CH2 3.56Å; F85-W161 HydrophobicContact CE2-CH2 3.56Å; F85-W161 HydrophobicContact CE2-CZ2 4.39Å; F85-W161 HydrophobicContact CE2-CZ3 4.46Å; F85-W161 HydrophobicContact CZ-CH2 4.33Å
86M95.5Very high94.1Very high5 Ų524.5 Ų24.53%0.02513%0.129CC..Iπ-helixtrans-63.5-39.1177.5-175.2167.161.100112.1A82 D83 G90 F91 A299A82-M86 PolarHBondContact O-N 3.08Å; D83-M86 PolarHBondContact O-N 3.07Å; M86-G90 CarbonylContact O-C 3.25Å; M86-G90 WeakPolarHBondContact O-CA 3.32Å; M86-G90 PolarHBondContact O-N 2.9Å; M86-F91 HydrophobicContact CE-CE1 4.15Å; M86-F91 HydrophobicContact CE-CZ 3.75Å; M86-F91 HydrophobicContact CG-CD1 4.06Å; M86-F91 HydrophobicContact CG-CE1 3.47Å; M86-F91 VanDerWaalsContact CG-CE1 3.47Å; M86-F91 HydrophobicContact CG-CZ 3.93Å; M86-F91 PolarHBondContact O-N 2.99Å; M86-F91 HydrophobicContact SD-CE1 3.89Å; M86-F91 HydrophobicContact SD-CZ 4.13Å; M86-A299 HydrophobicContact CE-CB 3.5Å
87I97.1Very high95Very high2 Ų224.1 Ų24.11%0.0113%0.127CC..Iπ-helixtrans-68.5-52.8178.3-65.9157.6000110.9I48 A51 F52 D83 L84 F85 F91 T92 A299I48-I87 HydrophobicContact CG1-CG2 4.27Å; I48-I87 HydrophobicContact CG2-CG2 4.34Å; A51-I87 HydrophobicContact CB-CD1 3.65Å; A51-I87 HydrophobicContact CB-CG1 4.27Å; F52-I87 HydrophobicContact CB-CG2 4.19Å; F52-I87 HydrophobicContact CD2-CG2 4.22Å; D83-I87 WeakPolarHBondContact O-CB 3.3Å; D83-I87 VanDerWaalsContact O-CD1 3.3Å; D83-I87 WeakPolarHBondContact O-CD1 3.2Å; D83-I87 WeakPolarHBondContact O-CG1 3.28Å; D83-I87 PolarHBondContact O-N 3.35Å; L84-I87 PolarHBondContact O-N 3.45Å; F85-I87 VanDerWaalsContact C-N 3.34Å; F85-I87 PolarHBondContact O-N 3.37Å; I87-F91 HydrophobicContact CB-CD2 4.2Å; I87-F91 HydrophobicContact CG1-CD2 3.72Å; I87-F91 HydrophobicContact CG1-CE2 3.81Å; I87-F91 HydrophobicContact CG2-CD2 4.42Å; I87-F91 WeakPolarHBondContact O-CB 3.22Å; I87-F91 PolarHBondContact O-N 3.41Å; I87-T92 PolarHBondContact O-N 2.89Å; I87-A299 HydrophobicContact CD1-CB 4.36Å; I87-A299 HydrophobicContact CG1-CB 4.3Å
88V96Very high95.5Very high88 Ų8822.5 Ų22.553%0.53312%0.119SC..Iπ-helixtrans-71.4-40.9-173.9174.60000111.5F52 L84 T92F52-V88 HydrophobicContact CD2-CG2 4.4Å; F52-V88 HydrophobicContact CE2-CG2 4.07Å; L84-V88 WeakPolarHBondContact O-CB 3.48Å; L84-V88 WeakPolarHBondContact O-CG2 3.3Å; L84-V88 PolarHBondContact O-N 3.48Å; V88-T92 WeakPolarHBondContact O-CG2 3.34Å; V88-T92 PolarHBondContact O-OG1 2.98Å
89G93.6Very high95.8Very high9 Ų927.3 Ų27.39%0.09314%0.144CC..Iπ-helixtrans-91.9-36.6-176.300000114.5F85 V93 V112 F116F85-G89 WeakPolarHBondContact O-CA 3.34Å; F85-G89 PolarHBondContact O-N 3.32Å; G89-V93 WeakPolarHBondContact O-CG2 3.17Å; G89-V112 WeakPolarHBondContact O-CG1 2.98Å; G89-F116 VanDerWaalsContact CA-CD2 3.43Å
90G96Very high96.2Very high0 Ų030.1 Ų30.10%016%0.157CC..Iπ-helixtrans-96.6-57.3-176.900000113.5M86 T92 V93 T94 E113M86-G90 CarbonylContact O-C 3.25Å; M86-G90 WeakPolarHBondContact O-CA 3.32Å; M86-G90 PolarHBondContact O-N 2.9Å; G90-T92 VanDerWaalsContact C-N 3.32Å; G90-T92 PolarHBondContact O-N 3.44Å; G90-V93 PolarHBondContact O-N 3.31Å; G90-V93 VanDerWaalsContact O-N 3.14Å; G90-T94 PolarHBondContact O-N 3.25Å; G90-T94 PolarHBondContact O-OG1 3.05Å; G90-E113 WeakPolarHBondContact O-CG 3.35Å
91F97.8Very high96.4Very high0 Ų030 Ų300%016%0.156CC..Iπ-helixtrans-66.6-35-170.1-65.9-0.4000112.7M44 L47 I48 M86 I87 V93 T94 L95 K296 A299M44-F91 HydrophobicContact CE-CB 3.57Å; M44-F91 HydrophobicContact CE-CD1 3.46Å; M44-F91 VanDerWaalsContact CE-CD1 3.46Å; M44-F91 HydrophobicContact CE-CD2 4.04Å; M44-F91 HydrophobicContact CE-CE1 4.13Å; M44-F91 HydrophobicContact CE-CG 3.42Å; M44-F91 VanDerWaalsContact CE-CG 3.42Å; L47-F91 HydrophobicContact CB-CD2 4.24Å; L47-F91 HydrophobicContact CB-CE2 4.18Å; L47-F91 HydrophobicContact CD1-CE2 4.24Å; I48-F91 HydrophobicContact CD1-CB 3.97Å; I48-F91 HydrophobicContact CG1-CB 3.68Å; I48-F91 HydrophobicContact CG1-CD2 4.3Å; M86-F91 HydrophobicContact CE-CE1 4.15Å; M86-F91 HydrophobicContact CE-CZ 3.75Å; M86-F91 HydrophobicContact CG-CD1 4.06Å; M86-F91 HydrophobicContact CG-CE1 3.47Å; M86-F91 VanDerWaalsContact CG-CE1 3.47Å; M86-F91 HydrophobicContact CG-CZ 3.93Å; M86-F91 PolarHBondContact O-N 2.99Å; M86-F91 HydrophobicContact SD-CE1 3.89Å; M86-F91 HydrophobicContact SD-CZ 4.13Å; I87-F91 HydrophobicContact CB-CD2 4.2Å; I87-F91 HydrophobicContact CG1-CD2 3.72Å; I87-F91 HydrophobicContact CG1-CE2 3.81Å; I87-F91 HydrophobicContact CG2-CD2 4.42Å; I87-F91 WeakPolarHBondContact O-CB 3.22Å; I87-F91 PolarHBondContact O-N 3.41Å; F91-V93 VanDerWaalsContact C-N 3.34Å; F91-V93 PolarHBondContact O-N 3.37Å; F91-T94 PolarHBondContact O-N 2.86Å; F91-L95 VanDerWaalsContact O-CB 3.29Å; F91-L95 WeakPolarHBondContact O-CB 3.35Å; F91-L95 PolarHBondContact O-N 3.16Å; F91-K296 HydrophobicContact CD1-CD 4.24Å; F91-K296 HydrophobicContact CE1-CB 3.62Å; F91-K296 HydrophobicContact CE1-CD 3.95Å; F91-K296 HydrophobicContact CE1-CG 3.74Å; F91-K296 HydrophobicContact CZ-CB 3.73Å; F91-K296 HydrophobicContact CZ-CG 4.35Å; F91-K296 WeakPolarHBondContact CZ-O 3.47Å; F91-A299 HydrophobicContact CE2-CB 3.88Å; F91-A299 HydrophobicContact CZ-CB 3.95Å
92T97.6Very high96.6Very high62 Ų6230.6 Ų30.638%0.3815%0.154SC..Hα-helixtrans-59.4-44.5174.254.50000111.7I87 V88 G90 L95 Y96I87-T92 PolarHBondContact O-N 2.89Å; V88-T92 WeakPolarHBondContact O-CG2 3.34Å; V88-T92 PolarHBondContact O-OG1 2.98Å; G90-T92 VanDerWaalsContact C-N 3.32Å; G90-T92 PolarHBondContact O-N 3.44Å; T92-L95 PolarHBondContact O-N 3.41Å; T92-Y96 WeakPolarHBondContact O-CB 3.4Å; T92-Y96 PolarHBondContact O-N 2.67Å
93V97.9Very high96.8Very high13 Ų1330.6 Ų30.68%0.07915%0.154CC..Hα-helixtrans-67.9-43.3176.61770000111G89 G90 F91 L95 Y96 T97 F103 L105 V112 E113G89-V93 WeakPolarHBondContact O-CG2 3.17Å; G90-V93 PolarHBondContact O-N 3.31Å; G90-V93 VanDerWaalsContact O-N 3.14Å; F91-V93 VanDerWaalsContact C-N 3.34Å; F91-V93 PolarHBondContact O-N 3.37Å; V93-L95 VanDerWaalsContact C-N 3.35Å; V93-L95 PolarHBondContact O-N 3.45Å; V93-Y96 PolarHBondContact O-N 3.41Å; V93-T97 VanDerWaalsContact O-CB 3.26Å; V93-T97 WeakPolarHBondContact O-CB 3.35Å; V93-T97 PolarHBondContact O-N 2.98Å; V93-T97 PolarHBondContact O-OG1 3.47Å; V93-F103 HydrophobicContact CG1-CE1 4.28Å; V93-L105 HydrophobicContact CG1-CD1 4.14Å; V93-L105 HydrophobicContact CG2-CD1 4.36Å; V93-V112 HydrophobicContact CG2-CG1 4.08Å; V93-E113 HydrophobicContact CB-CB 4.02Å; V93-E113 HydrophobicContact CB-CG 4.13Å; V93-E113 HydrophobicContact CG1-CB 3.77Å; V93-E113 HydrophobicContact CG1-CG 4.13Å
94T97.9Very high96.8Very high0 Ų032.3 Ų32.30%017%0.167CC..Hα-helixtrans-59.9-45.1176.6-51.90000111M44 G90 F91 T97 A98 E113 C185 F293M44-T94 HydrophobicContact CE-CG2 3.92Å; M44-T94 HydrophobicContact CG-CG2 3.76Å; M44-T94 HydrophobicContact SD-CG2 3.94Å; G90-T94 PolarHBondContact O-N 3.25Å; G90-T94 PolarHBondContact O-OG1 3.05Å; F91-T94 PolarHBondContact O-N 2.86Å; T94-T97 PolarHBondContact O-N 2.88Å; T94-A98 VanDerWaalsContact O-CB 3.32Å; T94-A98 WeakPolarHBondContact O-CB 3.48Å; T94-A98 PolarHBondContact O-N 3.48Å; T94-E113 VanDerWaalsContact OG1-CG 3.32Å; T94-E113 WeakPolarHBondContact OG1-CG 3.3Å; T94-E113 PolarHBondContact OG1-OE1 3.4Å; T94-C185 WeakPolarHBondContact CG2-O 3.4Å; T94-F293 HydrophobicContact CG2-CE1 3.66Å; T94-F293 HydrophobicContact CG2-CZ 3.73Å
95L98.3Very high96.8Very high30 Ų3035 Ų3516%0.15718%0.181CC..Hα-helixtrans-60-50.8176.3171.461.9000110.7A41 M44 L45 I48 F91 T92 V93 T97 A98 L99A41-L95 HydrophobicContact CB-CD1 4.05Å; A41-L95 WeakPolarHBondContact O-CD1 3.34Å; M44-L95 HydrophobicContact CB-CB 4.06Å; M44-L95 HydrophobicContact CB-CD1 4.33Å; L45-L95 HydrophobicContact CB-CD1 4.17Å; L45-L95 HydrophobicContact CD1-CD2 4.12Å; I48-L95 HydrophobicContact CD1-CB 4.11Å; I48-L95 HydrophobicContact CD1-CD2 3.79Å; F91-L95 VanDerWaalsContact O-CB 3.29Å; F91-L95 WeakPolarHBondContact O-CB 3.35Å; F91-L95 PolarHBondContact O-N 3.16Å; T92-L95 PolarHBondContact O-N 3.41Å; V93-L95 VanDerWaalsContact C-N 3.35Å; V93-L95 PolarHBondContact O-N 3.45Å; L95-T97 VanDerWaalsContact C-N 3.29Å; L95-T97 PolarHBondContact O-N 3.38Å; L95-A98 PolarHBondContact O-N 3.48Å; L95-L99 HydrophobicContact CD1-CD1 4.17Å; L95-L99 HydrophobicContact CD1-CG 4.23Å; L95-L99 HydrophobicContact CG-CD1 4.2Å; L95-L99 WeakPolarHBondContact O-CG 3.05Å; L95-L99 PolarHBondContact O-N 3.07Å
96Y97.9Very high96.9Very high97 Ų9731.9 Ų31.938%0.3817%0.173SC..Hα-helixtrans-59.2-42.9179.8-174.8-104.8000111.7T92 V93 L99 H100 S104 L105T92-Y96 WeakPolarHBondContact O-CB 3.4Å; T92-Y96 PolarHBondContact O-N 2.67Å; V93-Y96 PolarHBondContact O-N 3.41Å; Y96-L99 PolarHBondContact O-N 2.95Å; Y96-H100 AromaticContact CD2-CE1 3.82Å; Y96-H100 AromaticContact CE1-CE1 4Å; Y96-H100 AromaticContact CE2-CE1 3.31Å; Y96-H100 WeakPolarHBondContact CE2-CE1 3.37Å; Y96-H100 AromaticContact CZ-CE1 3.4Å; Y96-H100 AromaticContact CZ-ND1 3.99Å; Y96-H100 AromaticContact CZ-NE2 3.97Å; Y96-H100 PolarHBondContact O-N 3.05Å; Y96-H100 PolarHBondContact O-ND1 3.4Å; Y96-S104 WeakPolarHBondContact CE1-OG 3.34Å; Y96-L105 HydrophobicContact CD1-CD1 3.89Å; Y96-L105 HydrophobicContact CD1-CD2 4.25Å; Y96-L105 HydrophobicContact CD1-CG 3.79Å; Y96-L105 HydrophobicContact CE1-CD1 4.3Å; Y96-L105 HydrophobicContact CE1-CD2 3.79Å; Y96-L105 HydrophobicContact CE1-CG 3.76Å
97T97.6Very high97Very high0 Ų034.1 Ų34.10%019%0.187CC..Hα-helixtrans-64.2-45177-58.90000111.6V93 T94 L95 L99 H100 G101 Y102 F103 C185V93-T97 VanDerWaalsContact O-CB 3.26Å; V93-T97 WeakPolarHBondContact O-CB 3.35Å; V93-T97 PolarHBondContact O-N 2.98Å; V93-T97 PolarHBondContact O-OG1 3.47Å; T94-T97 PolarHBondContact O-N 2.88Å; L95-T97 VanDerWaalsContact C-N 3.29Å; L95-T97 PolarHBondContact O-N 3.38Å; T97-L99 VanDerWaalsContact C-N 3.32Å; T97-L99 PolarHBondContact O-N 2.64Å; T97-H100 PolarHBondContact O-N 3.01Å; T97-G101 PolarHBondContact O-N 2.97Å; T97-Y102 WeakPolarHBondContact CG2-O 3.37Å; T97-Y102 PolarHBondContact O-N 2.84Å; T97-F103 HydrophobicContact CG2-CB 4.37Å; T97-F103 HydrophobicContact CG2-CD1 3.89Å; T97-F103 HydrophobicContact CG2-CD2 3.65Å; T97-F103 HydrophobicContact CG2-CE1 4Å; T97-F103 HydrophobicContact CG2-CE2 3.77Å; T97-F103 HydrophobicContact CG2-CG 3.7Å; T97-F103 HydrophobicContact CG2-CZ 3.93Å; T97-C185 HydrophobicContact CG2-CB 4.26Å
98A97.5Very high97Very high1 Ų139 Ų391%0.00822%0.217CC..Hα-helixtrans-64.6-34.217800000112.8L40 A41 T94 L95 H100 C185L40-A98 HydrophobicContact CB-CB 4.22Å; A41-A98 HydrophobicContact CB-CB 3.91Å; T94-A98 VanDerWaalsContact O-CB 3.32Å; T94-A98 WeakPolarHBondContact O-CB 3.48Å; T94-A98 PolarHBondContact O-N 3.48Å; L95-A98 PolarHBondContact O-N 3.48Å; A98-H100 VanDerWaalsContact C-N 3.28Å; A98-H100 PolarHBondContact O-N 3.12Å; A98-C185 HydrophobicContact CB-CB 4.46Å
99L97.7Very high97.1Very high109 Ų10935.1 Ų35.157%0.57119%0.194SC*.Hα-helixtrans-65.6-29.5174.7-72.3169.8000113A41 L95 Y96 T97A41-L99 HydrophobicContact CB-CD2 3.76Å; A41-L99 HydrophobicContact CB-CG 4.03Å; L95-L99 HydrophobicContact CD1-CD1 4.17Å; L95-L99 HydrophobicContact CD1-CG 4.23Å; L95-L99 HydrophobicContact CG-CD1 4.2Å; L95-L99 WeakPolarHBondContact O-CG 3.05Å; L95-L99 PolarHBondContact O-N 3.07Å; Y96-L99 PolarHBondContact O-N 2.95Å; T97-L99 VanDerWaalsContact C-N 3.32Å; T97-L99 PolarHBondContact O-N 2.64Å
100H97.1Very high97.3Very high66 Ų6634.7 Ų34.731%0.30619%0.19SC..Hα-helixtrans-95.1-21.7179.4-6878.4000113.2Y29 Y96 T97 A98 Y102Y29-H100 PolarHBondContact OH-O 3.49Å; Y96-H100 AromaticContact CD2-CE1 3.82Å; Y96-H100 AromaticContact CE1-CE1 4Å; Y96-H100 AromaticContact CE2-CE1 3.31Å; Y96-H100 WeakPolarHBondContact CE2-CE1 3.37Å; Y96-H100 AromaticContact CZ-CE1 3.4Å; Y96-H100 AromaticContact CZ-ND1 3.99Å; Y96-H100 AromaticContact CZ-NE2 3.97Å; Y96-H100 PolarHBondContact O-N 3.05Å; Y96-H100 PolarHBondContact O-ND1 3.4Å; T97-H100 PolarHBondContact O-N 3.01Å; A98-H100 VanDerWaalsContact C-N 3.28Å; A98-H100 PolarHBondContact O-N 3.12Å; H100-Y102 HydrophobicContact CB-CD1 4.03Å; H100-Y102 HydrophobicContact CB-CE1 3.93Å; H100-Y102 WeakPolarHBondContact O-CD1 3.47Å
101G96.8Very high97.4Very high0 Ų036.9 Ų36.90%020%0.201CC..THydrogen-bonded Turntrans81.99.7-175.800000114.6Q28 T97Q28-G101 WeakPolarHBondContact CB-O 3.26Å; Q28-G101 PolarHBondContact N-O 3.37Å; T97-G101 PolarHBondContact O-N 2.97Å
102Y97.5Very high97.5Very high49 Ų4939.4 Ų39.419%0.19222%0.217CC..SBendtrans-166.3167.1177.873.5-73.7000110.9P23 H26 P27 T97 H100 S104P23-Y102 WeakPolarHBondContact O-CB 3.3Å; H26-Y102 VanDerWaalsContact C-CG 3.47Å; H26-Y102 WeakPolarHBondContact O-CB 3.47Å; P27-Y102 HydrophobicContact CB-CD1 4.18Å; P27-Y102 HydrophobicContact CG-CD1 3.77Å; P27-Y102 HydrophobicContact CG-CE1 3.93Å; T97-Y102 WeakPolarHBondContact CG2-O 3.37Å; T97-Y102 PolarHBondContact O-N 2.84Å; H100-Y102 HydrophobicContact CB-CD1 4.03Å; H100-Y102 HydrophobicContact CB-CE1 3.93Å; H100-Y102 WeakPolarHBondContact O-CD1 3.47Å; Y102-S104 VanDerWaalsContact C-N 3.34Å; Y102-S104 PolarHBondContact O-N 2.94Å
103F97Very high97.5Very high0 Ų036.5 Ų36.50%020%0.199CC..  trans-77.777.2178.4-84-86.5000111.8P23 F24 V93 T97 L105 G106 C110 E113 P180 Q184 C187P23-F103 WeakPolarHBondContact O-CA 3.47Å; P23-F103 WeakPolarHBondContact O-CB 3.35Å; P23-F103 PolarHBondContact O-N 3.25Å; F24-F103 HydrophobicContact CD1-CB 3.69Å; F24-F103 HydrophobicContact CE1-CB 4.01Å; F24-F103 HydrophobicContact CE1-CG 4.42Å; V93-F103 HydrophobicContact CG1-CE1 4.28Å; T97-F103 HydrophobicContact CG2-CB 4.37Å; T97-F103 HydrophobicContact CG2-CD1 3.89Å; T97-F103 HydrophobicContact CG2-CD2 3.65Å; T97-F103 HydrophobicContact CG2-CE1 4Å; T97-F103 HydrophobicContact CG2-CE2 3.77Å; T97-F103 HydrophobicContact CG2-CG 3.7Å; T97-F103 HydrophobicContact CG2-CZ 3.93Å; F103-L105 PolarHBondContact O-N 3.44Å; F103-G106 PolarHBondContact O-N 3.46Å; F103-C110 HydrophobicContact CD1-CB 4.11Å; F103-C110 HydrophobicContact CE1-CB 4.17Å; F103-E113 HydrophobicContact CE1-CB 4.45Å; F103-P180 HydrophobicContact CD2-CB 3.93Å; F103-P180 HydrophobicContact CD2-CG 3.8Å; F103-P180 HydrophobicContact CE2-CB 3.84Å; F103-P180 HydrophobicContact CE2-CG 4.05Å; F103-Q184 VanDerWaalsContact CD2-O 3.24Å; F103-Q184 WeakPolarHBondContact CD2-O 3.39Å; F103-Q184 VanDerWaalsContact CE2-O 3.29Å; F103-Q184 WeakPolarHBondContact CE2-O 3.34Å; F103-C187 VanDerWaalsContact CE2-SG 3.52Å; F103-C187 HydrophobicContact CZ-CB 4.16Å; F103-C187 WeakPolarHBondContact CZ-SG 3.34Å
104S95Very high97.5Very high38 Ų3835.9 Ų35.927%0.26620%0.195SC..THydrogen-bonded Turntrans-63.9-21.2176.255.10000114.1Y96 Y102 G106Y96-S104 WeakPolarHBondContact CE1-OG 3.34Å; Y102-S104 VanDerWaalsContact C-N 3.34Å; Y102-S104 PolarHBondContact O-N 2.94Å; S104-G106 PolarHBondContact O-N 3.37Å
105L95.9Very high97.5Very high81 Ų8137.5 Ų37.542%0.42420%0.202SC..THydrogen-bonded Turntrans-79.45.5171.3-61.9179.2000113.2V93 Y96 F103 G109V93-L105 HydrophobicContact CG1-CD1 4.14Å; V93-L105 HydrophobicContact CG2-CD1 4.36Å; Y96-L105 HydrophobicContact CD1-CD1 3.89Å; Y96-L105 HydrophobicContact CD1-CD2 4.25Å; Y96-L105 HydrophobicContact CD1-CG 3.79Å; Y96-L105 HydrophobicContact CE1-CD1 4.3Å; Y96-L105 HydrophobicContact CE1-CD2 3.79Å; Y96-L105 HydrophobicContact CE1-CG 3.76Å; F103-L105 PolarHBondContact O-N 3.44Å; L105-G109 PolarHBondContact O-N 2.92Å; L105-G109 VanDerWaalsContact O-N 3.14Å
106G97.2Very high97.5Very high20 Ų2038.4 Ų38.421%0.20621%0.205CC..Hα-helixtrans62.9-158.9178.800000113.6F24 F103 S104 T108 G109 C110F24-G106 VanDerWaalsContact CD1-C 3.44Å; F103-G106 PolarHBondContact O-N 3.46Å; S104-G106 PolarHBondContact O-N 3.37Å; G106-T108 VanDerWaalsContact C-N 3.25Å; G106-T108 PolarHBondContact O-N 3.44Å; G106-G109 PolarHBondContact O-N 3.07Å; G106-C110 PolarHBondContact O-N 3.4Å
107V97.6Very high97.4Very high52 Ų5234.4 Ų34.432%0.31519%0.192SC..Hα-helixtrans-60.9-36.2-179.8-179.40000111.4N8 F24 G109 C110 N111N8-V107 HydrophobicContact CB-CG2 4.15Å; F24-V107 HydrophobicContact CD1-CG2 4.43Å; F24-V107 HydrophobicContact CD2-CG2 4.24Å; F24-V107 HydrophobicContact CE1-CG2 4.25Å; F24-V107 HydrophobicContact CE2-CG2 4.04Å; F24-V107 HydrophobicContact CG-CG2 4.41Å; F24-V107 HydrophobicContact CZ-CG2 4.03Å; V107-G109 PolarHBondContact O-N 3.4Å; V107-C110 WeakPolarHBondContact O-CB 3.21Å; V107-C110 PolarHBondContact O-N 3Å; V107-N111 PolarHBondContact O-N 2.99Å
108T97.4Very high97.4Very high105 Ų10535.4 Ų35.464%0.64420%0.198SC*.Hα-helixtrans-61.6-44.9177.8-53.80000111.7G106 C110 N111 V112G106-T108 VanDerWaalsContact C-N 3.25Å; G106-T108 PolarHBondContact O-N 3.44Å; T108-C110 VanDerWaalsContact C-N 3.31Å; T108-C110 PolarHBondContact O-N 3.16Å; T108-N111 PolarHBondContact O-N 3.26Å; T108-V112 WeakPolarHBondContact O-CG2 3.29Å; T108-V112 PolarHBondContact O-N 3.02Å
109G97.8Very high97.4Very high5 Ų535.6 Ų35.65%0.05220%0.199CC..Hα-helixtrans-60.3-42.2174.800000112.4L105 G106 V107 V112 E113L105-G109 PolarHBondContact O-N 2.92Å; L105-G109 VanDerWaalsContact O-N 3.14Å; G106-G109 PolarHBondContact O-N 3.07Å; V107-G109 PolarHBondContact O-N 3.4Å; G109-V112 PolarHBondContact O-N 3.21Å; G109-E113 WeakPolarHBondContact O-CB 3.4Å; G109-E113 PolarHBondContact O-N 2.94Å
110C98.4Very high97.2Very high0 Ų030.5 Ų30.50%017%0.172CC..Hα-helixtrans-62.6-42.2176-178.60000113F24 F103 G106 V107 T108 E113 G114 C187F24-C110 HydrophobicContact CE1-CB 3.86Å; F24-C110 HydrophobicContact CZ-CB 4.38Å; F103-C110 HydrophobicContact CD1-CB 4.11Å; F103-C110 HydrophobicContact CE1-CB 4.17Å; G106-C110 PolarHBondContact O-N 3.4Å; V107-C110 WeakPolarHBondContact O-CB 3.21Å; V107-C110 PolarHBondContact O-N 3Å; T108-C110 VanDerWaalsContact C-N 3.31Å; T108-C110 PolarHBondContact O-N 3.16Å; C110-E113 PolarHBondContact O-N 3.48Å; C110-G114 PolarHBondContact O-N 2.83Å; C110-C187 WeakPolarHBondContact CA-SG 3.31Å; C110-C187 HydrophobicContact CB-CB 4.12Å; C110-C187 WeakPolarHBondContact CB-SG 3.49Å; C110-C187 WeakPolarHBondContact O-CB 3.41Å; C110-C187 WeakPolarHBondContact SG-CB 3.24Å; C110-C187 CovalentContact SG-SG 2.02Å; C110-C187 PolarHBondContact SG-SG 3.25Å
111N98.4Very high97Very high46 Ų4627.6 Ų27.625%0.24616%0.161CC..Hα-helixtrans-62.8-43.8175.4-74.7-16.2000111.7V107 T108 F115 L172V107-N111 PolarHBondContact O-N 2.99Å; T108-N111 PolarHBondContact O-N 3.26Å; N111-F115 WeakPolarHBondContact O-CB 3.33Å; N111-F115 PolarHBondContact O-N 2.97Å; N111-L172 HydrophobicContact CB-CD2 3.76Å
112V98.3Very high96.9Very high54 Ų5428.3 Ų28.333%0.32716%0.164SC..Hα-helixtrans-62.3-47.6176.9169.70000110.4G89 V93 T108 G109 F116G89-V112 WeakPolarHBondContact O-CG1 2.98Å; V93-V112 HydrophobicContact CG2-CG1 4.08Å; T108-V112 WeakPolarHBondContact O-CG2 3.29Å; T108-V112 PolarHBondContact O-N 3.02Å; G109-V112 PolarHBondContact O-N 3.21Å; V112-F116 HydrophobicContact CG1-CD2 3.85Å; V112-F116 HydrophobicContact CG1-CE2 4Å; V112-F116 VanDerWaalsContact O-CD2 3.25Å; V112-F116 WeakPolarHBondContact O-CD2 3.21Å; V112-F116 PolarHBondContact O-N 3.32Å; V112-F116 VanDerWaalsContact O-N 3.09Å
113E98.1Very high96.8Very high0 Ų026 Ų260%016%0.155CC..Hα-helixtrans-62.4-53.6-179.3-163.4-75.4145.500111.6G90 V93 T94 F103 G109 C110 F115 F116 A117 C187 K296G90-E113 WeakPolarHBondContact O-CG 3.35Å; V93-E113 HydrophobicContact CB-CB 4.02Å; V93-E113 HydrophobicContact CB-CG 4.13Å; V93-E113 HydrophobicContact CG1-CB 3.77Å; V93-E113 HydrophobicContact CG1-CG 4.13Å; T94-E113 VanDerWaalsContact OG1-CG 3.32Å; T94-E113 WeakPolarHBondContact OG1-CG 3.3Å; T94-E113 PolarHBondContact OG1-OE1 3.4Å; F103-E113 HydrophobicContact CE1-CB 4.45Å; G109-E113 WeakPolarHBondContact O-CB 3.4Å; G109-E113 PolarHBondContact O-N 2.94Å; C110-E113 PolarHBondContact O-N 3.48Å; E113-F115 PolarHBondContact O-N 3.3Å; E113-F116 PolarHBondContact O-N 2.92Å; E113-A117 VanDerWaalsContact O-CB 3.27Å; E113-A117 WeakPolarHBondContact O-CB 3.3Å; E113-A117 PolarHBondContact O-N 3.36Å; E113-C187 WeakPolarHBondContact OE2-CA 3.44Å; E113-C187 WeakPolarHBondContact OE2-CB 3.3Å; E113-C187 PolarHBondContact OE2-N 3.47Å; E113-K296 IonicContact OE1-NZ 2.64Å; E113-K296 PolarHBondContact OE1-NZ 3.44Å
114G97.9Very high96.5Very high0 Ų026.3 Ų26.30%016%0.158CC..Hα-helixtrans-62.9-40.4-179.600000112.5C110 T118 Y178C110-G114 PolarHBondContact O-N 2.83Å; G114-T118 VanDerWaalsContact O-CB 3.25Å; G114-T118 WeakPolarHBondContact O-CB 3.31Å; G114-T118 PolarHBondContact O-N 2.92Å; G114-T118 PolarHBondContact O-OG1 2.86Å; G114-Y178 VanDerWaalsContact C-CZ 3.44Å; G114-Y178 WeakPolarHBondContact O-CE1 3.46Å; G114-Y178 PolarHBondContact O-OH 2.95Å
115F98.6Very high96.3Very high35 Ų3524.7 Ų24.715%0.15415%0.146CC..Hα-helixtrans-61.3-53.1177.3174.5-99.9000111.7N111 E113 T118 L119 L165 A168 L172 Y178N111-F115 WeakPolarHBondContact O-CB 3.33Å; N111-F115 PolarHBondContact O-N 2.97Å; E113-F115 PolarHBondContact O-N 3.3Å; F115-T118 PolarHBondContact O-N 2.83Å; F115-L119 HydrophobicContact CE1-CD2 3.87Å; F115-L119 HydrophobicContact CZ-CD2 3.96Å; F115-L119 WeakPolarHBondContact O-CB 3.4Å; F115-L119 PolarHBondContact O-N 3.03Å; F115-L165 HydrophobicContact CE2-CD2 4.41Å; F115-L165 HydrophobicContact CZ-CD2 4.24Å; F115-A168 HydrophobicContact CD2-CB 3.88Å; F115-A168 WeakPolarHBondContact CD2-O 3.34Å; F115-A168 HydrophobicContact CE2-CB 3.89Å; F115-L172 HydrophobicContact CB-CD1 4.34Å; F115-L172 HydrophobicContact CD2-CD1 3.56Å; F115-L172 HydrophobicContact CD2-CG 4.43Å; F115-L172 HydrophobicContact CE2-CD1 4.09Å; F115-L172 HydrophobicContact CG-CD1 4.06Å; F115-Y178 HydrophobicContact CB-CE2 4.05Å
116F98.2Very high96.3Very high48 Ų4821.2 Ų21.221%0.21113%0.127CC..Hα-helixtrans-70.9-33.5-176.9-77.5-64.8000112.7F85 G89 V112 E113 L119 G120F85-F116 HydrophobicContact CB-CD1 4.08Å; F85-F116 HydrophobicContact CB-CE1 4.48Å; F85-F116 HydrophobicContact CD1-CD1 4.03Å; F85-F116 AromaticContact CD1-CE1 3.57Å; F85-F116 HydrophobicContact CD1-CE1 3.57Å; F85-F116 HydrophobicContact CE1-CE1 4.27Å; F85-F116 HydrophobicContact CG-CE1 4.43Å; G89-F116 VanDerWaalsContact CA-CD2 3.43Å; V112-F116 HydrophobicContact CG1-CD2 3.85Å; V112-F116 HydrophobicContact CG1-CE2 4Å; V112-F116 VanDerWaalsContact O-CD2 3.25Å; V112-F116 WeakPolarHBondContact O-CD2 3.21Å; V112-F116 PolarHBondContact O-N 3.32Å; V112-F116 VanDerWaalsContact O-N 3.09Å; E113-F116 PolarHBondContact O-N 2.92Å; F116-L119 HydrophobicContact CD1-CD2 4.47Å; F116-G120 PolarHBondContact O-N 2.89Å
117A96.1Very high95.9Very high14 Ų1420.3 Ų20.312%0.11612%0.118CC..Hα-helixtrans-64-46172.100000111.7E113 G121E113-A117 VanDerWaalsContact O-CB 3.27Å; E113-A117 WeakPolarHBondContact O-CB 3.3Å; E113-A117 PolarHBondContact O-N 3.36Å; A117-G121 PolarHBondContact O-N 3.36Å; A117-G121 VanDerWaalsContact O-N 3.1Å
118T97Very high95.5Very high20 Ų2018.5 Ų18.512%0.12311%0.107CC..Hα-helixtrans-66.1-48.3177.7-53.30000111G114 F115 G120 G121 E122 A168 Y178G114-T118 VanDerWaalsContact O-CB 3.25Å; G114-T118 WeakPolarHBondContact O-CB 3.31Å; G114-T118 PolarHBondContact O-N 2.92Å; G114-T118 PolarHBondContact O-OG1 2.86Å; F115-T118 PolarHBondContact O-N 2.83Å; T118-G120 VanDerWaalsContact C-N 3.35Å; T118-G120 PolarHBondContact O-N 3.29Å; T118-G121 PolarHBondContact O-N 3.49Å; T118-E122 HydrophobicContact CG2-CG 4.1Å; T118-E122 WeakPolarHBondContact O-CB 3.49Å; T118-E122 VanDerWaalsContact O-CG 3.26Å; T118-E122 WeakPolarHBondContact O-CG 3.3Å; T118-E122 PolarHBondContact O-N 3.5Å; T118-A168 HydrophobicContact CG2-CB 3.95Å; T118-Y178 VanDerWaalsContact CB-OH 3.28Å; T118-Y178 WeakPolarHBondContact CB-OH 3.34Å; T118-Y178 VanDerWaalsContact OG1-CE1 3.29Å; T118-Y178 WeakPolarHBondContact OG1-CE1 3.31Å; T118-Y178 PolarHBondContact OG1-OH 3.28Å
119L97.3Very high95.2Very high6 Ų613.8 Ų13.83%0.0318%0.078CC..Hα-helixtrans-58.7-46.8-179.6-176.370.7000111.1F115 F116 E122 I123 W161 A164 L165 A168F115-L119 HydrophobicContact CE1-CD2 3.87Å; F115-L119 HydrophobicContact CZ-CD2 3.96Å; F115-L119 WeakPolarHBondContact O-CB 3.4Å; F115-L119 PolarHBondContact O-N 3.03Å; F116-L119 HydrophobicContact CD1-CD2 4.47Å; L119-E122 PolarHBondContact O-N 3.3Å; L119-I123 HydrophobicContact CD1-CD1 4.08Å; L119-I123 HydrophobicContact CD1-CG1 4.41Å; L119-I123 HydrophobicContact CG-CD1 3.84Å; L119-I123 HydrophobicContact CG-CG1 4.49Å; L119-I123 WeakPolarHBondContact O-CB 3.35Å; L119-I123 WeakPolarHBondContact O-CG1 3.19Å; L119-I123 PolarHBondContact O-N 3.27Å; L119-W161 HydrophobicContact CD2-CZ3 4.48Å; L119-A164 HydrophobicContact CD1-CB 3.88Å; L119-L165 HydrophobicContact CD1-CD2 3.86Å; L119-L165 HydrophobicContact CD1-CG 4.13Å; L119-A168 HydrophobicContact CB-CB 3.96Å; L119-A168 HydrophobicContact CD1-CB 4.25Å
120G94.1Very high94.9Very high1 Ų114.6 Ų14.61%0.018%0.081CC..Hα-helixtrans-61.2-48.817800000112.5F116 T118 E122 I123 A124F116-G120 PolarHBondContact O-N 2.89Å; T118-G120 VanDerWaalsContact C-N 3.35Å; T118-G120 PolarHBondContact O-N 3.29Å; G120-E122 PolarHBondContact O-N 3.06Å; G120-I123 PolarHBondContact O-N 3.41Å; G120-A124 WeakPolarHBondContact O-CB 3.22Å; G120-A124 PolarHBondContact O-N 2.95Å
121G92.5Very high94.3Very high6 Ų614.8 Ų14.86%0.0628%0.082CC..Hα-helixtrans-61.4-42.2178.100000113.3A117 T118 A124 L125 W265A117-G121 PolarHBondContact O-N 3.36Å; A117-G121 VanDerWaalsContact O-N 3.1Å; T118-G121 PolarHBondContact O-N 3.49Å; G121-A124 WeakPolarHBondContact O-CB 3.43Å; G121-A124 PolarHBondContact O-N 2.88Å; G121-L125 PolarHBondContact O-N 3.49Å; G121-W265 VanDerWaalsContact CA-CZ2 3.49Å
122E95.4Very high93.9Very high14 Ų1412.6 Ų12.67%0.0657%0.071CC..Hα-helixtrans-71.8-41.1179.7-72.1-64.7143.700112.8T118 L119 G120 A124 L125 W126 A164 C167 H211T118-E122 HydrophobicContact CG2-CG 4.1Å; T118-E122 WeakPolarHBondContact O-CB 3.49Å; T118-E122 VanDerWaalsContact O-CG 3.26Å; T118-E122 WeakPolarHBondContact O-CG 3.3Å; T118-E122 PolarHBondContact O-N 3.5Å; L119-E122 PolarHBondContact O-N 3.3Å; G120-E122 PolarHBondContact O-N 3.06Å; E122-A124 PolarHBondContact O-N 3.08Å; E122-L125 PolarHBondContact O-N 3.22Å; E122-W126 VanDerWaalsContact O-CD1 3.24Å; E122-W126 PolarHBondContact O-N 3.16Å; E122-W126 PolarHBondContact OE2-NE1 3.21Å; E122-A164 HydrophobicContact CB-CB 3.54Å; E122-C167 HydrophobicContact CG-CB 3.99Å; E122-H211 IonicContact OE2-CE1 3.19Å; E122-H211 IonicContact OE2-CG 3.98Å; E122-H211 IonicContact OE2-ND1 3.19Å; E122-H211 PolarHBondContact OE2-ND1 3.19Å
123I94.4Very high93.5Very high0 Ų012.9 Ų12.90%07%0.072CC..Hα-helixtrans-59.3-42173.3-67.7166.8000109.4N78 A82 L119 G120 S127 W161 A164N78-I123 WeakPolarHBondContact ND2-CG2 3.39Å; A82-I123 HydrophobicContact CB-CB 3.75Å; A82-I123 HydrophobicContact CB-CD1 4.15Å; A82-I123 HydrophobicContact CB-CG2 3.64Å; L119-I123 HydrophobicContact CD1-CD1 4.08Å; L119-I123 HydrophobicContact CD1-CG1 4.41Å; L119-I123 HydrophobicContact CG-CD1 3.84Å; L119-I123 HydrophobicContact CG-CG1 4.49Å; L119-I123 WeakPolarHBondContact O-CB 3.35Å; L119-I123 WeakPolarHBondContact O-CG1 3.19Å; L119-I123 PolarHBondContact O-N 3.27Å; G120-I123 PolarHBondContact O-N 3.41Å; I123-S127 WeakPolarHBondContact O-CB 3.4Å; I123-S127 PolarHBondContact O-N 3.28Å; I123-S127 PolarHBondContact O-OG 2.93Å; I123-W161 HydrophobicContact CD1-CD2 3.79Å; I123-W161 HydrophobicContact CD1-CE3 3.82Å; I123-W161 HydrophobicContact CD1-CG 4.49Å; I123-W161 HydrophobicContact CD1-CH2 3.8Å; I123-W161 HydrophobicContact CD1-CZ2 3.78Å; I123-W161 HydrophobicContact CD1-CZ3 3.82Å; I123-W161 HydrophobicContact CG1-CD2 4.38Å; I123-A164 HydrophobicContact CB-CB 4.37Å; I123-A164 HydrophobicContact CD1-CB 4.5Å; I123-A164 HydrophobicContact CG1-CB 3.45Å; I123-A164 VanDerWaalsContact CG1-CB 3.45Å
124A90.3Very high92.9Very high7 Ų713.6 Ų13.66%0.0588%0.076CC..Hα-helixtrans-60-49.1176.600000111.8L79 G120 G121 E122 S127 L128L79-A124 HydrophobicContact CD1-CB 3.29Å; G120-A124 WeakPolarHBondContact O-CB 3.22Å; G120-A124 PolarHBondContact O-N 2.95Å; G121-A124 WeakPolarHBondContact O-CB 3.43Å; G121-A124 PolarHBondContact O-N 2.88Å; E122-A124 PolarHBondContact O-N 3.08Å; A124-S127 PolarHBondContact O-N 3.07Å; A124-L128 WeakPolarHBondContact O-CG 2.86Å; A124-L128 PolarHBondContact O-N 3.22Å; A124-L128 VanDerWaalsContact O-N 3.08Å
125L92.1Very high92.3Very high4 Ų416.6 Ų16.62%0.0219%0.087CC..Hα-helixtrans-58.6-52.8178.2172.854.9000112.3G121 E122 S127 L128 V129 H211 P215 I219 F261G121-L125 PolarHBondContact O-N 3.49Å; E122-L125 PolarHBondContact O-N 3.22Å; L125-S127 VanDerWaalsContact C-N 3.26Å; L125-S127 PolarHBondContact O-N 2.96Å; L125-L128 WeakPolarHBondContact O-CB 3.33Å; L125-L128 PolarHBondContact O-N 3.1Å; L125-V129 PolarHBondContact O-N 3.32Å; L125-V129 VanDerWaalsContact O-N 3.07Å; L125-H211 WeakPolarHBondContact CD2-O 3.28Å; L125-P215 HydrophobicContact CD1-CB 3.55Å; L125-P215 HydrophobicContact CD1-CG 4.44Å; L125-P215 HydrophobicContact CD2-CB 3.95Å; L125-P215 HydrophobicContact CD2-CG 3.97Å; L125-P215 HydrophobicContact CG-CB 3.88Å; L125-P215 HydrophobicContact CG-CG 4.27Å; L125-I219 HydrophobicContact CD1-CD1 4.17Å; L125-F261 HydrophobicContact CB-CE2 3.86Å; L125-F261 HydrophobicContact CB-CZ 4.08Å; L125-F261 HydrophobicContact CD1-CE1 3.81Å; L125-F261 HydrophobicContact CD1-CE2 3.73Å; L125-F261 HydrophobicContact CD1-CZ 3.31Å; L125-F261 HydrophobicContact CD2-CZ 4.17Å; L125-F261 HydrophobicContact CG-CE2 4.29Å; L125-F261 HydrophobicContact CG-CZ 4.03Å
126W94.5Very high91.8Very high8 Ų816.9 Ų16.93%0.039%0.087CC..Hα-helixtrans-69.2-27.7-177.8-74.1103.4000112.5E122 L128 V129 V130 F159 M163 L210 H211 P215E122-W126 VanDerWaalsContact O-CD1 3.24Å; E122-W126 PolarHBondContact O-N 3.16Å; E122-W126 PolarHBondContact OE2-NE1 3.21Å; W126-L128 VanDerWaalsContact C-N 3.33Å; W126-V129 HydrophobicContact CE3-CB 4.1Å; W126-V129 HydrophobicContact CE3-CG1 4.18Å; W126-V129 HydrophobicContact CE3-CG2 4.09Å; W126-V129 HydrophobicContact CZ3-CG1 4.23Å; W126-V129 HydrophobicContact CZ3-CG2 4.42Å; W126-V129 PolarHBondContact O-N 3.44Å; W126-V130 VanDerWaalsContact O-CG2 3.29Å; W126-V130 WeakPolarHBondContact O-CG2 3.48Å; W126-V130 PolarHBondContact O-N 2.94Å; W126-F159 HydrophobicContact CD2-CE1 4.43Å; W126-F159 AromaticContact CE3-CE1 3.54Å; W126-F159 HydrophobicContact CE3-CE1 3.54Å; W126-F159 HydrophobicContact CE3-CZ 4.01Å; W126-F159 AromaticContact CZ3-CE1 3.8Å; W126-F159 HydrophobicContact CZ3-CE1 3.8Å; W126-F159 AromaticContact CZ3-CZ 3.85Å; W126-F159 HydrophobicContact CZ3-CZ 3.85Å; W126-M163 HydrophobicContact CB-CB 4.49Å; W126-M163 VanDerWaalsContact CD1-CB 3.5Å; W126-M163 HydrophobicContact CD2-CB 3.63Å; W126-M163 HydrophobicContact CD2-CG 3.86Å; W126-M163 HydrophobicContact CE3-CB 4.41Å; W126-M163 HydrophobicContact CE3-CG 4.14Å; W126-M163 HydrophobicContact CG-CB 3.63Å; W126-M163 HydrophobicContact CG-CG 4.27Å; W126-M163 HydrophobicContact CH2-CE 3.71Å; W126-M163 HydrophobicContact CH2-CG 4.44Å; W126-M163 HydrophobicContact CZ2-CB 4.17Å; W126-M163 HydrophobicContact CZ2-CE 3.39Å; W126-M163 HydrophobicContact CZ2-CG 4.21Å; W126-M163 HydrophobicContact CZ3-CG 4.42Å; W126-L210 WeakPolarHBondContact CZ2-O 3.4Å; W126-H211 AromaticContact NE1-CE1 3.66Å; W126-H211 AromaticContact NE1-ND1 3.26Å; W126-H211 PolarHBondContact NE1-ND1 3.2Å; W126-P215 HydrophobicContact CH2-CG 3.89Å; W126-P215 HydrophobicContact CZ2-CG 3.77Å; W126-P215 HydrophobicContact CZ3-CG 4.39Å
127S90.4Very high91.3Very high2 Ų216 Ų161%0.0149%0.086CC..Hα-helixtrans-64.8-37.3170-61.10000112.2N78 I123 A124 L125 V130 L131N78-S127 PolarHBondContact ND2-OG 3.42Å; I123-S127 WeakPolarHBondContact O-CB 3.4Å; I123-S127 PolarHBondContact O-N 3.28Å; I123-S127 PolarHBondContact O-OG 2.93Å; A124-S127 PolarHBondContact O-N 3.07Å; L125-S127 VanDerWaalsContact C-N 3.26Å; L125-S127 PolarHBondContact O-N 2.96Å; S127-V130 PolarHBondContact O-N 3.46Å; S127-L131 WeakPolarHBondContact O-CB 3.21Å; S127-L131 PolarHBondContact O-N 2.98Å
128L87.9Confident90.6Very high14 Ų1418.6 Ų18.67%0.07310%0.1CC..Hα-helixtrans-66.7-38.6173.5-67.3173.9000112.1A124 L125 W126 L131 A132 I219 M257 F261A124-L128 WeakPolarHBondContact O-CG 2.86Å; A124-L128 PolarHBondContact O-N 3.22Å; A124-L128 VanDerWaalsContact O-N 3.08Å; L125-L128 WeakPolarHBondContact O-CB 3.33Å; L125-L128 PolarHBondContact O-N 3.1Å; W126-L128 VanDerWaalsContact C-N 3.33Å; L128-L131 PolarHBondContact O-N 3.25Å; L128-A132 WeakPolarHBondContact O-CB 3.27Å; L128-A132 PolarHBondContact O-N 2.84Å; L128-I219 HydrophobicContact CB-CD1 4.02Å; L128-M257 HydrophobicContact CD2-CE 3.23Å; L128-F261 HydrophobicContact CD1-CB 3.76Å; L128-F261 HydrophobicContact CD1-CD2 3.52Å; L128-F261 HydrophobicContact CD1-CE2 4.4Å; L128-F261 HydrophobicContact CD1-CG 3.78Å
129V92.1Very high89.9Confident6 Ų620 Ų204%0.03611%0.109CC..Hα-helixtrans-61.3-49.8174175.60000110.5L125 W126 L131 A132 V133 P215 I218 I219L125-V129 PolarHBondContact O-N 3.32Å; L125-V129 VanDerWaalsContact O-N 3.07Å; W126-V129 HydrophobicContact CE3-CB 4.1Å; W126-V129 HydrophobicContact CE3-CG1 4.18Å; W126-V129 HydrophobicContact CE3-CG2 4.09Å; W126-V129 HydrophobicContact CZ3-CG1 4.23Å; W126-V129 HydrophobicContact CZ3-CG2 4.42Å; W126-V129 PolarHBondContact O-N 3.44Å; V129-L131 VanDerWaalsContact C-N 3.29Å; V129-L131 PolarHBondContact O-N 2.84Å; V129-A132 PolarHBondContact O-N 3.43Å; V129-A132 VanDerWaalsContact O-N 3.16Å; V129-V133 WeakPolarHBondContact O-CG2 2.9Å; V129-V133 PolarHBondContact O-N 3.27Å; V129-P215 HydrophobicContact CG2-CB 3.67Å; V129-P215 HydrophobicContact CG2-CG 4.49Å; V129-I218 HydrophobicContact CG1-CB 4.35Å; V129-I218 HydrophobicContact CG1-CD1 4.23Å; V129-I218 HydrophobicContact CG1-CG2 3.85Å; V129-I219 HydrophobicContact CG2-CD1 3.94Å; V129-I219 HydrophobicContact CG2-CG1 4.01Å
130V90.9Very high89.3Confident22 Ų2220.8 Ų20.813%0.13311%0.114CC..Hα-helixtrans-57.9-44.1178.2169.20000110.7W126 S127 V133 E134 G156 F159W126-V130 VanDerWaalsContact O-CG2 3.29Å; W126-V130 WeakPolarHBondContact O-CG2 3.48Å; W126-V130 PolarHBondContact O-N 2.94Å; S127-V130 PolarHBondContact O-N 3.46Å; V130-V133 PolarHBondContact O-N 3.29Å; V130-E134 WeakPolarHBondContact O-CB 3.1Å; V130-E134 PolarHBondContact O-N 3.13Å; V130-G156 WeakPolarHBondContact CG2-O 3.48Å; V130-F159 HydrophobicContact CG2-CD1 4.1Å
131L86.6Confident88.5Confident4 Ų426.2 Ų26.22%0.02114%0.138CC..Hα-helixtrans-64.1-43.5176.6-174.666000112.3V75 S127 L128 V129 V133 E134 R135 M253 M257V75-L131 HydrophobicContact CG1-CB 4.48Å; V75-L131 HydrophobicContact CG1-CD2 4.46Å; V75-L131 HydrophobicContact CG2-CB 4.25Å; V75-L131 HydrophobicContact CG2-CD1 4.45Å; S127-L131 WeakPolarHBondContact O-CB 3.21Å; S127-L131 PolarHBondContact O-N 2.98Å; L128-L131 PolarHBondContact O-N 3.25Å; V129-L131 VanDerWaalsContact C-N 3.29Å; V129-L131 PolarHBondContact O-N 2.84Å; L131-V133 VanDerWaalsContact C-N 3.32Å; L131-V133 PolarHBondContact O-N 3.43Å; L131-E134 PolarHBondContact O-N 2.75Å; L131-R135 HydrophobicContact CD1-CG 4.27Å; L131-R135 HydrophobicContact CG-CG 4.37Å; L131-R135 WeakPolarHBondContact O-CB 3.24Å; L131-R135 VanDerWaalsContact O-CG 3.27Å; L131-R135 WeakPolarHBondContact O-CG 3.46Å; L131-R135 PolarHBondContact O-N 2.9Å; L131-M253 HydrophobicContact CD2-CE 4.03Å; L131-M257 HydrophobicContact CD2-CE 3.19Å; L131-M257 HydrophobicContact CD2-SD 3.83Å
132A88.7Confident87.3Confident0 Ų031.3 Ų31.30%017%0.17CC..Hα-helixtrans-61.3-42.8179.100000111.2L128 V129 Y136 I219 C222 Y223L128-A132 WeakPolarHBondContact O-CB 3.27Å; L128-A132 PolarHBondContact O-N 2.84Å; V129-A132 PolarHBondContact O-N 3.43Å; V129-A132 VanDerWaalsContact O-N 3.16Å; A132-Y136 WeakPolarHBondContact O-CB 3.45Å; A132-Y136 PolarHBondContact O-N 2.87Å; A132-I219 HydrophobicContact CB-CG1 4.29Å; A132-C222 HydrophobicContact CB-CB 3.88Å; A132-C222 WeakPolarHBondContact O-CB 3.37Å; A132-Y223 HydrophobicContact CB-CD2 4.35Å; A132-Y223 HydrophobicContact CB-CE1 4.13Å; A132-Y223 HydrophobicContact CB-CE2 3.98Å
133V90.1Very high86Confident60 Ų6035.3 Ų35.336%0.36419%0.19SC..Hα-helixtrans-66.1-45.9176.4173.80000111.3V129 V130 L131 R135 Y136 V137 I218V129-V133 WeakPolarHBondContact O-CG2 2.9Å; V129-V133 PolarHBondContact O-N 3.27Å; V130-V133 PolarHBondContact O-N 3.29Å; L131-V133 VanDerWaalsContact C-N 3.32Å; L131-V133 PolarHBondContact O-N 3.43Å; V133-R135 PolarHBondContact O-N 3.2Å; V133-Y136 PolarHBondContact O-N 3.4Å; V133-V137 HydrophobicContact CG1-CG2 4.33Å; V133-V137 WeakPolarHBondContact O-CG2 3.21Å; V133-V137 PolarHBondContact O-N 3.4Å; V133-I218 HydrophobicContact CG2-CG2 3.82Å
134E86.3Confident84.4Confident15 Ų1542.3 Ų42.37%0.0723%0.232CC..Hα-helixtrans-56-50.3176.3179.9-86.7164.900111.1P71 V130 L131 Y136 V137 V138 F148P71-E134 HydrophobicContact CB-CG 4.26Å; V130-E134 WeakPolarHBondContact O-CB 3.1Å; V130-E134 PolarHBondContact O-N 3.13Å; L131-E134 PolarHBondContact O-N 2.75Å; E134-Y136 VanDerWaalsContact C-N 3.33Å; E134-Y136 PolarHBondContact O-N 3.21Å; E134-V137 PolarHBondContact O-N 2.96Å; E134-V138 HydrophobicContact CG-CG2 4.38Å; E134-V138 WeakPolarHBondContact O-CB 3.38Å; E134-V138 WeakPolarHBondContact O-CG2 3.47Å; E134-V138 PolarHBondContact O-N 3.37Å; E134-F148 HydrophobicContact CB-CE2 4.14Å; E134-F148 HydrophobicContact CB-CZ 4.16Å; E134-F148 HydrophobicContact CG-CD1 3.91Å; E134-F148 HydrophobicContact CG-CD2 3.99Å; E134-F148 HydrophobicContact CG-CE1 3.73Å; E134-F148 HydrophobicContact CG-CE2 3.82Å; E134-F148 HydrophobicContact CG-CG 4.02Å; E134-F148 HydrophobicContact CG-CZ 3.68Å
135R85.7Confident83.4Confident62 Ų6249.8 Ų49.823%0.23427%0.272CS..Hα-helixtrans-62.4-41.4179.4-69.1-61.7-179.3-175.4-1.9112.4L131 V133 V139 L226L131-R135 HydrophobicContact CD1-CG 4.27Å; L131-R135 HydrophobicContact CG-CG 4.37Å; L131-R135 WeakPolarHBondContact O-CB 3.24Å; L131-R135 VanDerWaalsContact O-CG 3.27Å; L131-R135 WeakPolarHBondContact O-CG 3.46Å; L131-R135 PolarHBondContact O-N 2.9Å; V133-R135 PolarHBondContact O-N 3.2Å; R135-V139 WeakPolarHBondContact O-CB 3.24Å; R135-V139 WeakPolarHBondContact O-CG2 3.41Å; R135-V139 PolarHBondContact O-N 2.91Å; R135-V139 VanDerWaalsContact O-N 3.08Å; R135-L226 HydrophobicContact CB-CD2 3.98Å
136Y87.4Confident82.7Confident42 Ų4253.4 Ų53.417%0.16529%0.287CS..Hα-helixtrans-60.8-48.8175170.5-103.9000111.6A132 V133 E134 C140 K141 R225A132-Y136 WeakPolarHBondContact O-CB 3.45Å; A132-Y136 PolarHBondContact O-N 2.87Å; V133-Y136 PolarHBondContact O-N 3.4Å; E134-Y136 VanDerWaalsContact C-N 3.33Å; E134-Y136 PolarHBondContact O-N 3.21Å; Y136-C140 HydrophobicContact CD2-CB 3.69Å; Y136-C140 HydrophobicContact CE2-CB 3.65Å; Y136-C140 WeakPolarHBondContact O-CA 2.85Å; Y136-C140 WeakPolarHBondContact O-CB 3.48Å; Y136-C140 PolarHBondContact O-N 3.13Å; Y136-K141 HydrophobicContact CE1-CG 4.26Å; Y136-K141 WeakPolarHBondContact OH-CE 3.41Å; Y136-R225 HydrophobicContact CD2-CB 3.71Å; Y136-R225 HydrophobicContact CD2-CG 4.44Å; Y136-R225 HydrophobicContact CE2-CB 3.58Å; Y136-R225 HydrophobicContact CE2-CG 3.98Å
137V86.4Confident81.9Confident30 Ų3062.9 Ų62.918%0.18232%0.323CS..Hα-helixtrans-64.6-49.7-178.7173.30000110.8V133 E134 V139 K141 M143 F146V133-V137 HydrophobicContact CG1-CG2 4.33Å; V133-V137 WeakPolarHBondContact O-CG2 3.21Å; V133-V137 PolarHBondContact O-N 3.4Å; E134-V137 PolarHBondContact O-N 2.96Å; V137-V139 PolarHBondContact O-N 3.45Å; V137-K141 CarbonylContact O-C 3.48Å; V137-K141 VanDerWaalsContact O-C 3.24Å; V137-K141 WeakPolarHBondContact O-CA 3.38Å; V137-K141 PolarHBondContact O-N 3.48Å; V137-M143 HydrophobicContact CG1-CE 4.06Å; V137-F146 HydrophobicContact CG1-CD1 3.99Å; V137-F146 HydrophobicContact CG1-CE1 3.62Å
138V82.6Confident81.3Confident67 Ų6764.9 Ų64.941%0.40633%0.331SS..Hα-helixtrans-64.8-37.5-175.8171.60000112.4E134 F148E134-V138 HydrophobicContact CG-CG2 4.38Å; E134-V138 WeakPolarHBondContact O-CB 3.38Å; E134-V138 WeakPolarHBondContact O-CG2 3.47Å; E134-V138 PolarHBondContact O-N 3.37Å; V138-F148 HydrophobicContact CG2-CB 3.76Å; V138-F148 HydrophobicContact CG2-CG 4.38Å
139V81.9Confident81Confident51 Ų5168.6 Ų68.631%0.30935%0.348SS..Hα-helixtrans-97.7-43.9-173.4-178.10000112.8R135 V137 L226 V230R135-V139 WeakPolarHBondContact O-CB 3.24Å; R135-V139 WeakPolarHBondContact O-CG2 3.41Å; R135-V139 PolarHBondContact O-N 2.91Å; R135-V139 VanDerWaalsContact O-N 3.08Å; V137-V139 PolarHBondContact O-N 3.45Å; V139-L226 HydrophobicContact CB-CD1 3.47Å; V139-L226 VanDerWaalsContact CB-CD1 3.47Å; V139-L226 HydrophobicContact CG1-CD1 3.58Å; V139-L226 HydrophobicContact CG2-CD1 3.72Å; V139-V230 HydrophobicContact CG1-CG2 3.8Å
140C84.2Confident80.4Confident22 Ų2273.5 Ų73.515%0.14937%0.371CS..Hα-helixtrans-89.6-19.7-173.3-53.50000113.3Y136 P142 R225 L226 T229Y136-C140 HydrophobicContact CD2-CB 3.69Å; Y136-C140 HydrophobicContact CE2-CB 3.65Å; Y136-C140 WeakPolarHBondContact O-CA 2.85Å; Y136-C140 WeakPolarHBondContact O-CB 3.48Å; Y136-C140 PolarHBondContact O-N 3.13Å; C140-P142 VanDerWaalsContact C-CD 3.47Å; C140-R225 PolarHBondContact SG-O 3Å; C140-L226 VanDerWaalsContact SG-CA 3.53Å; C140-T229 PolarHBondContact SG-OG1 3.08Å
141K78.3Confident80.2Confident115 Ų11578.3 Ų78.350%0.539%0.39SS..  trans-128.971-178.4-66.4-68.2-172.9173.90109.5Y136 V137 M143Y136-K141 HydrophobicContact CE1-CG 4.26Å; Y136-K141 WeakPolarHBondContact OH-CE 3.41Å; V137-K141 CarbonylContact O-C 3.48Å; V137-K141 VanDerWaalsContact O-C 3.24Å; V137-K141 WeakPolarHBondContact O-CA 3.38Å; V137-K141 PolarHBondContact O-N 3.48Å; K141-M143 PolarHBondContact O-N 3.18Å
142P66.9Low80.2Confident113 Ų11380.8 Ų80.873%0.73440%0.401SS*.  trans-6683.3170.729.2-33000108.5C140 T144C140-P142 VanDerWaalsContact C-CD 3.47Å; P142-T144 PolarHBondContact O-N 3.24Å
143M67.6Low80Confident98 Ų9881 Ų8148%0.48340%0.403SS..  trans-73.7121.6176.1-76.5-165.1-80.300107.3V137 K141 N145 F146V137-M143 HydrophobicContact CG1-CE 4.06Å; K141-M143 PolarHBondContact O-N 3.18Å; M143-N145 PolarHBondContact O-N 3.28Å; M143-F146 HydrophobicContact CB-CB 3.73Å; M143-F146 HydrophobicContact CE-CB 3.53Å; M143-F146 HydrophobicContact CE-CD1 3.37Å; M143-F146 HydrophobicContact CE-CD2 4.24Å; M143-F146 HydrophobicContact CE-CE1 4.11Å; M143-F146 HydrophobicContact CE-CG 3.44Å; M143-F146 VanDerWaalsContact CE-CG 3.44Å; M143-F146 HydrophobicContact CG-CB 4.47Å; M143-F146 PolarHBondContact O-N 2.91Å; M143-F146 HydrophobicContact SD-CB 4.06Å
144T61.5Low79.8Confident146 Ų14682.6 Ų82.690%0.89641%0.409SS*.THydrogen-bonded Turntrans-54.3-26.4-178.315.80000113.6P142P142-T144 PolarHBondContact O-N 3.24Å
145N69.9Low80.1Confident165 Ų16584.7 Ų84.788%0.88243%0.428SS*.THydrogen-bonded Turntrans-115.82.5-176.9-64.6-25.6000114.9M143M143-N145 PolarHBondContact O-N 3.28Å
146F77.1Confident80.4Confident79 Ų7982.2 Ų82.235%0.34642%0.422SS..  trans-120.1121.1-178.5176.6-89.9000110.9V137 M143 F148 H152V137-F146 HydrophobicContact CG1-CD1 3.99Å; V137-F146 HydrophobicContact CG1-CE1 3.62Å; M143-F146 HydrophobicContact CB-CB 3.73Å; M143-F146 HydrophobicContact CE-CB 3.53Å; M143-F146 HydrophobicContact CE-CD1 3.37Å; M143-F146 HydrophobicContact CE-CD2 4.24Å; M143-F146 HydrophobicContact CE-CE1 4.11Å; M143-F146 HydrophobicContact CE-CG 3.44Å; M143-F146 VanDerWaalsContact CE-CG 3.44Å; M143-F146 HydrophobicContact CG-CB 4.47Å; M143-F146 PolarHBondContact O-N 2.91Å; M143-F146 HydrophobicContact SD-CB 4.06Å; F146-F148 HydrophobicContact CE1-CB 4.48Å; F146-F148 HydrophobicContact CE1-CD2 4.48Å; F146-F148 HydrophobicContact CZ-CD2 4.46Å; F146-H152 AromaticContact CE2-CE1 3.9Å; F146-H152 AromaticContact CE2-NE2 3.66Å
147R77.4Confident80.6Confident208 Ų20881.4 Ų81.479%0.78542%0.421SS*.  trans-117.3130.9172.9-172.5174.3176.8175.6-1108.9E149R147-E149 PolarHBondContact O-N 2.98Å
148F77.1Confident80.9Confident44 Ų4482.6 Ų82.619%0.19343%0.434CS..  trans-69.6100.2175.3-164.8-87.7000110P71 E134 V138 F146 H152 A153P71-F148 HydrophobicContact CB-CD1 4.1Å; P71-F148 HydrophobicContact CB-CE1 3.79Å; P71-F148 HydrophobicContact CG-CD1 3.66Å; P71-F148 HydrophobicContact CG-CE1 3.78Å; E134-F148 HydrophobicContact CB-CE2 4.14Å; E134-F148 HydrophobicContact CB-CZ 4.16Å; E134-F148 HydrophobicContact CG-CD1 3.91Å; E134-F148 HydrophobicContact CG-CD2 3.99Å; E134-F148 HydrophobicContact CG-CE1 3.73Å; E134-F148 HydrophobicContact CG-CE2 3.82Å; E134-F148 HydrophobicContact CG-CG 4.02Å; E134-F148 HydrophobicContact CG-CZ 3.68Å; V138-F148 HydrophobicContact CG2-CB 3.76Å; V138-F148 HydrophobicContact CG2-CG 4.38Å; F146-F148 HydrophobicContact CE1-CB 4.48Å; F146-F148 HydrophobicContact CE1-CD2 4.48Å; F146-F148 HydrophobicContact CZ-CD2 4.46Å; F148-H152 HydrophobicContact CD2-CB 3.92Å; F148-H152 HydrophobicContact CE1-CB 4.2Å; F148-H152 HydrophobicContact CE2-CB 3.53Å; F148-H152 HydrophobicContact CG-CB 4.42Å; F148-H152 HydrophobicContact CZ-CB 3.69Å; F148-A153 HydrophobicContact CE1-CB 3.91Å; F148-A153 HydrophobicContact CZ-CB 4.39Å
149E82.1Confident81.6Confident91 Ų9183.7 Ų83.743%0.42543%0.433SS..  trans-89.5166.6176-68.4168.8-162.100113.2R147 K151 H152 A153R147-E149 PolarHBondContact O-N 2.98Å; E149-K151 HydrophobicContact CB-CG 4.16Å; E149-K151 PolarHBondContact O-N 3.07Å; E149-K151 IonicContact OE1-NZ 3.88Å; E149-K151 WeakPolarHBondContact OE2-CD 3.26Å; E149-K151 WeakPolarHBondContact OE2-CE 3.39Å; E149-K151 IonicContact OE2-NZ 3.82Å; E149-K151 PolarHBondContact OE2-NZ 2.73Å; E149-H152 PolarHBondContact N-ND1 3.33Å; E149-H152 WeakPolarHBondContact O-CB 3.39Å; E149-H152 PolarHBondContact O-N 2.88Å; E149-H152 PolarHBondContact O-ND1 2.83Å; E149-A153 PolarHBondContact O-N 3.27Å
150E79.7Confident82.3Confident109 Ų10981.2 Ų81.251%0.50942%0.418SS..Hα-helixtrans-53.5-36.3176.3-178.2170.5-161.800113.5Y74 H152 A153 I154Y74-E150 HydrophobicContact CE2-CG 4.13Å; Y74-E150 PolarHBondContact OH-OE1 3.47Å; E150-H152 PolarHBondContact O-N 2.93Å; E150-A153 WeakPolarHBondContact O-CB 3.3Å; E150-A153 PolarHBondContact O-N 3.14Å; E150-I154 HydrophobicContact CG-CD1 3.95Å; E150-I154 HydrophobicContact CG-CG1 4.37Å; E150-I154 WeakPolarHBondContact O-CG1 3.38Å; E150-I154 PolarHBondContact O-N 3.37Å
151K85.9Confident82.9Confident124 Ų12483.6 Ų83.654%0.53942%0.424SS..Hα-helixtrans-57.9-36.4176.771.6-168.1-175.7-153.20113E149 A155E149-K151 HydrophobicContact CB-CG 4.16Å; E149-K151 PolarHBondContact O-N 3.07Å; E149-K151 IonicContact OE1-NZ 3.88Å; E149-K151 WeakPolarHBondContact OE2-CD 3.26Å; E149-K151 WeakPolarHBondContact OE2-CE 3.39Å; E149-K151 IonicContact OE2-NZ 3.82Å; E149-K151 PolarHBondContact OE2-NZ 2.73Å; K151-A155 WeakPolarHBondContact O-CB 3.43Å; K151-A155 PolarHBondContact O-N 2.97Å
152H87.4Confident83.8Confident55 Ų5582.1 Ų82.126%0.25543%0.425SS..Hα-helixtrans-74.4-35.3177.7-50.3104.2000111.1F146 F148 E149 E150 A155 G156F146-H152 AromaticContact CE2-CE1 3.9Å; F146-H152 AromaticContact CE2-NE2 3.66Å; F148-H152 HydrophobicContact CD2-CB 3.92Å; F148-H152 HydrophobicContact CE1-CB 4.2Å; F148-H152 HydrophobicContact CE2-CB 3.53Å; F148-H152 HydrophobicContact CG-CB 4.42Å; F148-H152 HydrophobicContact CZ-CB 3.69Å; E149-H152 PolarHBondContact N-ND1 3.33Å; E149-H152 WeakPolarHBondContact O-CB 3.39Å; E149-H152 PolarHBondContact O-N 2.88Å; E149-H152 PolarHBondContact O-ND1 2.83Å; E150-H152 PolarHBondContact O-N 2.93Å; H152-A155 PolarHBondContact O-N 3.14Å; H152-G156 PolarHBondContact O-N 2.74Å
153A84.4Confident85.3Confident5 Ų577.9 Ų77.94%0.04140%0.396CS..Hα-helixtrans-61.1-50.6173.300000110.6Y74 F148 E149 E150 A155 G156 L157Y74-A153 HydrophobicContact CD2-CB 4Å; F148-A153 HydrophobicContact CE1-CB 3.91Å; F148-A153 HydrophobicContact CZ-CB 4.39Å; E149-A153 PolarHBondContact O-N 3.27Å; E150-A153 WeakPolarHBondContact O-CB 3.3Å; E150-A153 PolarHBondContact O-N 3.14Å; A153-A155 PolarHBondContact O-N 3.1Å; A153-G156 PolarHBondContact O-N 3.26Å; A153-G156 VanDerWaalsContact O-N 3.16Å; A153-L157 WeakPolarHBondContact O-CG 3.43Å; A153-L157 PolarHBondContact O-N 3.41Å
154I87.1Confident86.8Confident93 Ų9373.2 Ų73.248%0.47737%0.373SS..Hα-helixtrans-61.6-43.2178.8-64.5170.2000111E150 G156 L157 A158E150-I154 HydrophobicContact CG-CD1 3.95Å; E150-I154 HydrophobicContact CG-CG1 4.37Å; E150-I154 WeakPolarHBondContact O-CG1 3.38Å; E150-I154 PolarHBondContact O-N 3.37Å; I154-G156 VanDerWaalsContact C-N 3.32Å; I154-G156 PolarHBondContact O-N 2.81Å; I154-L157 PolarHBondContact O-N 3.32Å; I154-A158 PolarHBondContact O-N 3.2Å
155A91.7Very high88.5Confident59 Ų5969.7 Ų69.749%0.48835%0.348SS..Hα-helixtrans-60.6-41.1175.300000112.1K151 H152 A153 A158 F159K151-A155 WeakPolarHBondContact O-CB 3.43Å; K151-A155 PolarHBondContact O-N 2.97Å; H152-A155 PolarHBondContact O-N 3.14Å; A153-A155 PolarHBondContact O-N 3.1Å; A155-A158 PolarHBondContact O-N 3.37Å; A155-F159 WeakPolarHBondContact O-CB 3.42Å; A155-F159 PolarHBondContact O-N 3.46Å
156G91.9Very high89.9Confident10 Ų1064.1 Ų64.110%0.10332%0.32CS..Hα-helixtrans-63-39.8173.800000112.8V130 H152 A153 I154 F159 S160V130-G156 WeakPolarHBondContact CG2-O 3.48Å; H152-G156 PolarHBondContact O-N 2.74Å; A153-G156 PolarHBondContact O-N 3.26Å; A153-G156 VanDerWaalsContact O-N 3.16Å; I154-G156 VanDerWaalsContact C-N 3.32Å; I154-G156 PolarHBondContact O-N 2.81Å; G156-F159 WeakPolarHBondContact O-CB 3.38Å; G156-F159 PolarHBondContact O-N 3.23Å; G156-S160 PolarHBondContact O-N 2.81Å
157L90.9Very high90.9Very high26 Ų2660.4 Ų60.414%0.13630%0.303CS..Hα-helixtrans-62.9-51.2173.3-61.4-167.7000110.7N78 A153 I154 F159 S160 W161N78-L157 HydrophobicContact CB-CD1 4.3Å; N78-L157 HydrophobicContact CB-CD2 3.64Å; A153-L157 WeakPolarHBondContact O-CG 3.43Å; A153-L157 PolarHBondContact O-N 3.41Å; I154-L157 PolarHBondContact O-N 3.32Å; L157-F159 PolarHBondContact O-N 2.97Å; L157-S160 WeakPolarHBondContact O-CB 3.44Å; L157-S160 PolarHBondContact O-N 3.18Å; L157-S160 PolarHBondContact O-OG 2.92Å; L157-W161 VanDerWaalsContact O-CD1 3.28Å; L157-W161 PolarHBondContact O-N 3Å; L157-W161 VanDerWaalsContact O-N 3.17Å
158A94.5Very high91.9Very high55 Ų5550.5 Ų50.546%0.45527%0.266SS..Hα-helixtrans-56-41.3177.400000111.9I154 A155 S160 W161 V162I154-A158 PolarHBondContact O-N 3.2Å; A155-A158 PolarHBondContact O-N 3.37Å; A158-S160 PolarHBondContact O-N 2.92Å; A158-W161 PolarHBondContact O-N 3.33Å; A158-V162 WeakPolarHBondContact O-CG2 3.26Å; A158-V162 PolarHBondContact O-N 3.47Å
159F96Very high92.9Very high89 Ų8949.4 Ų49.439%0.3927%0.265SS..Hα-helixtrans-58.6-45.2173.8173.8-103.9000112.3W126 V130 A155 G156 L157 W161 V162 M163W126-F159 HydrophobicContact CD2-CE1 4.43Å; W126-F159 AromaticContact CE3-CE1 3.54Å; W126-F159 HydrophobicContact CE3-CE1 3.54Å; W126-F159 HydrophobicContact CE3-CZ 4.01Å; W126-F159 AromaticContact CZ3-CE1 3.8Å; W126-F159 HydrophobicContact CZ3-CE1 3.8Å; W126-F159 AromaticContact CZ3-CZ 3.85Å; W126-F159 HydrophobicContact CZ3-CZ 3.85Å; V130-F159 HydrophobicContact CG2-CD1 4.1Å; A155-F159 WeakPolarHBondContact O-CB 3.42Å; A155-F159 PolarHBondContact O-N 3.46Å; G156-F159 WeakPolarHBondContact O-CB 3.38Å; G156-F159 PolarHBondContact O-N 3.23Å; L157-F159 PolarHBondContact O-N 2.97Å; F159-W161 VanDerWaalsContact C-N 3.28Å; F159-W161 PolarHBondContact O-N 3.27Å; F159-V162 PolarHBondContact O-N 3Å; F159-M163 HydrophobicContact CD1-CG 4.31Å; F159-M163 HydrophobicContact CD2-CG 4.03Å; F159-M163 HydrophobicContact CD2-SD 4.5Å; F159-M163 HydrophobicContact CE1-CG 3.87Å; F159-M163 HydrophobicContact CE2-CG 3.54Å; F159-M163 HydrophobicContact CE2-SD 3.71Å; F159-M163 HydrophobicContact CG-CG 4.39Å; F159-M163 HydrophobicContact CZ-CG 3.45Å; F159-M163 VanDerWaalsContact CZ-CG 3.45Å; F159-M163 HydrophobicContact CZ-SD 3.93Å; F159-M163 WeakPolarHBondContact O-CG 3.33Å; F159-M163 PolarHBondContact O-N 3.38Å
160S96Very high93.7Very high0 Ų046.1 Ų46.10%025%0.252CS..Hα-helixtrans-60.2-37.217871.80000113.2N78 G156 L157 A158 A164N78-S160 PolarHBondContact ND2-OG 3.24Å; G156-S160 PolarHBondContact O-N 2.81Å; L157-S160 WeakPolarHBondContact O-CB 3.44Å; L157-S160 PolarHBondContact O-N 3.18Å; L157-S160 PolarHBondContact O-OG 2.92Å; A158-S160 PolarHBondContact O-N 2.92Å; S160-A164 VanDerWaalsContact O-CB 3.26Å; S160-A164 WeakPolarHBondContact O-CB 3.39Å; S160-A164 PolarHBondContact O-N 3.19Å
161W97.5Very high94.5Very high71 Ų7141.3 Ų41.327%0.26923%0.23SC..Hα-helixtrans-70-43.3176.3-80.879.2000112.2N78 V81 F85 L119 I123 L157 A158 F159 A164 L165N78-W161 PolarHBondContact OD1-NE1 3.17Å; V81-W161 HydrophobicContact CG1-CH2 4.29Å; V81-W161 HydrophobicContact CG1-CZ2 3.87Å; F85-W161 AromaticContact CD2-CH2 3.86Å; F85-W161 HydrophobicContact CD2-CH2 3.86Å; F85-W161 AromaticContact CE2-CH2 3.56Å; F85-W161 HydrophobicContact CE2-CH2 3.56Å; F85-W161 HydrophobicContact CE2-CZ2 4.39Å; F85-W161 HydrophobicContact CE2-CZ3 4.46Å; F85-W161 HydrophobicContact CZ-CH2 4.33Å; L119-W161 HydrophobicContact CD2-CZ3 4.48Å; I123-W161 HydrophobicContact CD1-CD2 3.79Å; I123-W161 HydrophobicContact CD1-CE3 3.82Å; I123-W161 HydrophobicContact CD1-CG 4.49Å; I123-W161 HydrophobicContact CD1-CH2 3.8Å; I123-W161 HydrophobicContact CD1-CZ2 3.78Å; I123-W161 HydrophobicContact CD1-CZ3 3.82Å; I123-W161 HydrophobicContact CG1-CD2 4.38Å; L157-W161 VanDerWaalsContact O-CD1 3.28Å; L157-W161 PolarHBondContact O-N 3Å; L157-W161 VanDerWaalsContact O-N 3.17Å; A158-W161 PolarHBondContact O-N 3.33Å; F159-W161 VanDerWaalsContact C-N 3.28Å; F159-W161 PolarHBondContact O-N 3.27Å; W161-A164 PolarHBondContact O-N 3.45Å; W161-L165 WeakPolarHBondContact O-CB 3.38Å; W161-L165 WeakPolarHBondContact O-CG 3.39Å; W161-L165 PolarHBondContact O-N 3.45Å
162V98.2Very high95.1Very high85 Ų8538.6 Ų38.652%0.51522%0.221SC..Hα-helixtrans-59.1-51.4176170.50000109.7A158 F159 A164 L165 T166A158-V162 WeakPolarHBondContact O-CG2 3.26Å; A158-V162 PolarHBondContact O-N 3.47Å; F159-V162 PolarHBondContact O-N 3Å; V162-A164 VanDerWaalsContact C-N 3.33Å; V162-A164 PolarHBondContact O-N 3.17Å; V162-L165 PolarHBondContact O-N 3.25Å; V162-T166 WeakPolarHBondContact O-CG2 3.11Å; V162-T166 PolarHBondContact O-N 2.89Å
163M98.1Very high95.6Very high24 Ų2444.2 Ų44.212%0.11825%0.245CC..Hα-helixtrans-62.3-40.1178.6-64.4-53.4-63.200111.9W126 F159 L165 T166 C167 L210 H211W126-M163 HydrophobicContact CB-CB 4.49Å; W126-M163 VanDerWaalsContact CD1-CB 3.5Å; W126-M163 HydrophobicContact CD2-CB 3.63Å; W126-M163 HydrophobicContact CD2-CG 3.86Å; W126-M163 HydrophobicContact CE3-CB 4.41Å; W126-M163 HydrophobicContact CE3-CG 4.14Å; W126-M163 HydrophobicContact CG-CB 3.63Å; W126-M163 HydrophobicContact CG-CG 4.27Å; W126-M163 HydrophobicContact CH2-CE 3.71Å; W126-M163 HydrophobicContact CH2-CG 4.44Å; W126-M163 HydrophobicContact CZ2-CB 4.17Å; W126-M163 HydrophobicContact CZ2-CE 3.39Å; W126-M163 HydrophobicContact CZ2-CG 4.21Å; W126-M163 HydrophobicContact CZ3-CG 4.42Å; F159-M163 HydrophobicContact CD1-CG 4.31Å; F159-M163 HydrophobicContact CD2-CG 4.03Å; F159-M163 HydrophobicContact CD2-SD 4.5Å; F159-M163 HydrophobicContact CE1-CG 3.87Å; F159-M163 HydrophobicContact CE2-CG 3.54Å; F159-M163 HydrophobicContact CE2-SD 3.71Å; F159-M163 HydrophobicContact CG-CG 4.39Å; F159-M163 HydrophobicContact CZ-CG 3.45Å; F159-M163 VanDerWaalsContact CZ-CG 3.45Å; F159-M163 HydrophobicContact CZ-SD 3.93Å; F159-M163 WeakPolarHBondContact O-CG 3.33Å; F159-M163 PolarHBondContact O-N 3.38Å; M163-L165 VanDerWaalsContact C-N 3.3Å; M163-L165 PolarHBondContact O-N 2.89Å; M163-T166 PolarHBondContact O-N 2.62Å; M163-T166 PolarHBondContact O-OG1 2.93Å; M163-C167 PolarHBondContact O-N 2.93Å; M163-L210 HydrophobicContact CE-CD1 4.17Å; M163-L210 HydrophobicContact CE-CD2 3.93Å; M163-L210 HydrophobicContact CE-CG 4.04Å; M163-H211 PolarHBondContact O-CE1 3.25Å
164A98Very high96Very high0 Ų046 Ų460%026%0.264CS..Hα-helixtrans-62.4-39.3176.400000112.7L119 E122 I123 S160 W161 V162 C167 A168L119-A164 HydrophobicContact CD1-CB 3.88Å; E122-A164 HydrophobicContact CB-CB 3.54Å; I123-A164 HydrophobicContact CB-CB 4.37Å; I123-A164 HydrophobicContact CD1-CB 4.5Å; I123-A164 HydrophobicContact CG1-CB 3.45Å; I123-A164 VanDerWaalsContact CG1-CB 3.45Å; S160-A164 VanDerWaalsContact O-CB 3.26Å; S160-A164 WeakPolarHBondContact O-CB 3.39Å; S160-A164 PolarHBondContact O-N 3.19Å; W161-A164 PolarHBondContact O-N 3.45Å; V162-A164 VanDerWaalsContact C-N 3.33Å; V162-A164 PolarHBondContact O-N 3.17Å; A164-C167 PolarHBondContact O-N 3.5Å; A164-A168 WeakPolarHBondContact O-CB 3.26Å; A164-A168 PolarHBondContact O-N 3.36Å
165L98.4Very high96.5Very high72 Ų7245.8 Ų45.838%0.37726%0.257SS..Hα-helixtrans-68.7-32.5175.7-72.3168.2000112.7F115 L119 W161 V162 M163 C167 A169 P170F115-L165 HydrophobicContact CE2-CD2 4.41Å; F115-L165 HydrophobicContact CZ-CD2 4.24Å; L119-L165 HydrophobicContact CD1-CD2 3.86Å; L119-L165 HydrophobicContact CD1-CG 4.13Å; W161-L165 WeakPolarHBondContact O-CB 3.38Å; W161-L165 WeakPolarHBondContact O-CG 3.39Å; W161-L165 PolarHBondContact O-N 3.45Å; V162-L165 PolarHBondContact O-N 3.25Å; M163-L165 VanDerWaalsContact C-N 3.3Å; M163-L165 PolarHBondContact O-N 2.89Å; L165-C167 PolarHBondContact O-N 3.24Å; L165-C167 VanDerWaalsContact O-N 3.16Å; L165-A169 WeakPolarHBondContact O-CB 3.39Å; L165-A169 PolarHBondContact O-N 2.84Å; L165-P170 WeakPolarHBondContact O-CD 3.42Å
166T98.2Very high96.8Very high48 Ų4843 Ų4329%0.29424%0.235SC..Hα-helixtrans-67.1-11.3174.563.30000113.1V162 M163 P170 Y206V162-T166 WeakPolarHBondContact O-CG2 3.11Å; V162-T166 PolarHBondContact O-N 2.89Å; M163-T166 PolarHBondContact O-N 2.62Å; M163-T166 PolarHBondContact O-OG1 2.93Å; T166-P170 VanDerWaalsContact O-CG 3.29Å; T166-P170 WeakPolarHBondContact O-CG 2.93Å; T166-Y206 VanDerWaalsContact CB-OH 3.26Å; T166-Y206 WeakPolarHBondContact CB-OH 3.47Å; T166-Y206 WeakPolarHBondContact O-CE1 3.27Å; T166-Y206 PolarHBondContact O-OH 2.85Å; T166-Y206 PolarHBondContact OG1-OH 3.34Å
167C98.1Very high97.1Very high0 Ų043.9 Ų43.90%024%0.235CC..Hα-helixtrans-106.2-45171.1-171.40000112.5E122 M163 A164 L165 P171 F203E122-C167 HydrophobicContact CG-CB 3.99Å; M163-C167 PolarHBondContact O-N 2.93Å; A164-C167 PolarHBondContact O-N 3.5Å; L165-C167 PolarHBondContact O-N 3.24Å; L165-C167 VanDerWaalsContact O-N 3.16Å; C167-P171 WeakPolarHBondContact O-CD 3.45Å; C167-F203 WeakPolarHBondContact O-CZ 3.39Å
168A98.3Very high97.4Very high0 Ų042.9 Ų42.90%023%0.229CC..Hα-helixtrans-75.5-33.5-175.300000113.7F115 T118 L119 A164 Y178F115-A168 HydrophobicContact CD2-CB 3.88Å; F115-A168 WeakPolarHBondContact CD2-O 3.34Å; F115-A168 HydrophobicContact CE2-CB 3.89Å; T118-A168 HydrophobicContact CG2-CB 3.95Å; L119-A168 HydrophobicContact CB-CB 3.96Å; L119-A168 HydrophobicContact CD1-CB 4.25Å; A164-A168 WeakPolarHBondContact O-CB 3.26Å; A164-A168 PolarHBondContact O-N 3.36Å; A168-Y178 WeakPolarHBondContact CA-OH 3.19Å; A168-Y178 PolarHBondContact O-OH 2.96Å; A168-Y178 VanDerWaalsContact O-OH 3.08Å
169A98.4Very high97.6Very high21 Ų2140.3 Ų40.317%0.17421%0.208CC..SBendtrans-78.6-43.5-174.700000114.6L165 P171 L172 F173L165-A169 WeakPolarHBondContact O-CB 3.39Å; L165-A169 PolarHBondContact O-N 2.84Å; A169-P171 VanDerWaalsContact C-CD 3.43Å; A169-P171 VanDerWaalsContact C-N 3.35Å; A169-L172 VanDerWaalsContact O-CB 3.3Å; A169-L172 WeakPolarHBondContact O-CB 3.46Å; A169-L172 PolarHBondContact O-N 2.6Å; A169-F173 HydrophobicContact CB-CD2 4.36Å; A169-F173 HydrophobicContact CB-CE2 4.17Å; A169-F173 WeakPolarHBondContact O-CD2 3.42Å
170P98.4Very high97.7Very high22 Ų2236.1 Ų36.114%0.14319%0.189CC..G310 helixtrans-54.9-36.5-173-23.330.8000116.3L165 T166 L172 F173 G174 W175 F203L165-P170 WeakPolarHBondContact O-CD 3.42Å; T166-P170 VanDerWaalsContact O-CG 3.29Å; T166-P170 WeakPolarHBondContact O-CG 2.93Å; P170-L172 PolarHBondContact O-N 2.9Å; P170-L172 VanDerWaalsContact O-N 3.12Å; P170-F173 CarbonylContact O-C 3.58Å; P170-F173 PolarHBondContact O-N 2.97Å; P170-G174 PolarHBondContact O-N 3.32Å; P170-W175 CarbonylContact C-O 3.33Å; P170-W175 HydrophobicContact CB-CB 3.96Å; P170-W175 HydrophobicContact CB-CD2 4.41Å; P170-W175 HydrophobicContact CB-CE3 3.84Å; P170-W175 HydrophobicContact CG-CE3 4.24Å; P170-W175 PolarHBondContact O-N 3.1Å; P170-W175 VanDerWaalsContact O-N 3.11Å; P170-F203 HydrophobicContact CB-CD2 4.3Å; P170-F203 HydrophobicContact CB-CE2 3.78Å; P170-F203 HydrophobicContact CG-CE2 4.06Å
171P98Very high97.8Very high8 Ų836.4 Ų36.45%0.05219%0.19CC..G310 helixtrans-59-21.3173.7-26.835.7000114.7C167 A169 W175 Y178 I189 F203C167-P171 WeakPolarHBondContact O-CD 3.45Å; A169-P171 VanDerWaalsContact C-CD 3.43Å; A169-P171 VanDerWaalsContact C-N 3.35Å; P171-W175 VanDerWaalsContact CA-O 3.27Å; P171-W175 WeakPolarHBondContact CA-O 3.41Å; P171-W175 VanDerWaalsContact N-O 3.14Å; P171-Y178 HydrophobicContact CB-CD2 3.9Å; P171-Y178 HydrophobicContact CB-CE2 3.72Å; P171-Y178 HydrophobicContact CB-CG 4.44Å; P171-Y178 HydrophobicContact CG-CE2 4.2Å; P171-I189 HydrophobicContact CB-CD1 4.28Å; P171-I189 HydrophobicContact CG-CD1 3.49Å; P171-I189 VanDerWaalsContact CG-CD1 3.49Å; P171-F203 HydrophobicContact CG-CE1 4.04Å; P171-F203 HydrophobicContact CG-CE2 4.2Å; P171-F203 HydrophobicContact CG-CZ 3.69Å
172L97.8Very high97.7Very high68 Ų6833 Ų3336%0.35618%0.178SC..G310 helixtrans-83.7-17.5174.6-56.1179.2000112.9N111 F115 A169 P170 Y178N111-L172 HydrophobicContact CB-CD2 3.76Å; F115-L172 HydrophobicContact CB-CD1 4.34Å; F115-L172 HydrophobicContact CD2-CD1 3.56Å; F115-L172 HydrophobicContact CD2-CG 4.43Å; F115-L172 HydrophobicContact CE2-CD1 4.09Å; F115-L172 HydrophobicContact CG-CD1 4.06Å; A169-L172 VanDerWaalsContact O-CB 3.3Å; A169-L172 WeakPolarHBondContact O-CB 3.46Å; A169-L172 PolarHBondContact O-N 2.6Å; P170-L172 PolarHBondContact O-N 2.9Å; P170-L172 VanDerWaalsContact O-N 3.12Å; L172-Y178 HydrophobicContact CD2-CD2 3.89Å; L172-Y178 HydrophobicContact CD2-CE2 4.03Å; L172-Y178 HydrophobicContact CG-CE2 4.31Å
173F97.1Very high97.6Very high173 Ų17329.2 Ų29.276%0.75915%0.154SC*.THydrogen-bonded Turntrans-117.622.4-173.5-60.3-72.4000113A169 P170A169-F173 HydrophobicContact CB-CD2 4.36Å; A169-F173 HydrophobicContact CB-CE2 4.17Å; A169-F173 WeakPolarHBondContact O-CD2 3.42Å; P170-F173 CarbonylContact O-C 3.58Å; P170-F173 PolarHBondContact O-N 2.97Å
174G94.1Very high97.6Very high43 Ų4328.1 Ų28.144%0.44315%0.149SC..THydrogen-bonded Turntrans90.67.1170.200000115.9P170P170-G174 PolarHBondContact O-N 3.32Å
175W97.6Very high97.5Very high88 Ų8828.1 Ų28.133%0.33315%0.149SC..SBendtrans-106.5101.5167.4-170.321.9000109.7P170 P171 S202 F203 Y206P170-W175 CarbonylContact C-O 3.33Å; P170-W175 HydrophobicContact CB-CB 3.96Å; P170-W175 HydrophobicContact CB-CD2 4.41Å; P170-W175 HydrophobicContact CB-CE3 3.84Å; P170-W175 HydrophobicContact CG-CE3 4.24Å; P170-W175 PolarHBondContact O-N 3.1Å; P170-W175 VanDerWaalsContact O-N 3.11Å; P171-W175 VanDerWaalsContact CA-O 3.27Å; P171-W175 WeakPolarHBondContact CA-O 3.41Å; P171-W175 VanDerWaalsContact N-O 3.14Å; W175-S202 PolarHBondContact NE1-OG 3.26Å; W175-F203 HydrophobicContact CD2-CB 4.47Å; W175-F203 AromaticContact CD2-CD2 3.71Å; W175-F203 HydrophobicContact CD2-CD2 3.71Å; W175-F203 AromaticContact CE2-CD2 3.88Å; W175-F203 HydrophobicContact CE3-CD2 4.05Å; W175-F203 HydrophobicContact CG-CB 4.38Å; W175-F203 AromaticContact CG-CD2 3.96Å; W175-F203 HydrophobicContact CG-CD2 3.96Å; W175-F203 HydrophobicContact CZ2-CD2 4.34Å; W175-F203 HydrophobicContact CZ3-CD2 4.49Å; W175-Y206 AromaticContact CH2-CD1 3.98Å; W175-Y206 HydrophobicContact CH2-CD1 3.98Å; W175-Y206 AromaticContact CH2-CD2 3.94Å; W175-Y206 HydrophobicContact CH2-CD2 3.94Å; W175-Y206 HydrophobicContact CH2-CE1 4.38Å; W175-Y206 HydrophobicContact CH2-CE2 4.32Å; W175-Y206 AromaticContact CH2-CG 3.74Å; W175-Y206 HydrophobicContact CH2-CG 3.74Å; W175-Y206 HydrophobicContact CZ2-CG 4.22Å; W175-Y206 HydrophobicContact CZ3-CD1 4.43Å; W175-Y206 HydrophobicContact CZ3-CE1 4.45Å
176S97.6Very high97.5Very high1 Ų124.7 Ų24.71%0.00713%0.131CC..SBendtrans64.1-165-159.5-162.90000112.8I198 N200 F203S176-I198 PolarHBondContact N-O 3.41Å; S176-N200 WeakPolarHBondContact CA-OD1 3.34Å; S176-F203 VanDerWaalsContact CB-CD1 3.41Å; S176-F203 VanDerWaalsContact CB-CG 3.41Å
177R97.8Very high97.5Very high28 Ų2822.5 Ų22.511%0.10612%0.118CC..  trans-162.5163.4177.559.4177.2179171.110.4111.1P7 I179 D190 T193 I198P7-R177 PolarHBondContact O-NH1 2.94Å; R177-I179 HydrophobicContact CG-CG2 3.91Å; R177-D190 HydrophobicContact CG-CB 3.89Å; R177-D190 IonicContact CZ-OD2 2.72Å; R177-D190 IonicContact NE-OD2 3.56Å; R177-D190 PolarHBondContact NE-OD2 3.34Å; R177-D190 IonicContact NH2-OD2 2.63Å; R177-D190 PolarHBondContact NH2-OD2 3.45Å; R177-D190 PolarHBondContact O-N 2.97Å; R177-D190 VanDerWaalsContact O-N 3.13Å; R177-T193 PolarHBondContact NH2-OG1 3.34Å; R177-I198 HydrophobicContact CB-CD1 4.1Å; R177-I198 VanDerWaalsContact CD-CD1 3.48Å; R177-I198 HydrophobicContact CG-CD1 3.56Å
178Y98.4Very high97.4Very high5 Ų522.7 Ų22.72%0.0212%0.119CC..EExtended strand (participates in β ladder)trans-88129.9166.3-69.5-65.6000110.8G114 F115 T118 A168 P171 L172 G188 I189G114-Y178 VanDerWaalsContact C-CZ 3.44Å; G114-Y178 WeakPolarHBondContact O-CE1 3.46Å; G114-Y178 PolarHBondContact O-OH 2.95Å; F115-Y178 HydrophobicContact CB-CE2 4.05Å; T118-Y178 VanDerWaalsContact CB-OH 3.28Å; T118-Y178 WeakPolarHBondContact CB-OH 3.34Å; T118-Y178 VanDerWaalsContact OG1-CE1 3.29Å; T118-Y178 WeakPolarHBondContact OG1-CE1 3.31Å; T118-Y178 PolarHBondContact OG1-OH 3.28Å; A168-Y178 WeakPolarHBondContact CA-OH 3.19Å; A168-Y178 PolarHBondContact O-OH 2.96Å; A168-Y178 VanDerWaalsContact O-OH 3.08Å; P171-Y178 HydrophobicContact CB-CD2 3.9Å; P171-Y178 HydrophobicContact CB-CE2 3.72Å; P171-Y178 HydrophobicContact CB-CG 4.44Å; P171-Y178 HydrophobicContact CG-CE2 4.2Å; L172-Y178 HydrophobicContact CD2-CD2 3.89Å; L172-Y178 HydrophobicContact CD2-CE2 4.03Å; L172-Y178 HydrophobicContact CG-CE2 4.31Å; Y178-G188 WeakPolarHBondContact CA-O 3.41Å; Y178-I189 HydrophobicContact CD1-CD1 4.03Å; Y178-I189 HydrophobicContact CE1-CD1 3.42Å; Y178-I189 VanDerWaalsContact CE1-CD1 3.42Å; Y178-I189 HydrophobicContact CE1-CG1 4.33Å
179I98.1Very high97.4Very high1 Ų122.9 Ų22.91%0.00512%0.121CC..EExtended strand (participates in β ladder)trans-133.2154.5174.361.1166.5000111.8N8 R177 C187 G188 D190 Y192N8-I179 WeakPolarHBondContact O-CG2 3.43Å; R177-I179 HydrophobicContact CG-CG2 3.91Å; I179-C187 VanDerWaalsContact O-CA 3.32Å; I179-C187 WeakPolarHBondContact O-CA 3.43Å; I179-G188 PolarHBondContact N-O 3.39Å; I179-G188 PolarHBondContact O-N 2.98Å; I179-D190 HydrophobicContact CD1-CB 3.97Å; I179-D190 VanDerWaalsContact CD1-CG 3.48Å; I179-D190 WeakPolarHBondContact CD1-OD1 3.07Å; I179-D190 HydrophobicContact CG1-CB 4.02Å; I179-Y192 HydrophobicContact CD1-CD2 3.52Å; I179-Y192 HydrophobicContact CD1-CE2 4.32Å; I179-Y192 HydrophobicContact CD1-CG 4.15Å; I179-Y192 HydrophobicContact CG1-CD2 4.18Å
180P98.2Very high97.3Very high0 Ų021.9 Ų21.90%011%0.112CC..EExtended strand (participates in β ladder)trans-62.3136.8176.4-24.235.9000112.3P23 F24 F103 Q184 S186P23-P180 HydrophobicContact CB-CB 4.4Å; P23-P180 HydrophobicContact CB-CG 4.31Å; P23-P180 HydrophobicContact CG-CB 4.32Å; P23-P180 HydrophobicContact CG-CG 3.97Å; F24-P180 HydrophobicContact CE1-CG 3.8Å; F24-P180 HydrophobicContact CE2-CG 4.34Å; F24-P180 HydrophobicContact CZ-CG 3.6Å; F103-P180 HydrophobicContact CD2-CB 3.93Å; F103-P180 HydrophobicContact CD2-CG 3.8Å; F103-P180 HydrophobicContact CE2-CB 3.84Å; F103-P180 HydrophobicContact CE2-CG 4.05Å; P180-Q184 HydrophobicContact CB-CB 4.06Å; P180-S186 CarbonylContact C-O 3.41Å; P180-S186 VanDerWaalsContact CA-O 3.3Å; P180-S186 WeakPolarHBondContact CA-O 3.22Å
181E96.8Very high97.2Very high6 Ų621.1 Ų21.13%0.02811%0.106CC..EExtended strand (participates in β ladder)trans-120.6153.3-176.258.2179.6-171.400112.4M183 Q184 S186 Y191 Y192 Y268 M288 A292E181-M183 PolarHBondContact O-N 2.88Å; E181-Q184 WeakPolarHBondContact O-CA 3.16Å; E181-Q184 PolarHBondContact O-N 3.38Å; E181-S186 WeakPolarHBondContact CG-O 3.34Å; E181-S186 PolarHBondContact N-O 3.47Å; E181-S186 PolarHBondContact OE1-OG 2.65Å; E181-Y191 WeakPolarHBondContact CB-OH 3.3Å; E181-Y191 PolarHBondContact OE2-OH 2.89Å; E181-Y192 HydrophobicContact CB-CE2 4.02Å; E181-Y192 WeakPolarHBondContact CB-OH 3.18Å; E181-Y268 WeakPolarHBondContact OE2-CE2 3.3Å; E181-Y268 PolarHBondContact OE2-OH 3.04Å; E181-M288 HydrophobicContact CB-CG 4Å; E181-M288 HydrophobicContact CG-CG 4.42Å; E181-A292 WeakPolarHBondContact OE1-CB 3.4Å
182G95.7Very high97Very high0 Ų021 Ų210%011%0.105CC..THydrogen-bonded Turntrans60.5-118.8177.600000113.8Q184 Y192 P285 T289G182-Q184 PolarHBondContact O-N 3.06Å; G182-Q184 PolarHBondContact O-NE2 2.92Å; G182-Y192 PolarHBondContact N-OH 3.16Å; G182-P285 CarbonylContact C-O 3.16Å; G182-P285 WeakPolarHBondContact CA-O 3.48Å; G182-P285 WeakPolarHBondContact O-CB 3.45Å; G182-T289 WeakPolarHBondContact CA-OG1 3.43Å
183M97Very high96.8Very high6 Ų617.8 Ų17.83%0.039%0.088CC..THydrogen-bonded Turntrans-72.25.2173.1-76.4172.858.500113.6A32 K36 Y37 L40 E181 P285 T289A32-M183 HydrophobicContact CB-CE 3.63Å; A32-M183 HydrophobicContact CB-CG 4.16Å; A32-M183 HydrophobicContact CB-SD 3.98Å; K36-M183 HydrophobicContact CB-CE 3.76Å; K36-M183 HydrophobicContact CB-SD 4.46Å; Y37-M183 HydrophobicContact CD1-CE 3.95Å; Y37-M183 HydrophobicContact CD2-CE 3.62Å; Y37-M183 HydrophobicContact CE1-CB 4.23Å; Y37-M183 HydrophobicContact CE1-CE 3.83Å; Y37-M183 WeakPolarHBondContact CE1-O 3.27Å; Y37-M183 HydrophobicContact CE2-CE 3.48Å; Y37-M183 VanDerWaalsContact CE2-CE 3.48Å; Y37-M183 HydrophobicContact CG-CE 3.85Å; Y37-M183 PolarHBondContact OH-O 3.43Å; Y37-M183 VanDerWaalsContact OH-O 3.11Å; L40-M183 HydrophobicContact CD1-CB 4.49Å; L40-M183 HydrophobicContact CD1-CE 3.81Å; L40-M183 HydrophobicContact CD1-SD 3.96Å; E181-M183 PolarHBondContact O-N 2.88Å; M183-P285 HydrophobicContact CG-CB 4.03Å; M183-T289 HydrophobicContact CB-CG2 4.47Å; M183-T289 HydrophobicContact CG-CG2 4.36Å; M183-T289 WeakPolarHBondContact CG-OG1 3.15Å; M183-T289 PolarHBondContact N-OG1 2.92Å; M183-T289 HydrophobicContact SD-CG2 4.02Å
184Q97.4Very high96.4Very high0 Ų013 Ų130%08%0.075CC..THydrogen-bonded Turntrans68.533.2178.1-41.1-67.2-71.300112.9P23 Q28 L31 F103 P180 E181 G182P23-Q184 HydrophobicContact CB-CB 3.84Å; P23-Q184 HydrophobicContact CB-CG 4.2Å; Q28-Q184 HydrophobicContact CG-CB 3.95Å; Q28-Q184 HydrophobicContact CG-CG 4.13Å; L31-Q184 HydrophobicContact CD1-CG 3.53Å; F103-Q184 VanDerWaalsContact CD2-O 3.24Å; F103-Q184 WeakPolarHBondContact CD2-O 3.39Å; F103-Q184 VanDerWaalsContact CE2-O 3.29Å; F103-Q184 WeakPolarHBondContact CE2-O 3.34Å; P180-Q184 HydrophobicContact CB-CB 4.06Å; E181-Q184 WeakPolarHBondContact O-CA 3.16Å; E181-Q184 PolarHBondContact O-N 3.38Å; G182-Q184 PolarHBondContact O-N 3.06Å; G182-Q184 PolarHBondContact O-NE2 2.92Å
185C96.3Very high96.2Very high0 Ų012.6 Ų12.60%06%0.061CC..THydrogen-bonded Turntrans-113.8-5.7176.4-64.60000114.4Y37 L40 T94 T97 A98 F293Y37-C185 WeakPolarHBondContact CD1-SG 3.2Å; Y37-C185 WeakPolarHBondContact CE1-SG 3.18Å; L40-C185 HydrophobicContact CD1-CB 4.47Å; T94-C185 WeakPolarHBondContact CG2-O 3.4Å; T97-C185 HydrophobicContact CG2-CB 4.26Å; A98-C185 HydrophobicContact CB-CB 4.46Å; C185-F293 HydrophobicContact CB-CZ 4.11Å
186S97.6Very high96Very high0 Ų013.3 Ų13.30%08%0.077CC..EExtended strand (participates in β ladder)trans-125.8156.7173.6-1780000107P180 E181 K296P180-S186 CarbonylContact C-O 3.41Å; P180-S186 VanDerWaalsContact CA-O 3.3Å; P180-S186 WeakPolarHBondContact CA-O 3.22Å; E181-S186 WeakPolarHBondContact CG-O 3.34Å; E181-S186 PolarHBondContact N-O 3.47Å; E181-S186 PolarHBondContact OE1-OG 2.65Å; S186-K296 WeakPolarHBondContact OG-CE 3.29Å; S186-K296 PolarHBondContact OG-NZ 3.48Å
187C98.3Very high95.8Very high3 Ų321.8 Ų21.82%0.0212%0.116CC..EExtended strand (participates in β ladder)trans-118.9140.9172.6-78.40000111.1F103 C110 E113 I179F103-C187 VanDerWaalsContact CE2-SG 3.52Å; F103-C187 HydrophobicContact CZ-CB 4.16Å; F103-C187 WeakPolarHBondContact CZ-SG 3.34Å; C110-C187 WeakPolarHBondContact CA-SG 3.31Å; C110-C187 HydrophobicContact CB-CB 4.12Å; C110-C187 WeakPolarHBondContact CB-SG 3.49Å; C110-C187 WeakPolarHBondContact O-CB 3.41Å; C110-C187 WeakPolarHBondContact SG-CB 3.24Å; C110-C187 CovalentContact SG-SG 2.02Å; C110-C187 PolarHBondContact SG-SG 3.25Å; E113-C187 WeakPolarHBondContact OE2-CA 3.44Å; E113-C187 WeakPolarHBondContact OE2-CB 3.3Å; E113-C187 PolarHBondContact OE2-N 3.47Å; I179-C187 VanDerWaalsContact O-CA 3.32Å; I179-C187 WeakPolarHBondContact O-CA 3.43Å
188G97.3Very high95.6Very high3 Ų322.2 Ų22.23%0.03112%0.12CC..EExtended strand (participates in β ladder)trans-141.6177.8-179.800000111.1Y178 I179Y178-G188 WeakPolarHBondContact CA-O 3.41Å; I179-G188 PolarHBondContact N-O 3.39Å; I179-G188 PolarHBondContact O-N 2.98Å
189I97.5Very high95.5Very high5 Ų526.3 Ų26.33%0.02614%0.143CC..EExtended strand (participates in β ladder)trans-61.8145174-58.9-58.7000109.8P171 Y178 Y191 F203 V204 M207P171-I189 HydrophobicContact CB-CD1 4.28Å; P171-I189 HydrophobicContact CG-CD1 3.49Å; P171-I189 VanDerWaalsContact CG-CD1 3.49Å; Y178-I189 HydrophobicContact CD1-CD1 4.03Å; Y178-I189 HydrophobicContact CE1-CD1 3.42Å; Y178-I189 VanDerWaalsContact CE1-CD1 3.42Å; Y178-I189 HydrophobicContact CE1-CG1 4.33Å; I189-Y191 WeakPolarHBondContact O-CD1 3.46Å; I189-Y191 WeakPolarHBondContact O-CE1 3.14Å; I189-Y191 PolarHBondContact O-N 3.4Å; I189-F203 HydrophobicContact CB-CE1 4.44Å; I189-F203 HydrophobicContact CD1-CE1 3.69Å; I189-F203 HydrophobicContact CD1-CZ 4.21Å; I189-F203 HydrophobicContact CG1-CE1 4.01Å; I189-F203 HydrophobicContact CG2-CD1 3.6Å; I189-F203 HydrophobicContact CG2-CE1 3.56Å; I189-V204 HydrophobicContact CG2-CG2 4.27Å; I189-M207 HydrophobicContact CB-SD 4.39Å; I189-M207 HydrophobicContact CG1-SD 3.97Å; I189-M207 HydrophobicContact CG2-SD 4.48Å
190D97.3Very high95.3Very high0 Ų026.3 Ų26.30%014%0.143CC..  trans-74.686.9177.9-168.3-10.5000112.8R177 I179 Y192 T193 N200R177-D190 HydrophobicContact CG-CB 3.89Å; R177-D190 IonicContact CZ-OD2 2.72Å; R177-D190 IonicContact NE-OD2 3.56Å; R177-D190 PolarHBondContact NE-OD2 3.34Å; R177-D190 IonicContact NH2-OD2 2.63Å; R177-D190 PolarHBondContact NH2-OD2 3.45Å; R177-D190 PolarHBondContact O-N 2.97Å; R177-D190 VanDerWaalsContact O-N 3.13Å; I179-D190 HydrophobicContact CD1-CB 3.97Å; I179-D190 VanDerWaalsContact CD1-CG 3.48Å; I179-D190 WeakPolarHBondContact CD1-OD1 3.07Å; I179-D190 HydrophobicContact CG1-CB 4.02Å; D190-Y192 PolarHBondContact OD1-N 3.05Å; D190-Y192 VanDerWaalsContact OD1-N 3.14Å; D190-T193 VanDerWaalsContact CG-OG1 3.22Å; D190-T193 PolarHBondContact OD1-N 2.85Å; D190-T193 PolarHBondContact OD1-OG1 2.99Å; D190-T193 PolarHBondContact OD2-OG1 3.26Å; D190-N200 PolarHBondContact OD2-ND2 3.31Å
191Y95.2Very high95.2Very high5 Ų529.3 Ų29.32%0.0216%0.161CC..  trans-91.2-1.6166.344.7-99.3000112.7E181 I189 A272 I275 F276 Q279 M288E181-Y191 WeakPolarHBondContact CB-OH 3.3Å; E181-Y191 PolarHBondContact OE2-OH 2.89Å; I189-Y191 WeakPolarHBondContact O-CD1 3.46Å; I189-Y191 WeakPolarHBondContact O-CE1 3.14Å; I189-Y191 PolarHBondContact O-N 3.4Å; Y191-A272 HydrophobicContact CD1-CB 3.83Å; Y191-A272 HydrophobicContact CD2-CB 4.42Å; Y191-A272 HydrophobicContact CE1-CB 3.97Å; Y191-A272 HydrophobicContact CG-CB 4.11Å; Y191-I275 HydrophobicContact CD2-CB 3.84Å; Y191-I275 HydrophobicContact CD2-CD1 4.22Å; Y191-I275 HydrophobicContact CD2-CG2 3.69Å; Y191-I275 HydrophobicContact CE2-CB 4.3Å; Y191-I275 HydrophobicContact CE2-CD1 3.78Å; Y191-I275 HydrophobicContact CE2-CG2 4.22Å; Y191-F276 WeakPolarHBondContact O-CA 3.32Å; Y191-Q279 PolarHBondContact O-NE2 3.18Å; Y191-Q279 VanDerWaalsContact O-NE2 3.17Å; Y191-M288 HydrophobicContact CD2-CE 4.48Å; Y191-M288 HydrophobicContact CE1-CE 4.12Å; Y191-M288 HydrophobicContact CE2-CE 3.46Å; Y191-M288 VanDerWaalsContact CE2-CE 3.46Å; Y191-M288 WeakPolarHBondContact OH-CE 3.41Å; Y191-M288 VanDerWaalsContact OH-CG 3.31Å; Y191-M288 WeakPolarHBondContact OH-CG 3.28Å
192Y94.4Very high95.2Very high5 Ų531.5 Ų31.52%0.0218%0.177CC..SBendtrans-85.4-38.5-173.7-67.3-85.8000113.5Y10 I179 E181 G182 D190 I275 F283Y10-Y192 AromaticContact CD1-CD1 3.4Å; Y10-Y192 HydrophobicContact CD1-CD1 3.4Å; Y10-Y192 HydrophobicContact CD1-CE1 4.14Å; Y10-Y192 AromaticContact CD1-CG 3.87Å; Y10-Y192 HydrophobicContact CD1-CG 3.87Å; Y10-Y192 AromaticContact CE1-CD1 3.79Å; Y10-Y192 HydrophobicContact CE1-CD1 3.79Å; Y10-Y192 HydrophobicContact CE1-CE1 4.5Å; Y10-Y192 HydrophobicContact CG-CD1 4.21Å; Y10-Y192 HydrophobicContact CG-CG 4.24Å; I179-Y192 HydrophobicContact CD1-CD2 3.52Å; I179-Y192 HydrophobicContact CD1-CE2 4.32Å; I179-Y192 HydrophobicContact CD1-CG 4.15Å; I179-Y192 HydrophobicContact CG1-CD2 4.18Å; E181-Y192 HydrophobicContact CB-CE2 4.02Å; E181-Y192 WeakPolarHBondContact CB-OH 3.18Å; G182-Y192 PolarHBondContact N-OH 3.16Å; D190-Y192 PolarHBondContact OD1-N 3.05Å; D190-Y192 VanDerWaalsContact OD1-N 3.14Å; Y192-I275 HydrophobicContact CD1-CG2 3.67Å; Y192-I275 HydrophobicContact CE1-CD1 4Å; Y192-I275 HydrophobicContact CE1-CG2 4.01Å; Y192-I275 HydrophobicContact CG-CG2 4.25Å; Y192-F283 HydrophobicContact CD1-CE2 4.46Å; Y192-F283 AromaticContact CD1-CZ 3.81Å; Y192-F283 HydrophobicContact CD1-CZ 3.81Å; Y192-F283 AromaticContact CE1-CE2 3.8Å; Y192-F283 HydrophobicContact CE1-CE2 3.8Å; Y192-F283 AromaticContact CE1-CZ 3.6Å; Y192-F283 HydrophobicContact CE1-CZ 3.6Å
193T93.3Very high95.3Very high1 Ų131.5 Ų31.51%0.00618%0.177CC..  trans-121.3134.8-169.263.80000112.1E5 Y10 R177 D190 K195 N200E5-T193 HydrophobicContact CG-CG2 3.93Å; Y10-T193 HydrophobicContact CD2-CG2 3.84Å; Y10-T193 HydrophobicContact CG-CG2 4.25Å; R177-T193 PolarHBondContact NH2-OG1 3.34Å; D190-T193 VanDerWaalsContact CG-OG1 3.22Å; D190-T193 PolarHBondContact OD1-N 2.85Å; D190-T193 PolarHBondContact OD1-OG1 2.99Å; D190-T193 PolarHBondContact OD2-OG1 3.26Å; T193-K195 PolarHBondContact O-N 2.93Å; T193-K195 VanDerWaalsContact O-N 3.1Å; T193-N200 PolarHBondContact O-ND2 3.02Å; T193-N200 PolarHBondContact OG1-ND2 2.61Å
194P88.3Confident95.3Very high74 Ų7431.3 Ų31.348%0.48118%0.176SC..  trans-82.283170.731.6-29.5000108.9P196P194-P196 VanDerWaalsContact O-CD 3.28Å; P194-P196 WeakPolarHBondContact O-CD 3.38Å
195K91.1Very high95.3Very high33 Ų3335.2 Ų35.214%0.14320%0.196CC..  trans-95.3104.8173.4-69.5-162.6175.2-160.50111.4E5 P7 T193 E197 I198 N199 N200E5-K195 WeakPolarHBondContact OE1-CE 3.45Å; E5-K195 IonicContact OE1-NZ 2.95Å; P7-K195 PolarHBondContact O-NZ 2.88Å; T193-K195 PolarHBondContact O-N 2.93Å; T193-K195 VanDerWaalsContact O-N 3.1Å; K195-E197 VanDerWaalsContact C-N 3.29Å; K195-E197 PolarHBondContact O-N 3.07Å; K195-I198 HydrophobicContact CB-CD1 4.13Å; K195-I198 HydrophobicContact CB-CG1 3.72Å; K195-I198 HydrophobicContact CD-CD1 4.3Å; K195-N199 PolarHBondContact O-N 2.98Å; K195-N200 PolarHBondContact O-N 2.71Å
196P91.6Very high95.4Very high104 Ų10437.5 Ų37.568%0.67521%0.205SC*.G310 helixtrans-68.2-29.9179.4-18.233.7000112.3P194 I198 N199P194-P196 VanDerWaalsContact O-CD 3.28Å; P194-P196 WeakPolarHBondContact O-CD 3.38Å; P196-I198 PolarHBondContact O-N 3.03Å; P196-I198 VanDerWaalsContact O-N 3.16Å; P196-N199 PolarHBondContact O-N 3.44Å; P196-N199 VanDerWaalsContact O-N 3.08Å; P196-N199 PolarHBondContact O-OD1 3.41Å
197E94Very high95.4Very high179 Ų17939.3 Ų39.384%0.83621%0.214SC*.G310 helixtrans-56.6-32.7-179.1-63.2174.3-174.100113.4K195K195-E197 VanDerWaalsContact C-N 3.29Å; K195-E197 PolarHBondContact O-N 3.07Å
198I94.5Very high95.3Very high36 Ų3640 Ų4019%0.18522%0.217CC..G310 helixtrans-116.21017956.5171.6000112.2S176 R177 K195 P196 N200S176-I198 PolarHBondContact N-O 3.41Å; R177-I198 HydrophobicContact CB-CD1 4.1Å; R177-I198 VanDerWaalsContact CD-CD1 3.48Å; R177-I198 HydrophobicContact CG-CD1 3.56Å; K195-I198 HydrophobicContact CB-CD1 4.13Å; K195-I198 HydrophobicContact CB-CG1 3.72Å; K195-I198 HydrophobicContact CD-CD1 4.3Å; P196-I198 PolarHBondContact O-N 3.03Å; P196-I198 VanDerWaalsContact O-N 3.16Å; I198-N200 VanDerWaalsContact C-N 3.32Å; I198-N200 WeakPolarHBondContact CD1-OD1 3.27Å; I198-N200 VanDerWaalsContact CG1-OD1 3.27Å; I198-N200 WeakPolarHBondContact CG1-OD1 3.41Å; I198-N200 PolarHBondContact O-N 2.9Å
199N96.4Very high95.3Very high92 Ų9243.4 Ų43.449%0.49224%0.237SC..THydrogen-bonded Turntrans53.938.4175.8-59.2-58.8000115.3K195 P196 T201 S202 F203K195-N199 PolarHBondContact O-N 2.98Å; P196-N199 PolarHBondContact O-N 3.44Å; P196-N199 VanDerWaalsContact O-N 3.08Å; P196-N199 PolarHBondContact O-OD1 3.41Å; N199-T201 VanDerWaalsContact C-N 3.29Å; N199-T201 PolarHBondContact O-N 3.18Å; N199-S202 WeakPolarHBondContact CB-OG 3.28Å; N199-S202 PolarHBondContact O-N 3.04Å; N199-S202 VanDerWaalsContact O-N 3.09Å; N199-S202 PolarHBondContact O-OG 2.95Å; N199-F203 PolarHBondContact O-N 3.46Å
200N94.2Very high95.3Very high1 Ų145.3 Ų45.31%0.00525%0.247CC..Hα-helixtrans-47.1-49.2-178.4-80.2-3.9000112.8S176 D190 T193 K195 I198 S202 F203 V204S176-N200 WeakPolarHBondContact CA-OD1 3.34Å; D190-N200 PolarHBondContact OD2-ND2 3.31Å; T193-N200 PolarHBondContact O-ND2 3.02Å; T193-N200 PolarHBondContact OG1-ND2 2.61Å; K195-N200 PolarHBondContact O-N 2.71Å; I198-N200 VanDerWaalsContact C-N 3.32Å; I198-N200 WeakPolarHBondContact CD1-OD1 3.27Å; I198-N200 VanDerWaalsContact CG1-OD1 3.27Å; I198-N200 WeakPolarHBondContact CG1-OD1 3.41Å; I198-N200 PolarHBondContact O-N 2.9Å; N200-S202 VanDerWaalsContact C-N 3.33Å; N200-S202 PolarHBondContact O-N 3.1Å; N200-F203 PolarHBondContact O-N 3.12Å; N200-F203 VanDerWaalsContact O-N 3.14Å; N200-V204 WeakPolarHBondContact O-CG2 3.36Å; N200-V204 PolarHBondContact O-N 3.04Å
201T95.4Very high95.3Very high63 Ų6345.6 Ų45.639%0.38725%0.248SC..Hα-helixtrans-57.1-44.9-177.4-51.40000112.5N199 I205 F276N199-T201 VanDerWaalsContact C-N 3.29Å; N199-T201 PolarHBondContact O-N 3.18Å; T201-I205 HydrophobicContact CG2-CD1 4.11Å; T201-I205 VanDerWaalsContact O-CG1 3.3Å; T201-I205 WeakPolarHBondContact O-CG1 3.08Å; T201-I205 PolarHBondContact O-N 3.42Å; T201-I205 VanDerWaalsContact O-N 3.12Å; T201-F276 HydrophobicContact CG2-CE2 4.1Å; T201-F276 HydrophobicContact CG2-CZ 3.86Å
202S97.3Very high95.2Very high52 Ų5247.6 Ų47.636%0.36426%0.257SS..Hα-helixtrans-66.5-38.7179.570.10000112W175 N199 N200 Y206W175-S202 PolarHBondContact NE1-OG 3.26Å; N199-S202 WeakPolarHBondContact CB-OG 3.28Å; N199-S202 PolarHBondContact O-N 3.04Å; N199-S202 VanDerWaalsContact O-N 3.09Å; N199-S202 PolarHBondContact O-OG 2.95Å; N200-S202 VanDerWaalsContact C-N 3.33Å; N200-S202 PolarHBondContact O-N 3.1Å; S202-Y206 VanDerWaalsContact O-CB 3.3Å; S202-Y206 WeakPolarHBondContact O-CB 3.3Å; S202-Y206 PolarHBondContact O-N 3.08Å
203F97.8Very high95.2Very high0 Ų050.4 Ų50.40%028%0.277CS..Hα-helixtrans-68.2-43.4179.5-175.9-92.1000111.6C167 P170 P171 W175 S176 I189 N199 N200 I205 Y206 M207C167-F203 WeakPolarHBondContact O-CZ 3.39Å; P170-F203 HydrophobicContact CB-CD2 4.3Å; P170-F203 HydrophobicContact CB-CE2 3.78Å; P170-F203 HydrophobicContact CG-CE2 4.06Å; P171-F203 HydrophobicContact CG-CE1 4.04Å; P171-F203 HydrophobicContact CG-CE2 4.2Å; P171-F203 HydrophobicContact CG-CZ 3.69Å; W175-F203 HydrophobicContact CD2-CB 4.47Å; W175-F203 AromaticContact CD2-CD2 3.71Å; W175-F203 HydrophobicContact CD2-CD2 3.71Å; W175-F203 AromaticContact CE2-CD2 3.88Å; W175-F203 HydrophobicContact CE3-CD2 4.05Å; W175-F203 HydrophobicContact CG-CB 4.38Å; W175-F203 AromaticContact CG-CD2 3.96Å; W175-F203 HydrophobicContact CG-CD2 3.96Å; W175-F203 HydrophobicContact CZ2-CD2 4.34Å; W175-F203 HydrophobicContact CZ3-CD2 4.49Å; S176-F203 VanDerWaalsContact CB-CD1 3.41Å; S176-F203 VanDerWaalsContact CB-CG 3.41Å; I189-F203 HydrophobicContact CB-CE1 4.44Å; I189-F203 HydrophobicContact CD1-CE1 3.69Å; I189-F203 HydrophobicContact CD1-CZ 4.21Å; I189-F203 HydrophobicContact CG1-CE1 4.01Å; I189-F203 HydrophobicContact CG2-CD1 3.6Å; I189-F203 HydrophobicContact CG2-CE1 3.56Å; N199-F203 PolarHBondContact O-N 3.46Å; N200-F203 PolarHBondContact O-N 3.12Å; N200-F203 VanDerWaalsContact O-N 3.14Å; F203-I205 PolarHBondContact O-N 2.9Å; F203-Y206 HydrophobicContact CD2-CD1 4.22Å; F203-Y206 HydrophobicContact CE2-CD1 4.15Å; F203-Y206 HydrophobicContact CE2-CE1 4.24Å; F203-Y206 WeakPolarHBondContact O-CB 3.27Å; F203-Y206 PolarHBondContact O-N 3.23Å; F203-M207 HydrophobicContact CE1-CB 4.47Å; F203-M207 WeakPolarHBondContact O-CB 3.29Å; F203-M207 PolarHBondContact O-N 3.18Å
204V97.1Very high95.4Very high2 Ų253.8 Ų53.81%0.01230%0.295CS..Hα-helixtrans-62.5-45.1177.8176.20000110.2I189 N200 Y206 M207 F208 F276I189-V204 HydrophobicContact CG2-CG2 4.27Å; N200-V204 WeakPolarHBondContact O-CG2 3.36Å; N200-V204 PolarHBondContact O-N 3.04Å; V204-Y206 VanDerWaalsContact C-N 3.34Å; V204-Y206 PolarHBondContact O-N 3.45Å; V204-M207 PolarHBondContact O-N 2.91Å; V204-F208 HydrophobicContact CG1-CD2 3.74Å; V204-F208 HydrophobicContact CG1-CE2 3.86Å; V204-F208 WeakPolarHBondContact O-CD2 3.14Å; V204-F208 PolarHBondContact O-N 2.98Å; V204-F276 HydrophobicContact CB-CD2 4.03Å; V204-F276 HydrophobicContact CB-CE2 3.9Å; V204-F276 HydrophobicContact CB-CG 4.47Å; V204-F276 HydrophobicContact CB-CZ 4.23Å; V204-F276 HydrophobicContact CG1-CB 4.19Å; V204-F276 HydrophobicContact CG1-CD1 3.86Å; V204-F276 HydrophobicContact CG1-CD2 3.65Å; V204-F276 HydrophobicContact CG1-CE1 4.1Å; V204-F276 HydrophobicContact CG1-CE2 3.92Å; V204-F276 HydrophobicContact CG1-CG 3.61Å; V204-F276 HydrophobicContact CG1-CZ 4.12Å; V204-F276 HydrophobicContact CG2-CD2 4.28Å; V204-F276 HydrophobicContact CG2-CE2 4.39Å
205I97.3Very high95.7Very high81 Ų8150.2 Ų50.242%0.41527%0.272SS..Hα-helixtrans-60-45.9175.1-66.7167.1000110.9T201 F203 M207 F208 V209 F276T201-I205 HydrophobicContact CG2-CD1 4.11Å; T201-I205 VanDerWaalsContact O-CG1 3.3Å; T201-I205 WeakPolarHBondContact O-CG1 3.08Å; T201-I205 PolarHBondContact O-N 3.42Å; T201-I205 VanDerWaalsContact O-N 3.12Å; F203-I205 PolarHBondContact O-N 2.9Å; I205-M207 PolarHBondContact O-N 3.29Å; I205-F208 PolarHBondContact O-N 3.49Å; I205-V209 HydrophobicContact CG2-CG2 4.28Å; I205-V209 WeakPolarHBondContact O-CB 3.46Å; I205-V209 VanDerWaalsContact O-CG2 3.29Å; I205-V209 WeakPolarHBondContact O-CG2 3.41Å; I205-V209 PolarHBondContact O-N 3.15Å; I205-F276 HydrophobicContact CD1-CZ 4.47Å; I205-F276 HydrophobicContact CG1-CE1 4.2Å; I205-F276 HydrophobicContact CG1-CZ 4.05Å
206Y98Very high95.8Very high48 Ų4849.8 Ų49.819%0.18827%0.271CS..Hα-helixtrans-55.7-48.4175.4160-96000112.1T166 W175 S202 F203 V204 V209 L210 H211T166-Y206 VanDerWaalsContact CB-OH 3.26Å; T166-Y206 WeakPolarHBondContact CB-OH 3.47Å; T166-Y206 WeakPolarHBondContact O-CE1 3.27Å; T166-Y206 PolarHBondContact O-OH 2.85Å; T166-Y206 PolarHBondContact OG1-OH 3.34Å; W175-Y206 AromaticContact CH2-CD1 3.98Å; W175-Y206 HydrophobicContact CH2-CD1 3.98Å; W175-Y206 AromaticContact CH2-CD2 3.94Å; W175-Y206 HydrophobicContact CH2-CD2 3.94Å; W175-Y206 HydrophobicContact CH2-CE1 4.38Å; W175-Y206 HydrophobicContact CH2-CE2 4.32Å; W175-Y206 AromaticContact CH2-CG 3.74Å; W175-Y206 HydrophobicContact CH2-CG 3.74Å; W175-Y206 HydrophobicContact CZ2-CG 4.22Å; W175-Y206 HydrophobicContact CZ3-CD1 4.43Å; W175-Y206 HydrophobicContact CZ3-CE1 4.45Å; S202-Y206 VanDerWaalsContact O-CB 3.3Å; S202-Y206 WeakPolarHBondContact O-CB 3.3Å; S202-Y206 PolarHBondContact O-N 3.08Å; F203-Y206 HydrophobicContact CD2-CD1 4.22Å; F203-Y206 HydrophobicContact CE2-CD1 4.15Å; F203-Y206 HydrophobicContact CE2-CE1 4.24Å; F203-Y206 WeakPolarHBondContact O-CB 3.27Å; F203-Y206 PolarHBondContact O-N 3.23Å; V204-Y206 VanDerWaalsContact C-N 3.34Å; V204-Y206 PolarHBondContact O-N 3.45Å; Y206-V209 PolarHBondContact O-N 3.16Å; Y206-L210 HydrophobicContact CD2-CB 4.37Å; Y206-L210 HydrophobicContact CD2-CD2 4.15Å; Y206-L210 HydrophobicContact CE2-CB 4.24Å; Y206-L210 HydrophobicContact CE2-CD2 3.3Å; Y206-L210 HydrophobicContact CE2-CG 4.39Å; Y206-L210 WeakPolarHBondContact O-CB 3.35Å; Y206-L210 PolarHBondContact O-N 3.15Å; Y206-H211 AromaticContact CE1-CD2 3.72Å; Y206-H211 AromaticContact CE1-NE2 3.75Å; Y206-H211 AromaticContact CZ-CD2 3.84Å; Y206-H211 AromaticContact CZ-NE2 3.5Å; Y206-H211 PolarHBondContact OH-NE2 2.8Å; Y206-H211 VanDerWaalsContact OH-NE2 3.14Å
207M97.3Very high95.9Very high38 Ų3851.6 Ų51.619%0.18727%0.268CS..Hα-helixtrans-60-49.8178.3-179.2-170.5174.500111.2I189 F203 V204 I205 V209 H211 F212I189-M207 HydrophobicContact CB-SD 4.39Å; I189-M207 HydrophobicContact CG1-SD 3.97Å; I189-M207 HydrophobicContact CG2-SD 4.48Å; F203-M207 HydrophobicContact CE1-CB 4.47Å; F203-M207 WeakPolarHBondContact O-CB 3.29Å; F203-M207 PolarHBondContact O-N 3.18Å; V204-M207 PolarHBondContact O-N 2.91Å; I205-M207 PolarHBondContact O-N 3.29Å; M207-V209 VanDerWaalsContact C-N 3.33Å; M207-V209 PolarHBondContact O-N 3.08Å; M207-H211 HydrophobicContact CG-CB 4.31Å; M207-H211 CarbonylContact O-C 3.24Å; M207-H211 WeakPolarHBondContact O-CA 3.37Å; M207-H211 WeakPolarHBondContact O-CB 3.41Å; M207-H211 PolarHBondContact O-N 3.24Å; M207-F212 PolarHBondContact O-N 2.72Å
208F96.8Very high96Very high18 Ų1845.3 Ų45.38%0.07924%0.24CC..Hα-helixtrans-68.2-30.1-178.6-86.9-86.6000114V204 I205 F212 S213 A269 A272 W273V204-F208 HydrophobicContact CG1-CD2 3.74Å; V204-F208 HydrophobicContact CG1-CE2 3.86Å; V204-F208 WeakPolarHBondContact O-CD2 3.14Å; V204-F208 PolarHBondContact O-N 2.98Å; I205-F208 PolarHBondContact O-N 3.49Å; F208-F212 HydrophobicContact CD1-CD1 4.27Å; F208-F212 WeakPolarHBondContact O-CB 3.32Å; F208-S213 WeakPolarHBondContact O-CB 3.47Å; F208-S213 PolarHBondContact O-N 2.98Å; F208-S213 PolarHBondContact O-OG 3.4Å; F208-A269 HydrophobicContact CE1-CB 4.06Å; F208-A269 WeakPolarHBondContact CE1-O 3.05Å; F208-A269 VanDerWaalsContact CZ-O 3.31Å; F208-A269 WeakPolarHBondContact CZ-O 3.36Å; F208-A272 HydrophobicContact CZ-CB 4.05Å; F208-W273 HydrophobicContact CB-CE3 4Å; F208-W273 HydrophobicContact CB-CZ3 3.72Å; F208-W273 HydrophobicContact CD1-CB 4.49Å; F208-W273 HydrophobicContact CD1-CD2 4.32Å; F208-W273 AromaticContact CD1-CE3 3.61Å; F208-W273 HydrophobicContact CD1-CE3 3.61Å; F208-W273 HydrophobicContact CD1-CZ3 4.21Å; F208-W273 AromaticContact CD2-CE3 3.49Å; F208-W273 HydrophobicContact CD2-CE3 3.49Å; F208-W273 VanDerWaalsContact CD2-CE3 3.49Å; F208-W273 AromaticContact CD2-CZ3 3.81Å; F208-W273 HydrophobicContact CD2-CZ3 3.81Å; F208-W273 HydrophobicContact CE1-CB 3.7Å; F208-W273 HydrophobicContact CE1-CD2 4.36Å; F208-W273 AromaticContact CE1-CE3 3.88Å; F208-W273 HydrophobicContact CE1-CE3 3.88Å; F208-W273 HydrophobicContact CE1-CG 4.35Å; F208-W273 HydrophobicContact CE2-CB 4.47Å; F208-W273 AromaticContact CE2-CE3 3.76Å; F208-W273 HydrophobicContact CE2-CE3 3.76Å; F208-W273 HydrophobicContact CE2-CZ3 4.49Å; F208-W273 HydrophobicContact CG-CD2 4.49Å; F208-W273 AromaticContact CG-CE3 3.4Å; F208-W273 HydrophobicContact CG-CE3 3.4Å; F208-W273 AromaticContact CG-CZ3 3.64Å; F208-W273 HydrophobicContact CG-CZ3 3.64Å; F208-W273 HydrophobicContact CZ-CB 3.69Å; F208-W273 AromaticContact CZ-CE3 3.95Å; F208-W273 HydrophobicContact CZ-CE3 3.95Å
209V97.4Very high95.9Very high75 Ų7543.9 Ų43.946%0.45523%0.233SC..Iπ-helixtrans-79.3-57.7176.8174.20000110.6I205 Y206 M207 S213 I214I205-V209 HydrophobicContact CG2-CG2 4.28Å; I205-V209 WeakPolarHBondContact O-CB 3.46Å; I205-V209 VanDerWaalsContact O-CG2 3.29Å; I205-V209 WeakPolarHBondContact O-CG2 3.41Å; I205-V209 PolarHBondContact O-N 3.15Å; Y206-V209 PolarHBondContact O-N 3.16Å; M207-V209 VanDerWaalsContact C-N 3.33Å; M207-V209 PolarHBondContact O-N 3.08Å; V209-S213 PolarHBondContact O-N 3.23Å; V209-I214 HydrophobicContact CG1-CD1 4.29Å; V209-I214 WeakPolarHBondContact O-CG1 3.17Å; V209-I214 PolarHBondContact O-N 3.09Å
210L97.5Very high95.6Very high45 Ų4544.1 Ų44.124%0.23623%0.229CC..Iπ-helixtrans-82.7-35.6-170.9-174.562.2000113.4W126 M163 Y206 I214 P215W126-L210 WeakPolarHBondContact CZ2-O 3.4Å; M163-L210 HydrophobicContact CE-CD1 4.17Å; M163-L210 HydrophobicContact CE-CD2 3.93Å; M163-L210 HydrophobicContact CE-CG 4.04Å; Y206-L210 HydrophobicContact CD2-CB 4.37Å; Y206-L210 HydrophobicContact CD2-CD2 4.15Å; Y206-L210 HydrophobicContact CE2-CB 4.24Å; Y206-L210 HydrophobicContact CE2-CD2 3.3Å; Y206-L210 HydrophobicContact CE2-CG 4.39Å; Y206-L210 WeakPolarHBondContact O-CB 3.35Å; Y206-L210 PolarHBondContact O-N 3.15Å; L210-I214 HydrophobicContact CD1-CD1 3.97Å; L210-P215 WeakPolarHBondContact O-CD 3.29Å; L210-P215 WeakPolarHBondContact O-CG 3.42Å
211H96.6Very high95.6Very high5 Ų548.9 Ų48.92%0.02325%0.25CS..Iπ-helixtrans-1059.3-174.5-66-83000113.1E122 L125 W126 M163 Y206 M207E122-H211 IonicContact OE2-CE1 3.19Å; E122-H211 IonicContact OE2-CG 3.98Å; E122-H211 IonicContact OE2-ND1 3.19Å; E122-H211 PolarHBondContact OE2-ND1 3.19Å; L125-H211 WeakPolarHBondContact CD2-O 3.28Å; W126-H211 AromaticContact NE1-CE1 3.66Å; W126-H211 AromaticContact NE1-ND1 3.26Å; W126-H211 PolarHBondContact NE1-ND1 3.2Å; M163-H211 PolarHBondContact O-CE1 3.25Å; Y206-H211 AromaticContact CE1-CD2 3.72Å; Y206-H211 AromaticContact CE1-NE2 3.75Å; Y206-H211 AromaticContact CZ-CD2 3.84Å; Y206-H211 AromaticContact CZ-NE2 3.5Å; Y206-H211 PolarHBondContact OH-NE2 2.8Å; Y206-H211 VanDerWaalsContact OH-NE2 3.14Å; M207-H211 HydrophobicContact CG-CB 4.31Å; M207-H211 CarbonylContact O-C 3.24Å; M207-H211 WeakPolarHBondContact O-CA 3.37Å; M207-H211 WeakPolarHBondContact O-CB 3.41Å; M207-H211 PolarHBondContact O-N 3.24Å
212F93.3Very high95.4Very high48 Ų4846.1 Ų46.121%0.21123%0.233CC..Iπ-helixtrans-140.8-61.9173.4-175.5-102.4000112M207 F208 L216 V266 A269M207-F212 PolarHBondContact O-N 2.72Å; F208-F212 HydrophobicContact CD1-CD1 4.27Å; F208-F212 WeakPolarHBondContact O-CB 3.32Å; F212-L216 HydrophobicContact CD1-CD1 4.09Å; F212-L216 HydrophobicContact CD2-CD1 4.12Å; F212-L216 HydrophobicContact CE1-CD1 3.76Å; F212-L216 HydrophobicContact CE2-CD1 3.79Å; F212-L216 HydrophobicContact CG-CD1 4.26Å; F212-L216 HydrophobicContact CZ-CD1 3.6Å; F212-L216 WeakPolarHBondContact O-CB 3.25Å; F212-L216 VanDerWaalsContact O-CG 3.23Å; F212-L216 WeakPolarHBondContact O-CG 3.22Å; F212-L216 PolarHBondContact O-N 2.89Å; F212-L216 VanDerWaalsContact O-N 3.08Å; F212-V266 HydrophobicContact CZ-CG2 4.37Å; F212-A269 HydrophobicContact CD2-CB 4Å; F212-A269 HydrophobicContact CE1-CB 4.44Å; F212-A269 HydrophobicContact CE2-CB 3.51Å; F212-A269 HydrophobicContact CZ-CB 3.77Å
213S94.9Very high95.1Very high64 Ų6444.1 Ų44.145%0.44822%0.218SC..Iπ-helixtrans-67.1-47.8-173.1-57.70000113.3F208 V209 F217F208-S213 WeakPolarHBondContact O-CB 3.47Å; F208-S213 PolarHBondContact O-N 2.98Å; F208-S213 PolarHBondContact O-OG 3.4Å; V209-S213 PolarHBondContact O-N 3.23Å; S213-F217 WeakPolarHBondContact O-CB 3.44Å; S213-F217 PolarHBondContact O-N 3.3Å
214I96.5Very high94.7Very high71 Ų7147.2 Ų47.236%0.36424%0.24SC..Hα-helixtrans-63.2-51.4178.7-72172.9000111.7V209 L210 L216 F217 I218V209-I214 HydrophobicContact CG1-CD1 4.29Å; V209-I214 WeakPolarHBondContact O-CG1 3.17Å; V209-I214 PolarHBondContact O-N 3.09Å; L210-I214 HydrophobicContact CD1-CD1 3.97Å; I214-L216 VanDerWaalsContact C-N 3.34Å; I214-L216 PolarHBondContact O-N 2.87Å; I214-F217 PolarHBondContact O-N 3.1Å; I214-I218 HydrophobicContact CG2-CD1 3.77Å; I214-I218 HydrophobicContact CG2-CG1 4.48Å; I214-I218 WeakPolarHBondContact O-CG1 3.03Å; I214-I218 PolarHBondContact O-N 3.16Å
215P94.8Very high94.4Very high0 Ų053.2 Ų53.20%026%0.262CS..Hα-helixtrans-55.3-46.4176-3238000113.1L125 W126 V129 L210 F217 I218 I219L125-P215 HydrophobicContact CD1-CB 3.55Å; L125-P215 HydrophobicContact CD1-CG 4.44Å; L125-P215 HydrophobicContact CD2-CB 3.95Å; L125-P215 HydrophobicContact CD2-CG 3.97Å; L125-P215 HydrophobicContact CG-CB 3.88Å; L125-P215 HydrophobicContact CG-CG 4.27Å; W126-P215 HydrophobicContact CH2-CG 3.89Å; W126-P215 HydrophobicContact CZ2-CG 3.77Å; W126-P215 HydrophobicContact CZ3-CG 4.39Å; V129-P215 HydrophobicContact CG2-CB 3.67Å; V129-P215 HydrophobicContact CG2-CG 4.49Å; L210-P215 WeakPolarHBondContact O-CD 3.29Å; L210-P215 WeakPolarHBondContact O-CG 3.42Å; P215-F217 PolarHBondContact O-N 2.98Å; P215-I218 PolarHBondContact O-N 3.22Å; P215-I219 WeakPolarHBondContact O-CB 3.39Å; P215-I219 VanDerWaalsContact O-CG1 3.24Å; P215-I219 WeakPolarHBondContact O-CG1 3.31Å; P215-I219 PolarHBondContact O-N 2.73Å
216L92.4Very high94Very high23 Ų2349.4 Ų49.412%0.1224%0.243CC..Hα-helixtrans-60.8-47177.9-75.4179.5000111.5F212 I214 I218 I219 F220 F261 L262F212-L216 HydrophobicContact CD1-CD1 4.09Å; F212-L216 HydrophobicContact CD2-CD1 4.12Å; F212-L216 HydrophobicContact CE1-CD1 3.76Å; F212-L216 HydrophobicContact CE2-CD1 3.79Å; F212-L216 HydrophobicContact CG-CD1 4.26Å; F212-L216 HydrophobicContact CZ-CD1 3.6Å; F212-L216 WeakPolarHBondContact O-CB 3.25Å; F212-L216 VanDerWaalsContact O-CG 3.23Å; F212-L216 WeakPolarHBondContact O-CG 3.22Å; F212-L216 PolarHBondContact O-N 2.89Å; F212-L216 VanDerWaalsContact O-N 3.08Å; I214-L216 VanDerWaalsContact C-N 3.34Å; I214-L216 PolarHBondContact O-N 2.87Å; L216-I218 VanDerWaalsContact C-N 3.34Å; L216-I218 PolarHBondContact O-N 2.93Å; L216-I219 PolarHBondContact O-N 3.38Å; L216-F220 HydrophobicContact CB-CD2 4.39Å; L216-F220 HydrophobicContact CB-CE2 4.47Å; L216-F220 HydrophobicContact CD2-CE2 4.37Å; L216-F220 WeakPolarHBondContact O-CB 3.09Å; L216-F220 WeakPolarHBondContact O-CD2 3.47Å; L216-F220 PolarHBondContact O-N 2.92Å; L216-F261 HydrophobicContact CD2-CD1 4.14Å; L216-F261 HydrophobicContact CD2-CE1 3.93Å; L216-L262 HydrophobicContact CD2-CD2 3.73Å
217F95.2Very high93.5Very high143 Ų14348.7 Ų48.763%0.62724%0.242SC*.Hα-helixtrans-56.9-47.3177.1174.8-98.4000112S213 I214 P215 F220 F221S213-F217 WeakPolarHBondContact O-CB 3.44Å; S213-F217 PolarHBondContact O-N 3.3Å; I214-F217 PolarHBondContact O-N 3.1Å; P215-F217 PolarHBondContact O-N 2.98Å; F217-F220 PolarHBondContact O-N 2.85Å; F217-F221 VanDerWaalsContact O-CB 3.26Å; F217-F221 WeakPolarHBondContact O-CB 3.46Å; F217-F221 PolarHBondContact O-N 2.93Å
218I95.3Very high93.2Very high46 Ų4650.6 Ų50.624%0.23626%0.258CS..Hα-helixtrans-61.5-48.2179-64.8166.4000110.5V129 V133 I214 P215 L216 F220 F221 C222V129-I218 HydrophobicContact CG1-CB 4.35Å; V129-I218 HydrophobicContact CG1-CD1 4.23Å; V129-I218 HydrophobicContact CG1-CG2 3.85Å; V133-I218 HydrophobicContact CG2-CG2 3.82Å; I214-I218 HydrophobicContact CG2-CD1 3.77Å; I214-I218 HydrophobicContact CG2-CG1 4.48Å; I214-I218 WeakPolarHBondContact O-CG1 3.03Å; I214-I218 PolarHBondContact O-N 3.16Å; P215-I218 PolarHBondContact O-N 3.22Å; L216-I218 VanDerWaalsContact C-N 3.34Å; L216-I218 PolarHBondContact O-N 2.93Å; I218-F220 PolarHBondContact O-N 3.01Å; I218-F221 PolarHBondContact O-N 3.13Å; I218-C222 VanDerWaalsContact O-CB 3.31Å; I218-C222 WeakPolarHBondContact O-CB 3.37Å; I218-C222 PolarHBondContact O-N 2.79Å; I218-C222 PolarHBondContact O-SG 2.64Å; I218-C222 VanDerWaalsContact O-SG 3.4Å
219I92.1Very high92.8Very high7 Ų751.9 Ų51.94%0.03627%0.267CS..Hα-helixtrans-58.7-50.1179.8-71.1168000110.6L125 L128 V129 A132 P215 L216 F221 Y223 V258L125-I219 HydrophobicContact CD1-CD1 4.17Å; L128-I219 HydrophobicContact CB-CD1 4.02Å; V129-I219 HydrophobicContact CG2-CD1 3.94Å; V129-I219 HydrophobicContact CG2-CG1 4.01Å; A132-I219 HydrophobicContact CB-CG1 4.29Å; P215-I219 WeakPolarHBondContact O-CB 3.39Å; P215-I219 VanDerWaalsContact O-CG1 3.24Å; P215-I219 WeakPolarHBondContact O-CG1 3.31Å; P215-I219 PolarHBondContact O-N 2.73Å; L216-I219 PolarHBondContact O-N 3.38Å; I219-F221 PolarHBondContact O-N 3.03Å; I219-Y223 HydrophobicContact CG2-CD2 3.63Å; I219-Y223 HydrophobicContact CG2-CE2 3.8Å; I219-Y223 WeakPolarHBondContact O-CB 3.33Å; I219-Y223 WeakPolarHBondContact O-CD2 3.42Å; I219-Y223 PolarHBondContact O-N 2.78Å; I219-V258 HydrophobicContact CG2-CG2 3.91Å
220F91.2Very high92.3Very high97 Ų9749.4 Ų49.443%0.42525%0.252SS..Hα-helixtrans-62.7-43.9179.7-83.2-65.1000112.4L216 F217 I218 S224 V258 L262L216-F220 HydrophobicContact CB-CD2 4.39Å; L216-F220 HydrophobicContact CB-CE2 4.47Å; L216-F220 HydrophobicContact CD2-CE2 4.37Å; L216-F220 WeakPolarHBondContact O-CB 3.09Å; L216-F220 WeakPolarHBondContact O-CD2 3.47Å; L216-F220 PolarHBondContact O-N 2.92Å; F217-F220 PolarHBondContact O-N 2.85Å; I218-F220 PolarHBondContact O-N 3.01Å; F220-S224 WeakPolarHBondContact O-CB 3.46Å; F220-S224 PolarHBondContact O-N 3.14Å; F220-S224 PolarHBondContact O-OG 2.99Å; F220-V258 HydrophobicContact CE1-CG1 4.22Å; F220-V258 HydrophobicContact CZ-CG1 4.45Å; F220-L262 HydrophobicContact CZ-CD1 3.84Å; F220-L262 HydrophobicContact CZ-CD2 4.4Å
221F93.5Very high91.8Very high101 Ų10154.1 Ų54.144%0.44327%0.267SS..Hα-helixtrans-61.6-54178.1174-97.5000111.4F217 I218 I219 Y223 S224 R225F217-F221 VanDerWaalsContact O-CB 3.26Å; F217-F221 WeakPolarHBondContact O-CB 3.46Å; F217-F221 PolarHBondContact O-N 2.93Å; I218-F221 PolarHBondContact O-N 3.13Å; I219-F221 PolarHBondContact O-N 3.03Å; F221-Y223 PolarHBondContact O-N 2.67Å; F221-S224 PolarHBondContact O-N 3.48Å; F221-R225 HydrophobicContact CE1-CG 4.41Å; F221-R225 HydrophobicContact CE2-CG 4.21Å; F221-R225 HydrophobicContact CZ-CG 4.12Å; F221-R225 WeakPolarHBondContact O-CG 3.46Å; F221-R225 PolarHBondContact O-N 2.8Å; F221-R225 VanDerWaalsContact O-N 3.07Å
222C92.3Very high91.4Very high5 Ų556.5 Ų56.53%0.03429%0.287CS..Hα-helixtrans-59.1-47.8-178.2-76.70000111.7A132 I218 R225 L226A132-C222 HydrophobicContact CB-CB 3.88Å; A132-C222 WeakPolarHBondContact O-CB 3.37Å; I218-C222 VanDerWaalsContact O-CB 3.31Å; I218-C222 WeakPolarHBondContact O-CB 3.37Å; I218-C222 PolarHBondContact O-N 2.79Å; I218-C222 PolarHBondContact O-SG 2.64Å; I218-C222 VanDerWaalsContact O-SG 3.4Å; C222-R225 PolarHBondContact O-N 3.23Å; C222-L226 WeakPolarHBondContact O-CB 3.44Å; C222-L226 PolarHBondContact O-N 3.47Å
223Y89.1Confident91Very high10 Ų1056.1 Ų56.14%0.03929%0.293CS..Hα-helixtrans-72.8-32-178.7-74.2-38.5000113.7A132 I219 F221 L226 L227 V254 V258A132-Y223 HydrophobicContact CB-CD2 4.35Å; A132-Y223 HydrophobicContact CB-CE1 4.13Å; A132-Y223 HydrophobicContact CB-CE2 3.98Å; I219-Y223 HydrophobicContact CG2-CD2 3.63Å; I219-Y223 HydrophobicContact CG2-CE2 3.8Å; I219-Y223 WeakPolarHBondContact O-CB 3.33Å; I219-Y223 WeakPolarHBondContact O-CD2 3.42Å; I219-Y223 PolarHBondContact O-N 2.78Å; F221-Y223 PolarHBondContact O-N 2.67Å; Y223-L226 HydrophobicContact CD1-CD2 3.78Å; Y223-L226 HydrophobicContact CE1-CD2 4.17Å; Y223-L226 PolarHBondContact O-N 2.91Å; Y223-L227 WeakPolarHBondContact O-CB 3.5Å; Y223-L227 VanDerWaalsContact O-CG 3.27Å; Y223-L227 WeakPolarHBondContact O-CG 3.09Å; Y223-L227 PolarHBondContact O-N 3.1Å; Y223-V254 HydrophobicContact CD1-CB 4.27Å; Y223-V254 HydrophobicContact CD1-CG1 3.55Å; Y223-V254 HydrophobicContact CD1-CG2 3.72Å; Y223-V254 HydrophobicContact CD2-CG1 3.78Å; Y223-V254 HydrophobicContact CE1-CB 4.42Å; Y223-V254 HydrophobicContact CE1-CG1 4.08Å; Y223-V254 HydrophobicContact CE1-CG2 3.71Å; Y223-V254 HydrophobicContact CE2-CG1 4.27Å; Y223-V254 HydrophobicContact CG-CG1 3.39Å; Y223-V254 HydrophobicContact CG-CG2 4.44Å; Y223-V258 HydrophobicContact CD2-CG2 3.42Å; Y223-V258 VanDerWaalsContact CD2-CG2 3.42Å; Y223-V258 HydrophobicContact CE2-CG2 3.65Å
224S89.7Confident90.6Very high65 Ų6553.3 Ų53.346%0.45527%0.274SS..Hα-helixtrans-62.1-45.7172.1-67.10000111.1F220 F221 L226 L227 C228F220-S224 WeakPolarHBondContact O-CB 3.46Å; F220-S224 PolarHBondContact O-N 3.14Å; F220-S224 PolarHBondContact O-OG 2.99Å; F221-S224 PolarHBondContact O-N 3.48Å; S224-L226 PolarHBondContact O-N 3.32Å; S224-L227 PolarHBondContact O-N 3.41Å; S224-C228 PolarHBondContact O-N 3Å; S224-C228 PolarHBondContact O-SG 3.31Å
225R91.6Very high90.2Very high128 Ų12852.8 Ų52.848%0.48328%0.28SS..Hα-helixtrans-65.1-38.9175.9-66.3-58.1-58.2-171-1.4112.6Y136 C140 F221 C222 T229Y136-R225 HydrophobicContact CD2-CB 3.71Å; Y136-R225 HydrophobicContact CD2-CG 4.44Å; Y136-R225 HydrophobicContact CE2-CB 3.58Å; Y136-R225 HydrophobicContact CE2-CG 3.98Å; C140-R225 PolarHBondContact SG-O 3Å; F221-R225 HydrophobicContact CE1-CG 4.41Å; F221-R225 HydrophobicContact CE2-CG 4.21Å; F221-R225 HydrophobicContact CZ-CG 4.12Å; F221-R225 WeakPolarHBondContact O-CG 3.46Å; F221-R225 PolarHBondContact O-N 2.8Å; F221-R225 VanDerWaalsContact O-N 3.07Å; C222-R225 PolarHBondContact O-N 3.23Å; R225-T229 WeakPolarHBondContact O-CB 3.43Å; R225-T229 PolarHBondContact O-N 3.02Å; R225-T229 PolarHBondContact O-OG1 3.39Å
226L88.2Confident89.9Confident1 Ų160.9 Ų60.91%0.00532%0.318CS..Hα-helixtrans-58.2-54.4174.3-179.666.3000110.8R135 V139 C140 C222 Y223 S224 C228 T229 V230 V250 V254R135-L226 HydrophobicContact CB-CD2 3.98Å; V139-L226 HydrophobicContact CB-CD1 3.47Å; V139-L226 VanDerWaalsContact CB-CD1 3.47Å; V139-L226 HydrophobicContact CG1-CD1 3.58Å; V139-L226 HydrophobicContact CG2-CD1 3.72Å; C140-L226 VanDerWaalsContact SG-CA 3.53Å; C222-L226 WeakPolarHBondContact O-CB 3.44Å; C222-L226 PolarHBondContact O-N 3.47Å; Y223-L226 HydrophobicContact CD1-CD2 3.78Å; Y223-L226 HydrophobicContact CE1-CD2 4.17Å; Y223-L226 PolarHBondContact O-N 2.91Å; S224-L226 PolarHBondContact O-N 3.32Å; L226-C228 VanDerWaalsContact C-N 3.35Å; L226-C228 PolarHBondContact O-N 3.17Å; L226-T229 PolarHBondContact O-N 3.35Å; L226-T229 VanDerWaalsContact O-N 3.12Å; L226-V230 HydrophobicContact CD1-CG2 4.01Å; L226-V230 HydrophobicContact CG-CG2 4.37Å; L226-V230 VanDerWaalsContact O-CG2 3.31Å; L226-V230 WeakPolarHBondContact O-CG2 3.18Å; L226-V230 PolarHBondContact O-N 3.49Å; L226-V250 HydrophobicContact CD2-CG1 4.09Å; L226-V250 HydrophobicContact CG-CG1 4.46Å; L226-V254 HydrophobicContact CD2-CG2 3.75Å
227L88.2Confident89.6Confident32 Ų3264.9 Ų64.917%0.16834%0.336CS..Hα-helixtrans-60.3-42.7-179.6-69174.4000112.1Y223 S224 T229 R231 T251Y223-L227 WeakPolarHBondContact O-CB 3.5Å; Y223-L227 VanDerWaalsContact O-CG 3.27Å; Y223-L227 WeakPolarHBondContact O-CG 3.09Å; Y223-L227 PolarHBondContact O-N 3.1Å; S224-L227 PolarHBondContact O-N 3.41Å; L227-T229 VanDerWaalsContact C-N 3.32Å; L227-T229 PolarHBondContact O-N 3.31Å; L227-R231 VanDerWaalsContact O-CB 3.27Å; L227-R231 WeakPolarHBondContact O-CB 3.49Å; L227-R231 WeakPolarHBondContact O-CG 3.44Å; L227-R231 PolarHBondContact O-N 2.85Å; L227-T251 HydrophobicContact CD2-CG2 3.77Å; L227-T251 VanDerWaalsContact CD2-OG1 3.23Å; L227-T251 WeakPolarHBondContact CD2-OG1 3.42Å
228C90.6Very high88.8Confident79 Ų7965.2 Ų65.253%0.53434%0.339SS..Hα-helixtrans-58.6-44.5174.8-70.60000112S224 L226 A232S224-C228 PolarHBondContact O-N 3Å; S224-C228 PolarHBondContact O-SG 3.31Å; L226-C228 VanDerWaalsContact C-N 3.35Å; L226-C228 PolarHBondContact O-N 3.17Å; C228-A232 WeakPolarHBondContact O-CB 3.04Å; C228-A232 PolarHBondContact O-N 2.92Å
229T88.3Confident88.1Confident44 Ų4472.3 Ų72.327%0.2737%0.372SS..Hα-helixtrans-68.1-47.2-177.3-54.50000111.4C140 R225 L226 L227 R231 A232 A233C140-T229 PolarHBondContact SG-OG1 3.08Å; R225-T229 WeakPolarHBondContact O-CB 3.43Å; R225-T229 PolarHBondContact O-N 3.02Å; R225-T229 PolarHBondContact O-OG1 3.39Å; L226-T229 PolarHBondContact O-N 3.35Å; L226-T229 VanDerWaalsContact O-N 3.12Å; L227-T229 VanDerWaalsContact C-N 3.32Å; L227-T229 PolarHBondContact O-N 3.31Å; T229-R231 PolarHBondContact O-N 3.45Å; T229-A232 PolarHBondContact O-N 3.02Å; T229-A233 PolarHBondContact O-N 2.83Å
230V86.3Confident87.8Confident23 Ų2373.7 Ų73.714%0.13938%0.382CS..Hα-helixtrans-67.5-38.6-178.3-1730000110.8V139 L226 A233 A234 E247V139-V230 HydrophobicContact CG1-CG2 3.8Å; L226-V230 HydrophobicContact CD1-CG2 4.01Å; L226-V230 HydrophobicContact CG-CG2 4.37Å; L226-V230 VanDerWaalsContact O-CG2 3.31Å; L226-V230 WeakPolarHBondContact O-CG2 3.18Å; L226-V230 PolarHBondContact O-N 3.49Å; V230-A233 PolarHBondContact O-N 2.83Å; V230-A234 WeakPolarHBondContact O-CB 3.21Å; V230-A234 PolarHBondContact O-N 3.05Å; V230-E247 HydrophobicContact CB-CG 4.3Å; V230-E247 HydrophobicContact CG1-CB 3.59Å; V230-E247 HydrophobicContact CG1-CG 3.45Å; V230-E247 VanDerWaalsContact CG1-CG 3.45Å
231R87Confident87.3Confident145 Ų14577.2 Ų77.255%0.54740%0.4SS..Hα-helixtrans-64.4-39.7173.8-73.5177.8178.8179.50.7112.8L227 T229 A234 A235L227-R231 VanDerWaalsContact O-CB 3.27Å; L227-R231 WeakPolarHBondContact O-CB 3.49Å; L227-R231 WeakPolarHBondContact O-CG 3.44Å; L227-R231 PolarHBondContact O-N 2.85Å; T229-R231 PolarHBondContact O-N 3.45Å; R231-A234 PolarHBondContact O-N 3.31Å; R231-A235 WeakPolarHBondContact O-CB 3.45Å; R231-A235 PolarHBondContact O-N 3.21Å
232A88.6Confident86.7Confident54 Ų5477.6 Ų77.645%0.44641%0.41SS..Hα-helixtrans-64.3-43.1175.800000111.8C228 T229 A235 Q236C228-A232 WeakPolarHBondContact O-CB 3.04Å; C228-A232 PolarHBondContact O-N 2.92Å; T229-A232 PolarHBondContact O-N 3.02Å; A232-A235 PolarHBondContact O-N 2.96Å; A232-Q236 WeakPolarHBondContact O-CG 3.44Å; A232-Q236 PolarHBondContact O-N 3.49Å; A232-Q236 VanDerWaalsContact O-N 3.08Å
233A85.9Confident85.9Confident40 Ų4079.1 Ų79.133%0.33142%0.419SS..Hα-helixtrans-63.7-43.317600000112.1T229 V230 A235 Q236 Q237T229-A233 PolarHBondContact O-N 2.83Å; V230-A233 PolarHBondContact O-N 2.83Å; A233-A235 VanDerWaalsContact C-N 3.31Å; A233-A235 PolarHBondContact O-N 3.36Å; A233-Q236 PolarHBondContact O-N 3.17Å; A233-Q237 PolarHBondContact O-N 3.4Å
234A87Confident85.3Confident5 Ų581.1 Ų81.14%0.04143%0.429CS..Hα-helixtrans-62.7-37.317500000112V230 R231 Q236 Q237 Q238 Q244 E247V230-A234 WeakPolarHBondContact O-CB 3.21Å; V230-A234 PolarHBondContact O-N 3.05Å; R231-A234 PolarHBondContact O-N 3.31Å; A234-Q236 VanDerWaalsContact C-N 3.32Å; A234-Q236 PolarHBondContact O-N 3.5Å; A234-Q237 CarbonylContact O-C 3.29Å; A234-Q237 VanDerWaalsContact O-C 3.29Å; A234-Q237 PolarHBondContact O-N 3.13Å; A234-Q238 PolarHBondContact O-N 3.46Å; A234-Q244 PolarHBondContact O-NE2 3.29Å; A234-E247 HydrophobicContact CB-CB 4.25Å; A234-E247 HydrophobicContact CB-CG 4.21Å
235A86.9Confident84.8Confident61 Ų6184.8 Ų84.850%0.50443%0.433SS..Hα-helixtrans-67.8-30.3175.600000113.1R231 A232 A233 Q238R231-A235 WeakPolarHBondContact O-CB 3.45Å; R231-A235 PolarHBondContact O-N 3.21Å; A232-A235 PolarHBondContact O-N 2.96Å; A233-A235 VanDerWaalsContact C-N 3.31Å; A233-A235 PolarHBondContact O-N 3.36Å; A235-Q238 WeakPolarHBondContact O-CG 3.29Å
236Q88.3Confident84Confident170 Ų17081 Ų8179%0.79443%0.429SS*.Hα-helixtrans-77.4-29.5174.2-71.2176.7-15.400112.8A232 A233 A234A232-Q236 WeakPolarHBondContact O-CG 3.44Å; A232-Q236 PolarHBondContact O-N 3.49Å; A232-Q236 VanDerWaalsContact O-N 3.08Å; A233-Q236 PolarHBondContact O-N 3.17Å; A234-Q236 VanDerWaalsContact C-N 3.32Å; A234-Q236 PolarHBondContact O-N 3.5Å
237Q85.6Confident83.5Confident106 Ų10682 Ų8250%0.49543%0.434SS..  trans-114.156.8-179.5-65.7-176.9-17.800111.3A233 A234 E239 S240 T243A233-Q237 PolarHBondContact O-N 3.4Å; A234-Q237 CarbonylContact O-C 3.29Å; A234-Q237 VanDerWaalsContact O-C 3.29Å; A234-Q237 PolarHBondContact O-N 3.13Å; Q237-E239 PolarHBondContact O-N 3.36Å; Q237-S240 PolarHBondContact O-N 3.48Å; Q237-T243 HydrophobicContact CB-CG2 4.34Å; Q237-T243 PolarHBondContact OE1-OG1 3.38Å
238Q78.6Confident83Confident150 Ų15087.1 Ų87.170%0.70146%0.455SS*.THydrogen-bonded Turntrans-60.9-33-177.6-80.6177.6-10.200113.4A234 A235 S240A234-Q238 PolarHBondContact O-N 3.46Å; A235-Q238 WeakPolarHBondContact O-CG 3.29Å; Q238-S240 VanDerWaalsContact C-N 3.29Å; Q238-S240 PolarHBondContact O-N 3.4Å
239E81.8Confident82.5Confident196 Ų19687.7 Ų87.792%0.91645%0.449SS*.THydrogen-bonded Turntrans-77.4-13.4-178.8-60.6-171.9167.900113.5Q237 E241Q237-E239 PolarHBondContact O-N 3.36Å; E239-E241 PolarHBondContact O-N 3.01Å
240S84.9Confident81.7Confident35 Ų3587.8 Ų87.825%0.24545%0.45CS..  trans-87.198.8-178.8-175.90000111.5Q237 Q238 T242 T243 Q244Q237-S240 PolarHBondContact O-N 3.48Å; Q238-S240 VanDerWaalsContact C-N 3.29Å; Q238-S240 PolarHBondContact O-N 3.4Å; S240-T242 PolarHBondContact O-N 3Å; S240-T242 PolarHBondContact OG-OG1 3.13Å; S240-T243 PolarHBondContact O-N 3.26Å; S240-T243 PolarHBondContact OG-N 2.92Å; S240-T243 PolarHBondContact OG-OG1 2.83Å; S240-T243 VanDerWaalsContact OG-OG1 3.12Å; S240-Q244 WeakPolarHBondContact O-CG 3.38Å; S240-Q244 PolarHBondContact O-N 3.24Å
241E80.9Confident81.2Confident172 Ų17287.4 Ų87.480%0.80445%0.448SS*.Hα-helixtrans-56.5-33.9173.7-67.4-168.9164.600112.5E239 R245E239-E241 PolarHBondContact O-N 3.01Å; E241-R245 VanDerWaalsContact O-CB 3.3Å; E241-R245 WeakPolarHBondContact O-CB 3.28Å; E241-R245 PolarHBondContact O-N 3.46Å
242T80.3Confident80.9Confident109 Ų10986.5 Ų86.567%0.66944%0.444SS*.Hα-helixtrans-68.5-43.8179.1530000111.6S240 R245 A246S240-T242 PolarHBondContact O-N 3Å; S240-T242 PolarHBondContact OG-OG1 3.13Å; T242-R245 PolarHBondContact O-N 3.28Å; T242-A246 WeakPolarHBondContact O-CB 3.45Å; T242-A246 PolarHBondContact O-N 3.23Å
243T77.4Confident80.4Confident36 Ų3685.5 Ų85.522%0.22143%0.431CS..Hα-helixtrans-64.7-42.8175.4-590000111.4Q237 S240 R245 A246 E247Q237-T243 HydrophobicContact CB-CG2 4.34Å; Q237-T243 PolarHBondContact OE1-OG1 3.38Å; S240-T243 PolarHBondContact O-N 3.26Å; S240-T243 PolarHBondContact OG-N 2.92Å; S240-T243 PolarHBondContact OG-OG1 2.83Å; S240-T243 VanDerWaalsContact OG-OG1 3.12Å; T243-R245 PolarHBondContact O-N 3.3Å; T243-A246 PolarHBondContact O-N 3.34Å; T243-E247 PolarHBondContact O-N 3.01Å
244Q75.6Confident79.9Confident53 Ų5384 Ų8425%0.24842%0.417CS..Hα-helixtrans-62.9-40.5176.4-67.3-65.6-24.600112.4A234 S240 E247 K248A234-Q244 PolarHBondContact O-NE2 3.29Å; S240-Q244 WeakPolarHBondContact O-CG 3.38Å; S240-Q244 PolarHBondContact O-N 3.24Å; Q244-E247 PolarHBondContact O-N 3.41Å; Q244-K248 WeakPolarHBondContact O-CG 3.49Å; Q244-K248 PolarHBondContact O-N 2.72Å; Q244-K248 VanDerWaalsContact O-N 3.12Å
245R79.2Confident79.5Confident142 Ų14287.3 Ų87.354%0.53643%0.433SS..Hα-helixtrans-66.5-43.5176.4-176.7178.3179.4157.57.3111.8E241 T242 T243 E247 K248 E249E241-R245 VanDerWaalsContact O-CB 3.3Å; E241-R245 WeakPolarHBondContact O-CB 3.28Å; E241-R245 PolarHBondContact O-N 3.46Å; T242-R245 PolarHBondContact O-N 3.28Å; T243-R245 PolarHBondContact O-N 3.3Å; R245-E247 VanDerWaalsContact C-N 3.32Å; R245-E247 PolarHBondContact O-N 2.8Å; R245-K248 PolarHBondContact O-N 2.94Å; R245-E249 IonicContact CZ-OE1 2.74Å; R245-E249 IonicContact NE-OE1 3.76Å; R245-E249 PolarHBondContact NE-OE1 3.47Å; R245-E249 IonicContact NH2-OE1 3.45Å; R245-E249 WeakPolarHBondContact O-CG 3.49Å; R245-E249 PolarHBondContact O-N 3Å
246A74.1Confident79.3Confident48 Ų4886.6 Ų86.640%0.39742%0.423SS..Hα-helixtrans-61.4-41.2176.700000111.5T242 T243 E249 V250T242-A246 WeakPolarHBondContact O-CB 3.45Å; T242-A246 PolarHBondContact O-N 3.23Å; T243-A246 PolarHBondContact O-N 3.34Å; A246-E249 PolarHBondContact O-N 3.39Å; A246-V250 VanDerWaalsContact O-CG2 3.31Å; A246-V250 WeakPolarHBondContact O-CG2 3.39Å; A246-V250 PolarHBondContact O-N 3.1Å
247E78.7Confident78.7Confident23 Ų2378.6 Ų78.611%0.10739%0.386CS..Hα-helixtrans-57.1-52.2173.2-175.7-79.6150.800111.5V230 A234 T243 Q244 R245 E249 V250 T251V230-E247 HydrophobicContact CB-CG 4.3Å; V230-E247 HydrophobicContact CG1-CB 3.59Å; V230-E247 HydrophobicContact CG1-CG 3.45Å; V230-E247 VanDerWaalsContact CG1-CG 3.45Å; A234-E247 HydrophobicContact CB-CB 4.25Å; A234-E247 HydrophobicContact CB-CG 4.21Å; T243-E247 PolarHBondContact O-N 3.01Å; Q244-E247 PolarHBondContact O-N 3.41Å; R245-E247 VanDerWaalsContact C-N 3.32Å; R245-E247 PolarHBondContact O-N 2.8Å; E247-E249 VanDerWaalsContact C-N 3.32Å; E247-E249 PolarHBondContact O-N 2.81Å; E247-V250 PolarHBondContact O-N 3.47Å; E247-T251 VanDerWaalsContact O-CB 3.3Å; E247-T251 WeakPolarHBondContact O-CB 3.32Å; E247-T251 PolarHBondContact O-N 2.75Å; E247-T251 PolarHBondContact O-OG1 3.44Å; E247-T251 VanDerWaalsContact O-OG1 3.12Å; E247-T251 PolarHBondContact OE1-OG1 3.13Å
248K77.6Confident78.3Confident138 Ų13874.7 Ų74.760%0.637%0.369SS*.Hα-helixtrans-60.8-41.1-179-72.6176.8-177.2175.60112.3Q244 R245 R252Q244-K248 WeakPolarHBondContact O-CG 3.49Å; Q244-K248 PolarHBondContact O-N 2.72Å; Q244-K248 VanDerWaalsContact O-N 3.12Å; R245-K248 PolarHBondContact O-N 2.94Å; K248-R252 WeakPolarHBondContact O-CB 3.21Å; K248-R252 PolarHBondContact O-N 2.92Å
249E78.9Confident78.6Confident91 Ų9171.9 Ų71.943%0.42536%0.358SS..Hα-helixtrans-65.6-44.5179.1-74.8180-173.200111.7R245 A246 E247 M253R245-E249 IonicContact CZ-OE1 2.74Å; R245-E249 IonicContact NE-OE1 3.76Å; R245-E249 PolarHBondContact NE-OE1 3.47Å; R245-E249 IonicContact NH2-OE1 3.45Å; R245-E249 WeakPolarHBondContact O-CG 3.49Å; R245-E249 PolarHBondContact O-N 3Å; A246-E249 PolarHBondContact O-N 3.39Å; E247-E249 VanDerWaalsContact C-N 3.32Å; E247-E249 PolarHBondContact O-N 2.81Å; E249-M253 WeakPolarHBondContact O-CB 2.98Å; E249-M253 PolarHBondContact O-N 3Å
250V72.4Confident78.7Confident47 Ų4763.1 Ų63.129%0.28532%0.318SS..Hα-helixtrans-65.6-49.3176.7172.80000110.8L226 A246 E247 R252 M253 V254L226-V250 HydrophobicContact CD2-CG1 4.09Å; L226-V250 HydrophobicContact CG-CG1 4.46Å; A246-V250 VanDerWaalsContact O-CG2 3.31Å; A246-V250 WeakPolarHBondContact O-CG2 3.39Å; A246-V250 PolarHBondContact O-N 3.1Å; E247-V250 PolarHBondContact O-N 3.47Å; V250-R252 VanDerWaalsContact C-N 3.33Å; V250-R252 PolarHBondContact O-N 2.87Å; V250-M253 PolarHBondContact O-N 2.96Å; V250-V254 HydrophobicContact CG1-CG2 4.33Å; V250-V254 VanDerWaalsContact O-CG2 3.26Å; V250-V254 WeakPolarHBondContact O-CG2 3.32Å; V250-V254 PolarHBondContact O-N 3.4Å
251T75.9Confident78.4Confident14 Ų1462.1 Ų62.19%0.08631%0.309CS..Hα-helixtrans-58-45.5178.7-68.30000111.1L227 E247 V254 I255L227-T251 HydrophobicContact CD2-CG2 3.77Å; L227-T251 VanDerWaalsContact CD2-OG1 3.23Å; L227-T251 WeakPolarHBondContact CD2-OG1 3.42Å; E247-T251 VanDerWaalsContact O-CB 3.3Å; E247-T251 WeakPolarHBondContact O-CB 3.32Å; E247-T251 PolarHBondContact O-N 2.75Å; E247-T251 PolarHBondContact O-OG1 3.44Å; E247-T251 VanDerWaalsContact O-OG1 3.12Å; E247-T251 PolarHBondContact OE1-OG1 3.13Å; T251-V254 PolarHBondContact O-N 3.05Å; T251-I255 HydrophobicContact CG2-CD1 3.68Å; T251-I255 HydrophobicContact CG2-CG1 4.47Å; T251-I255 WeakPolarHBondContact O-CB 3.2Å; T251-I255 VanDerWaalsContact O-CG1 3.25Å; T251-I255 WeakPolarHBondContact O-CG1 3.16Å; T251-I255 PolarHBondContact O-N 3.09Å
252R81.4Confident78.6Confident127 Ų12756 Ų5648%0.47928%0.282SS..Hα-helixtrans-61-46.6176.4-174.3-177.671.7-173.63111.7K248 V250 V254 I255 V256 L309K248-R252 WeakPolarHBondContact O-CB 3.21Å; K248-R252 PolarHBondContact O-N 2.92Å; V250-R252 VanDerWaalsContact C-N 3.33Å; V250-R252 PolarHBondContact O-N 2.87Å; R252-V254 PolarHBondContact O-N 3.17Å; R252-I255 PolarHBondContact O-N 3.44Å; R252-V256 HydrophobicContact CG-CG2 4.37Å; R252-V256 VanDerWaalsContact O-CG2 3.24Å; R252-V256 WeakPolarHBondContact O-CG2 3.36Å; R252-V256 PolarHBondContact O-N 3.18Å; R252-L309 HydrophobicContact CG-CD2 4.18Å
253M77.8Confident79Confident32 Ų3254.4 Ų54.416%0.15827%0.272CS..Hα-helixtrans-60.1-48.2-179.9-178.1-173.7150.500111.2L72 L131 E249 V250 I255 V256 M257L72-M253 HydrophobicContact CD1-CE 3.45Å; L72-M253 VanDerWaalsContact CD1-CE 3.45Å; L72-M253 HydrophobicContact CD1-SD 3.63Å; L72-M253 HydrophobicContact CG-CE 3.92Å; L131-M253 HydrophobicContact CD2-CE 4.03Å; E249-M253 WeakPolarHBondContact O-CB 2.98Å; E249-M253 PolarHBondContact O-N 3Å; V250-M253 PolarHBondContact O-N 2.96Å; M253-I255 PolarHBondContact O-N 3.11Å; M253-V256 PolarHBondContact O-N 2.83Å; M253-M257 HydrophobicContact CE-SD 3.34Å; M253-M257 WeakPolarHBondContact CE-SD 3.48Å; M253-M257 HydrophobicContact CG-CG 4.48Å; M253-M257 HydrophobicContact CG-SD 3.88Å; M253-M257 WeakPolarHBondContact O-CB 3.45Å; M253-M257 WeakPolarHBondContact O-CG 3.42Å; M253-M257 PolarHBondContact O-N 2.9Å
254V74.1Confident79.5Confident8 Ų852.7 Ų52.75%0.04826%0.261CS..Hα-helixtrans-58.6-50.2179169.50000111.7Y223 L226 V250 T251 R252 V256 M257 V258Y223-V254 HydrophobicContact CD1-CB 4.27Å; Y223-V254 HydrophobicContact CD1-CG1 3.55Å; Y223-V254 HydrophobicContact CD1-CG2 3.72Å; Y223-V254 HydrophobicContact CD2-CG1 3.78Å; Y223-V254 HydrophobicContact CE1-CB 4.42Å; Y223-V254 HydrophobicContact CE1-CG1 4.08Å; Y223-V254 HydrophobicContact CE1-CG2 3.71Å; Y223-V254 HydrophobicContact CE2-CG1 4.27Å; Y223-V254 HydrophobicContact CG-CG1 3.39Å; Y223-V254 HydrophobicContact CG-CG2 4.44Å; L226-V254 HydrophobicContact CD2-CG2 3.75Å; V250-V254 HydrophobicContact CG1-CG2 4.33Å; V250-V254 VanDerWaalsContact O-CG2 3.26Å; V250-V254 WeakPolarHBondContact O-CG2 3.32Å; V250-V254 PolarHBondContact O-N 3.4Å; T251-V254 PolarHBondContact O-N 3.05Å; R252-V254 PolarHBondContact O-N 3.17Å; V254-V256 PolarHBondContact O-N 2.8Å; V254-M257 PolarHBondContact O-N 3.15Å; V254-V258 WeakPolarHBondContact O-CG2 3.4Å; V254-V258 PolarHBondContact O-N 2.83Å
255I79.5Confident80.2Confident75 Ų7552.4 Ų52.439%0.38526%0.258SS..Hα-helixtrans-59.6-48.5-178.8-71.9170.5000110.5T251 R252 M253 M257 V258 I259T251-I255 HydrophobicContact CG2-CD1 3.68Å; T251-I255 HydrophobicContact CG2-CG1 4.47Å; T251-I255 WeakPolarHBondContact O-CB 3.2Å; T251-I255 VanDerWaalsContact O-CG1 3.25Å; T251-I255 WeakPolarHBondContact O-CG1 3.16Å; T251-I255 PolarHBondContact O-N 3.09Å; R252-I255 PolarHBondContact O-N 3.44Å; M253-I255 PolarHBondContact O-N 3.11Å; I255-M257 VanDerWaalsContact C-N 3.33Å; I255-M257 PolarHBondContact O-N 3.3Å; I255-V258 PolarHBondContact O-N 2.72Å; I255-I259 HydrophobicContact CG2-CD1 3.48Å; I255-I259 VanDerWaalsContact CG2-CD1 3.48Å; I255-I259 HydrophobicContact CG2-CG1 4.29Å; I255-I259 WeakPolarHBondContact O-CB 3.34Å; I255-I259 VanDerWaalsContact O-CG1 3.25Å; I255-I259 WeakPolarHBondContact O-CG1 3.3Å; I255-I259 PolarHBondContact O-N 2.89Å
256V82.5Confident80.9Confident47 Ų4747.9 Ų47.929%0.28525%0.246SC..Hα-helixtrans-63.7-41.4-177.3176.70000111R252 M253 V254 S260 I305 L309R252-V256 HydrophobicContact CG-CG2 4.37Å; R252-V256 VanDerWaalsContact O-CG2 3.24Å; R252-V256 WeakPolarHBondContact O-CG2 3.36Å; R252-V256 PolarHBondContact O-N 3.18Å; M253-V256 PolarHBondContact O-N 2.83Å; V254-V256 PolarHBondContact O-N 2.8Å; V256-S260 VanDerWaalsContact O-CB 3.22Å; V256-S260 WeakPolarHBondContact O-CB 3.46Å; V256-S260 PolarHBondContact O-N 3.47Å; V256-S260 PolarHBondContact O-OG 3.12Å; V256-I305 HydrophobicContact CG1-CB 4.4Å; V256-I305 HydrophobicContact CG1-CD1 4Å; V256-I305 HydrophobicContact CG1-CG1 4.14Å; V256-I305 HydrophobicContact CG1-CG2 3.43Å; V256-I305 VanDerWaalsContact CG1-CG2 3.43Å; V256-L309 HydrophobicContact CB-CD1 3.89Å; V256-L309 HydrophobicContact CG1-CD1 3.88Å; V256-L309 HydrophobicContact CG2-CD1 4.35Å
257M75.5Confident81.9Confident2 Ų248.1 Ų48.11%0.0124%0.243CC..Hα-helixtrans-66.5-41179.4-70.3-179.568.300113.6L128 L131 M253 V254 I255 S260 F261 Y306L128-M257 HydrophobicContact CD2-CE 3.23Å; L131-M257 HydrophobicContact CD2-CE 3.19Å; L131-M257 HydrophobicContact CD2-SD 3.83Å; M253-M257 HydrophobicContact CE-SD 3.34Å; M253-M257 WeakPolarHBondContact CE-SD 3.48Å; M253-M257 HydrophobicContact CG-CG 4.48Å; M253-M257 HydrophobicContact CG-SD 3.88Å; M253-M257 WeakPolarHBondContact O-CB 3.45Å; M253-M257 WeakPolarHBondContact O-CG 3.42Å; M253-M257 PolarHBondContact O-N 2.9Å; V254-M257 PolarHBondContact O-N 3.15Å; I255-M257 VanDerWaalsContact C-N 3.33Å; I255-M257 PolarHBondContact O-N 3.3Å; M257-S260 PolarHBondContact O-OG 3.08Å; M257-F261 PolarHBondContact O-N 2.88Å; M257-Y306 HydrophobicContact CE-CE1 3.54Å; M257-Y306 VanDerWaalsContact CE-OH 3.3Å; M257-Y306 WeakPolarHBondContact CE-OH 3.48Å; M257-Y306 HydrophobicContact CG-CE1 3.74Å; M257-Y306 HydrophobicContact SD-CE1 3.73Å
258V78.3Confident82.8Confident24 Ų2448.3 Ų48.315%0.14524%0.243CC..Hα-helixtrans-68.8-47.2177.71730000110.1I219 F220 Y223 V254 I255 S260 F261 L262I219-V258 HydrophobicContact CG2-CG2 3.91Å; F220-V258 HydrophobicContact CE1-CG1 4.22Å; F220-V258 HydrophobicContact CZ-CG1 4.45Å; Y223-V258 HydrophobicContact CD2-CG2 3.42Å; Y223-V258 VanDerWaalsContact CD2-CG2 3.42Å; Y223-V258 HydrophobicContact CE2-CG2 3.65Å; V254-V258 WeakPolarHBondContact O-CG2 3.4Å; V254-V258 PolarHBondContact O-N 2.83Å; I255-V258 PolarHBondContact O-N 2.72Å; V258-S260 VanDerWaalsContact C-N 3.33Å; V258-S260 PolarHBondContact O-N 2.64Å; V258-F261 PolarHBondContact O-N 2.93Å; V258-L262 HydrophobicContact CG1-CD1 3.72Å; V258-L262 HydrophobicContact CG1-CG 4.29Å; V258-L262 VanDerWaalsContact O-CG 3.28Å; V258-L262 WeakPolarHBondContact O-CG 2.98Å; V258-L262 PolarHBondContact O-N 3.43Å
259I84.4Confident83.6Confident91 Ų9142.3 Ų42.347%0.46722%0.219SC..Hα-helixtrans-62.7-42.5179.7-69176.4000110.5I255 F261 L262 V263I255-I259 HydrophobicContact CG2-CD1 3.48Å; I255-I259 VanDerWaalsContact CG2-CD1 3.48Å; I255-I259 HydrophobicContact CG2-CG1 4.29Å; I255-I259 WeakPolarHBondContact O-CB 3.34Å; I255-I259 VanDerWaalsContact O-CG1 3.25Å; I255-I259 WeakPolarHBondContact O-CG1 3.3Å; I255-I259 PolarHBondContact O-N 2.89Å; I259-F261 VanDerWaalsContact C-N 3.34Å; I259-F261 PolarHBondContact O-N 3.36Å; I259-L262 PolarHBondContact O-N 2.87Å; I259-V263 HydrophobicContact CG2-CG2 3.88Å; I259-V263 VanDerWaalsContact O-CB 3.3Å; I259-V263 WeakPolarHBondContact O-CB 3.12Å; I259-V263 VanDerWaalsContact O-CG2 3.24Å; I259-V263 WeakPolarHBondContact O-CG2 3.3Å; I259-V263 PolarHBondContact O-N 3.25Å
260S82.9Confident84.5Confident11 Ų1141.9 Ų41.98%0.07722%0.223CC..Hα-helixtrans-61.4-43.7-179.768.90000111.7V256 M257 V258 C264 I305V256-S260 VanDerWaalsContact O-CB 3.22Å; V256-S260 WeakPolarHBondContact O-CB 3.46Å; V256-S260 PolarHBondContact O-N 3.47Å; V256-S260 PolarHBondContact O-OG 3.12Å; M257-S260 PolarHBondContact O-OG 3.08Å; V258-S260 VanDerWaalsContact C-N 3.33Å; V258-S260 PolarHBondContact O-N 2.64Å; S260-C264 VanDerWaalsContact O-CB 3.24Å; S260-C264 WeakPolarHBondContact O-CB 3.41Å; S260-C264 PolarHBondContact O-N 3Å; S260-I305 VanDerWaalsContact CB-CD1 3.49Å
261F78.6Confident85.7Confident15 Ų1540.5 Ų40.57%0.06622%0.215CC..Hα-helixtrans-63.8-48175.7-177.1-94.5000112.1L125 L128 L216 M257 V258 I259 C264 W265L125-F261 HydrophobicContact CB-CE2 3.86Å; L125-F261 HydrophobicContact CB-CZ 4.08Å; L125-F261 HydrophobicContact CD1-CE1 3.81Å; L125-F261 HydrophobicContact CD1-CE2 3.73Å; L125-F261 HydrophobicContact CD1-CZ 3.31Å; L125-F261 HydrophobicContact CD2-CZ 4.17Å; L125-F261 HydrophobicContact CG-CE2 4.29Å; L125-F261 HydrophobicContact CG-CZ 4.03Å; L128-F261 HydrophobicContact CD1-CB 3.76Å; L128-F261 HydrophobicContact CD1-CD2 3.52Å; L128-F261 HydrophobicContact CD1-CE2 4.4Å; L128-F261 HydrophobicContact CD1-CG 3.78Å; L216-F261 HydrophobicContact CD2-CD1 4.14Å; L216-F261 HydrophobicContact CD2-CE1 3.93Å; M257-F261 PolarHBondContact O-N 2.88Å; V258-F261 PolarHBondContact O-N 2.93Å; I259-F261 VanDerWaalsContact C-N 3.34Å; I259-F261 PolarHBondContact O-N 3.36Å; F261-C264 WeakPolarHBondContact O-CB 3.21Å; F261-C264 PolarHBondContact O-N 2.89Å; F261-W265 AromaticContact CD2-CD1 3.44Å; F261-W265 VanDerWaalsContact CD2-CD1 3.44Å; F261-W265 HydrophobicContact CD2-CG 4.39Å; F261-W265 AromaticContact CD2-NE1 3.96Å; F261-W265 HydrophobicContact CE1-CB 4.33Å; F261-W265 HydrophobicContact CE2-CB 4.42Å; F261-W265 AromaticContact CE2-CD1 3.26Å; F261-W265 AromaticContact CE2-CG 3.9Å; F261-W265 HydrophobicContact CE2-CG 3.9Å; F261-W265 AromaticContact CE2-NE1 3.73Å; F261-W265 HydrophobicContact CZ-CB 4.09Å; F261-W265 AromaticContact CZ-CD1 3.81Å; F261-W265 HydrophobicContact CZ-CG 4.02Å; F261-W265 PolarHBondContact O-N 3.09Å
262L86.1Confident86.7Confident42 Ų4240 Ų4022%0.2221%0.212CC..Hα-helixtrans-62.8-48.1-178.3-69.3172.6000111.7L216 F220 V258 I259 C264 W265 V266L216-L262 HydrophobicContact CD2-CD2 3.73Å; F220-L262 HydrophobicContact CZ-CD1 3.84Å; F220-L262 HydrophobicContact CZ-CD2 4.4Å; V258-L262 HydrophobicContact CG1-CD1 3.72Å; V258-L262 HydrophobicContact CG1-CG 4.29Å; V258-L262 VanDerWaalsContact O-CG 3.28Å; V258-L262 WeakPolarHBondContact O-CG 2.98Å; V258-L262 PolarHBondContact O-N 3.43Å; I259-L262 PolarHBondContact O-N 2.87Å; L262-C264 PolarHBondContact O-N 2.86Å; L262-W265 PolarHBondContact O-N 2.88Å; L262-V266 HydrophobicContact CB-CG2 4.07Å; L262-V266 HydrophobicContact CD2-CG2 3.65Å; L262-V266 HydrophobicContact CG-CG2 4.48Å; L262-V266 WeakPolarHBondContact O-CB 3.34Å; L262-V266 VanDerWaalsContact O-CG2 3.22Å; L262-V266 WeakPolarHBondContact O-CG2 3.33Å; L262-V266 PolarHBondContact O-N 2.88Å
263V88.9Confident87.4Confident76 Ų7639.4 Ų39.446%0.46121%0.21SC..Hα-helixtrans-57.6-38.8179.4166.20000110.5I259 P267 F294I259-V263 HydrophobicContact CG2-CG2 3.88Å; I259-V263 VanDerWaalsContact O-CB 3.3Å; I259-V263 WeakPolarHBondContact O-CB 3.12Å; I259-V263 VanDerWaalsContact O-CG2 3.24Å; I259-V263 WeakPolarHBondContact O-CG2 3.3Å; I259-V263 PolarHBondContact O-N 3.25Å; V263-P267 WeakPolarHBondContact O-CD 3.22Å; V263-P267 WeakPolarHBondContact O-CG 3.02Å; V263-F294 HydrophobicContact CG1-CE1 3.8Å; V263-F294 HydrophobicContact CG1-CZ 3.79Å; V263-F294 VanDerWaalsContact O-CE1 3.27Å; V263-F294 WeakPolarHBondContact O-CE1 3.19Å
264C87.7Confident88.3Confident0 Ų042.5 Ų42.50%022%0.22CC..Hα-helixtrans-72.6-50-178.7-174.90000114.6S260 F261 L262 A295 Y301S260-C264 VanDerWaalsContact O-CB 3.24Å; S260-C264 WeakPolarHBondContact O-CB 3.41Å; S260-C264 PolarHBondContact O-N 3Å; F261-C264 WeakPolarHBondContact O-CB 3.21Å; F261-C264 PolarHBondContact O-N 2.89Å; L262-C264 PolarHBondContact O-N 2.86Å; C264-A295 VanDerWaalsContact SG-CA 3.52Å; C264-A295 PolarHBondContact SG-O 2.97Å; C264-A295 VanDerWaalsContact SG-O 3.34Å; C264-Y301 WeakPolarHBondContact CB-OH 3.36Å; C264-Y301 PolarHBondContact SG-OH 3.43Å
265W90.8Very high89.4Confident47 Ų4742.1 Ų42.118%0.17822%0.218CC..Hα-helixtrans-102.3-27.1-165-68.9101.6000113.3G121 F261 L262 Y268 A269 A295G121-W265 VanDerWaalsContact CA-CZ2 3.49Å; F261-W265 AromaticContact CD2-CD1 3.44Å; F261-W265 VanDerWaalsContact CD2-CD1 3.44Å; F261-W265 HydrophobicContact CD2-CG 4.39Å; F261-W265 AromaticContact CD2-NE1 3.96Å; F261-W265 HydrophobicContact CE1-CB 4.33Å; F261-W265 HydrophobicContact CE2-CB 4.42Å; F261-W265 AromaticContact CE2-CD1 3.26Å; F261-W265 AromaticContact CE2-CG 3.9Å; F261-W265 HydrophobicContact CE2-CG 3.9Å; F261-W265 AromaticContact CE2-NE1 3.73Å; F261-W265 HydrophobicContact CZ-CB 4.09Å; F261-W265 AromaticContact CZ-CD1 3.81Å; F261-W265 HydrophobicContact CZ-CG 4.02Å; F261-W265 PolarHBondContact O-N 3.09Å; L262-W265 PolarHBondContact O-N 2.88Å; W265-Y268 PolarHBondContact O-N 3.46Å; W265-A269 VanDerWaalsContact O-CB 3.31Å; W265-A269 WeakPolarHBondContact O-CB 3.32Å; W265-A269 PolarHBondContact O-N 3.47Å; W265-A295 HydrophobicContact CE3-CB 4.29Å; W265-A295 HydrophobicContact CZ3-CB 4.24Å
266V92.7Very high90.2Very high48 Ų4839.9 Ų39.929%0.29121%0.206SC..Hα-helixtrans-62.3-41.8178.8176.10000111.9F212 L262 Y268 A269 T270F212-V266 HydrophobicContact CZ-CG2 4.37Å; L262-V266 HydrophobicContact CB-CG2 4.07Å; L262-V266 HydrophobicContact CD2-CG2 3.65Å; L262-V266 HydrophobicContact CG-CG2 4.48Å; L262-V266 WeakPolarHBondContact O-CB 3.34Å; L262-V266 VanDerWaalsContact O-CG2 3.22Å; L262-V266 WeakPolarHBondContact O-CG2 3.33Å; L262-V266 PolarHBondContact O-N 2.88Å; V266-Y268 VanDerWaalsContact C-N 3.35Å; V266-Y268 PolarHBondContact O-N 3.25Å; V266-A269 PolarHBondContact O-N 3.24Å; V266-T270 WeakPolarHBondContact O-CB 3.37Å; V266-T270 PolarHBondContact O-N 3.18Å; V266-T270 PolarHBondContact O-OG1 2.68Å
267P96.3Very high90.8Very high52 Ų5240.6 Ų40.634%0.33822%0.216SC..Hα-helixtrans-58.6-45.4175.2-26.336.5000112.6V263 V271 P291V263-P267 WeakPolarHBondContact O-CD 3.22Å; V263-P267 WeakPolarHBondContact O-CG 3.02Å; P267-V271 WeakPolarHBondContact O-CG2 3.33Å; P267-V271 PolarHBondContact O-N 2.81Å; P267-V271 VanDerWaalsContact O-N 3.1Å; P267-P291 HydrophobicContact CB-CB 4Å
268Y96.1Very high91.8Very high28 Ų2843.7 Ų43.711%0.1123%0.233CC..Hα-helixtrans-63.6-51.9177.5-177.7-95.5000111.8E181 W265 V266 T270 V271 A272 M288 A292E181-Y268 WeakPolarHBondContact OE2-CE2 3.3Å; E181-Y268 PolarHBondContact OE2-OH 3.04Å; W265-Y268 PolarHBondContact O-N 3.46Å; V266-Y268 VanDerWaalsContact C-N 3.35Å; V266-Y268 PolarHBondContact O-N 3.25Å; Y268-T270 VanDerWaalsContact C-N 3.28Å; Y268-T270 PolarHBondContact O-N 3.2Å; Y268-V271 PolarHBondContact O-N 2.84Å; Y268-A272 WeakPolarHBondContact O-CB 3.27Å; Y268-A272 PolarHBondContact O-N 2.9Å; Y268-M288 HydrophobicContact CD2-CE 4.49Å; Y268-M288 HydrophobicContact CD2-SD 3.76Å; Y268-M288 HydrophobicContact CE2-CE 4.2Å; Y268-M288 HydrophobicContact CE2-SD 3.59Å; Y268-M288 VanDerWaalsContact CE2-SD 3.59Å; Y268-A292 HydrophobicContact CD2-CB 3.99Å; Y268-A292 HydrophobicContact CE2-CB 3.85Å
269A95.8Very high92.4Very high11 Ų1145.5 Ų45.59%0.09124%0.24CC..Hα-helixtrans-59.6-39179.500000112F208 F212 W265 V266 A272 W273F208-A269 HydrophobicContact CE1-CB 4.06Å; F208-A269 WeakPolarHBondContact CE1-O 3.05Å; F208-A269 VanDerWaalsContact CZ-O 3.31Å; F208-A269 WeakPolarHBondContact CZ-O 3.36Å; F212-A269 HydrophobicContact CD2-CB 4Å; F212-A269 HydrophobicContact CE1-CB 4.44Å; F212-A269 HydrophobicContact CE2-CB 3.51Å; F212-A269 HydrophobicContact CZ-CB 3.77Å; W265-A269 VanDerWaalsContact O-CB 3.31Å; W265-A269 WeakPolarHBondContact O-CB 3.32Å; W265-A269 PolarHBondContact O-N 3.47Å; V266-A269 PolarHBondContact O-N 3.24Å; A269-A272 PolarHBondContact O-N 3.46Å; A269-W273 VanDerWaalsContact O-CB 3.3Å; A269-W273 WeakPolarHBondContact O-CB 3.48Å; A269-W273 PolarHBondContact O-N 3.27Å
270T96.5Very high92.5Very high82 Ų8242.9 Ų42.950%0.50324%0.235SC..Hα-helixtrans-64.5-46.7177.7-580000111.2V266 Y268 Y274V266-T270 WeakPolarHBondContact O-CB 3.37Å; V266-T270 PolarHBondContact O-N 3.18Å; V266-T270 PolarHBondContact O-OG1 2.68Å; Y268-T270 VanDerWaalsContact C-N 3.28Å; Y268-T270 PolarHBondContact O-N 3.2Å; T270-Y274 VanDerWaalsContact O-CB 3.3Å; T270-Y274 WeakPolarHBondContact O-CB 3.25Å; T270-Y274 PolarHBondContact O-N 3.05Å
271V97.3Very high92.9Very high18 Ų1844.4 Ų44.411%0.10924%0.244CC..Hα-helixtrans-67.8-41.3178.7174.60000111.1P267 Y268 Y274 I275 F287 M288 P291P267-V271 WeakPolarHBondContact O-CG2 3.33Å; P267-V271 PolarHBondContact O-N 2.81Å; P267-V271 VanDerWaalsContact O-N 3.1Å; Y268-V271 PolarHBondContact O-N 2.84Å; V271-Y274 PolarHBondContact O-N 2.63Å; V271-I275 HydrophobicContact CG1-CD1 3.94Å; V271-I275 WeakPolarHBondContact O-CG1 3.37Å; V271-I275 PolarHBondContact O-N 2.99Å; V271-F287 HydrophobicContact CG1-CD1 3.74Å; V271-F287 HydrophobicContact CG1-CE1 3.57Å; V271-F287 HydrophobicContact CG1-CG 4.33Å; V271-F287 HydrophobicContact CG1-CZ 4.02Å; V271-F287 HydrophobicContact CG2-CE1 4.45Å; V271-F287 HydrophobicContact CG2-CE2 4.2Å; V271-F287 HydrophobicContact CG2-CZ 4.05Å; V271-M288 HydrophobicContact CB-CE 4.04Å; V271-M288 HydrophobicContact CB-SD 4.48Å; V271-M288 HydrophobicContact CG1-CB 4.35Å; V271-M288 HydrophobicContact CG1-CE 3.55Å; V271-M288 HydrophobicContact CG1-SD 3.97Å; V271-P291 HydrophobicContact CB-CG 4.24Å; V271-P291 HydrophobicContact CG1-CG 4.46Å; V271-P291 HydrophobicContact CG2-CG 4.05Å
272A96.9Very high93.4Very high3 Ų351.1 Ų51.13%0.02528%0.275CS..Hα-helixtrans-62.5-44.9176.800000111.5Y191 F208 Y268 A269 I275 F276 M288Y191-A272 HydrophobicContact CD1-CB 3.83Å; Y191-A272 HydrophobicContact CD2-CB 4.42Å; Y191-A272 HydrophobicContact CE1-CB 3.97Å; Y191-A272 HydrophobicContact CG-CB 4.11Å; F208-A272 HydrophobicContact CZ-CB 4.05Å; Y268-A272 WeakPolarHBondContact O-CB 3.27Å; Y268-A272 PolarHBondContact O-N 2.9Å; A269-A272 PolarHBondContact O-N 3.46Å; A272-I275 PolarHBondContact O-N 2.97Å; A272-F276 WeakPolarHBondContact O-CB 3.42Å; A272-F276 PolarHBondContact O-N 2.9Å; A272-M288 HydrophobicContact CB-CE 3.9Å
273W97.1Very high93.7Very high115 Ų11550.2 Ų50.244%0.43627%0.269SS..Hα-helixtrans-64.6-40.8175.2-172.1-100.7000112.1F208 A269 I275 F276 A277F208-W273 HydrophobicContact CB-CE3 4Å; F208-W273 HydrophobicContact CB-CZ3 3.72Å; F208-W273 HydrophobicContact CD1-CB 4.49Å; F208-W273 HydrophobicContact CD1-CD2 4.32Å; F208-W273 AromaticContact CD1-CE3 3.61Å; F208-W273 HydrophobicContact CD1-CE3 3.61Å; F208-W273 HydrophobicContact CD1-CZ3 4.21Å; F208-W273 AromaticContact CD2-CE3 3.49Å; F208-W273 HydrophobicContact CD2-CE3 3.49Å; F208-W273 VanDerWaalsContact CD2-CE3 3.49Å; F208-W273 AromaticContact CD2-CZ3 3.81Å; F208-W273 HydrophobicContact CD2-CZ3 3.81Å; F208-W273 HydrophobicContact CE1-CB 3.7Å; F208-W273 HydrophobicContact CE1-CD2 4.36Å; F208-W273 AromaticContact CE1-CE3 3.88Å; F208-W273 HydrophobicContact CE1-CE3 3.88Å; F208-W273 HydrophobicContact CE1-CG 4.35Å; F208-W273 HydrophobicContact CE2-CB 4.47Å; F208-W273 AromaticContact CE2-CE3 3.76Å; F208-W273 HydrophobicContact CE2-CE3 3.76Å; F208-W273 HydrophobicContact CE2-CZ3 4.49Å; F208-W273 HydrophobicContact CG-CD2 4.49Å; F208-W273 AromaticContact CG-CE3 3.4Å; F208-W273 HydrophobicContact CG-CE3 3.4Å; F208-W273 AromaticContact CG-CZ3 3.64Å; F208-W273 HydrophobicContact CG-CZ3 3.64Å; F208-W273 HydrophobicContact CZ-CB 3.69Å; F208-W273 AromaticContact CZ-CE3 3.95Å; F208-W273 HydrophobicContact CZ-CE3 3.95Å; A269-W273 VanDerWaalsContact O-CB 3.3Å; A269-W273 WeakPolarHBondContact O-CB 3.48Å; A269-W273 PolarHBondContact O-N 3.27Å; W273-I275 PolarHBondContact O-N 2.84Å; W273-F276 HydrophobicContact CD2-CD1 4.45Å; W273-F276 AromaticContact CE3-CD1 3.98Å; W273-F276 HydrophobicContact CE3-CD1 3.98Å; W273-F276 HydrophobicContact CH2-CD1 4.32Å; W273-F276 HydrophobicContact CH2-CE1 4.19Å; W273-F276 AromaticContact CZ3-CD1 3.91Å; W273-F276 HydrophobicContact CZ3-CD1 3.91Å; W273-F276 HydrophobicContact CZ3-CE1 4.03Å; W273-F276 PolarHBondContact O-N 2.69Å; W273-A277 WeakPolarHBondContact O-CB 3.34Å; W273-A277 PolarHBondContact O-N 3.41Å
274Y97.2Very high93.7Very high97 Ų9748.5 Ų48.538%0.3827%0.268SS..Hα-helixtrans-59.8-46.6176.5174.6-90.3000111.4T270 V271 F276 A277 N278 V281 F287T270-Y274 VanDerWaalsContact O-CB 3.3Å; T270-Y274 WeakPolarHBondContact O-CB 3.25Å; T270-Y274 PolarHBondContact O-N 3.05Å; V271-Y274 PolarHBondContact O-N 2.63Å; Y274-F276 VanDerWaalsContact C-N 3.34Å; Y274-A277 PolarHBondContact O-N 2.84Å; Y274-N278 WeakPolarHBondContact O-CB 3.32Å; Y274-N278 PolarHBondContact O-N 2.88Å; Y274-N278 PolarHBondContact O-ND2 2.89Å; Y274-V281 HydrophobicContact CE1-CG1 3.97Å; Y274-F287 AromaticContact CD1-CE1 3.66Å; Y274-F287 HydrophobicContact CD1-CE1 3.66Å; Y274-F287 AromaticContact CD1-CZ 3.9Å; Y274-F287 HydrophobicContact CD1-CZ 3.9Å; Y274-F287 AromaticContact CE1-CE1 3.99Å; Y274-F287 HydrophobicContact CE1-CE1 3.99Å; Y274-F287 HydrophobicContact CE1-CZ 4.2Å; Y274-F287 HydrophobicContact CG-CZ 4.49Å
275I96.2Very high93.9Very high1 Ų149.4 Ų49.41%0.00527%0.273CS..Hα-helixtrans-64.2-42.1177.6-66.8167.2000110.4Y191 Y192 V271 A272 W273 N278 Q279 F283 F287 M288Y191-I275 HydrophobicContact CD2-CB 3.84Å; Y191-I275 HydrophobicContact CD2-CD1 4.22Å; Y191-I275 HydrophobicContact CD2-CG2 3.69Å; Y191-I275 HydrophobicContact CE2-CB 4.3Å; Y191-I275 HydrophobicContact CE2-CD1 3.78Å; Y191-I275 HydrophobicContact CE2-CG2 4.22Å; Y192-I275 HydrophobicContact CD1-CG2 3.67Å; Y192-I275 HydrophobicContact CE1-CD1 4Å; Y192-I275 HydrophobicContact CE1-CG2 4.01Å; Y192-I275 HydrophobicContact CG-CG2 4.25Å; V271-I275 HydrophobicContact CG1-CD1 3.94Å; V271-I275 WeakPolarHBondContact O-CG1 3.37Å; V271-I275 PolarHBondContact O-N 2.99Å; A272-I275 PolarHBondContact O-N 2.97Å; W273-I275 PolarHBondContact O-N 2.84Å; I275-N278 CarbonylContact O-C 3.42Å; I275-N278 VanDerWaalsContact O-C 3.27Å; I275-N278 PolarHBondContact O-N 2.92Å; I275-Q279 WeakPolarHBondContact O-CA 3.33Å; I275-Q279 WeakPolarHBondContact O-CG 3.4Å; I275-Q279 PolarHBondContact O-N 3.31Å; I275-Q279 VanDerWaalsContact O-N 3.1Å; I275-F283 HydrophobicContact CD1-CD2 4.49Å; I275-F283 HydrophobicContact CD1-CE2 4.02Å; I275-F283 HydrophobicContact CD1-CZ 4.07Å; I275-F283 HydrophobicContact CG1-CD1 4.48Å; I275-F283 HydrophobicContact CG1-CE1 4.14Å; I275-F283 HydrophobicContact CG1-CE2 4.44Å; I275-F283 HydrophobicContact CG1-CZ 4.12Å; I275-F283 HydrophobicContact CG2-CE1 4.18Å; I275-F283 HydrophobicContact CG2-CZ 4.08Å; I275-F287 HydrophobicContact CD1-CD1 4.47Å; I275-F287 HydrophobicContact CG1-CE1 4.36Å; I275-M288 HydrophobicContact CD1-CB 4.44Å; I275-M288 HydrophobicContact CD1-CE 3.96Å
276F96.5Very high94Very high28 Ų2850.8 Ų50.812%0.12329%0.287CS..Hα-helixtrans-61.6-43.5176.3175.4-112.9000113.2Y191 T201 V204 I205 A272 W273 Y274 N278 Q279Y191-F276 WeakPolarHBondContact O-CA 3.32Å; T201-F276 HydrophobicContact CG2-CE2 4.1Å; T201-F276 HydrophobicContact CG2-CZ 3.86Å; V204-F276 HydrophobicContact CB-CD2 4.03Å; V204-F276 HydrophobicContact CB-CE2 3.9Å; V204-F276 HydrophobicContact CB-CG 4.47Å; V204-F276 HydrophobicContact CB-CZ 4.23Å; V204-F276 HydrophobicContact CG1-CB 4.19Å; V204-F276 HydrophobicContact CG1-CD1 3.86Å; V204-F276 HydrophobicContact CG1-CD2 3.65Å; V204-F276 HydrophobicContact CG1-CE1 4.1Å; V204-F276 HydrophobicContact CG1-CE2 3.92Å; V204-F276 HydrophobicContact CG1-CG 3.61Å; V204-F276 HydrophobicContact CG1-CZ 4.12Å; V204-F276 HydrophobicContact CG2-CD2 4.28Å; V204-F276 HydrophobicContact CG2-CE2 4.39Å; I205-F276 HydrophobicContact CD1-CZ 4.47Å; I205-F276 HydrophobicContact CG1-CE1 4.2Å; I205-F276 HydrophobicContact CG1-CZ 4.05Å; A272-F276 WeakPolarHBondContact O-CB 3.42Å; A272-F276 PolarHBondContact O-N 2.9Å; W273-F276 HydrophobicContact CD2-CD1 4.45Å; W273-F276 AromaticContact CE3-CD1 3.98Å; W273-F276 HydrophobicContact CE3-CD1 3.98Å; W273-F276 HydrophobicContact CH2-CD1 4.32Å; W273-F276 HydrophobicContact CH2-CE1 4.19Å; W273-F276 AromaticContact CZ3-CD1 3.91Å; W273-F276 HydrophobicContact CZ3-CD1 3.91Å; W273-F276 HydrophobicContact CZ3-CE1 4.03Å; W273-F276 PolarHBondContact O-N 2.69Å; Y274-F276 VanDerWaalsContact C-N 3.34Å; F276-N278 VanDerWaalsContact C-N 3.27Å; F276-N278 PolarHBondContact O-N 3.34Å; F276-Q279 WeakPolarHBondContact O-CG 3.3Å
277A96.1Very high94.1Very high61 Ų6152.5 Ų52.550%0.50429%0.29SS..Hα-helixtrans-74.3-19.8179.500000112.9W273 Y274W273-A277 WeakPolarHBondContact O-CB 3.34Å; W273-A277 PolarHBondContact O-N 3.41Å; Y274-A277 PolarHBondContact O-N 2.84Å
278N94.7Very high94.1Very high68 Ų6850 Ų5036%0.36428%0.275SS..THydrogen-bonded Turntrans-128.246.3-175.2-57.5-86.6000111.3Y274 I275 F276 G280 V281Y274-N278 WeakPolarHBondContact O-CB 3.32Å; Y274-N278 PolarHBondContact O-N 2.88Å; Y274-N278 PolarHBondContact O-ND2 2.89Å; I275-N278 CarbonylContact O-C 3.42Å; I275-N278 VanDerWaalsContact O-C 3.27Å; I275-N278 PolarHBondContact O-N 2.92Å; F276-N278 VanDerWaalsContact C-N 3.27Å; F276-N278 PolarHBondContact O-N 3.34Å; N278-G280 PolarHBondContact O-N 3.1Å; N278-V281 HydrophobicContact CB-CB 3.99Å; N278-V281 HydrophobicContact CB-CG1 3.8Å; N278-V281 WeakPolarHBondContact O-CB 3.16Å; N278-V281 WeakPolarHBondContact O-CG1 3.46Å; N278-V281 PolarHBondContact O-N 2.83Å
279Q92Very high94.2Very high62 Ų6249.2 Ų49.229%0.2927%0.272SS..THydrogen-bonded Turntrans-56.4131.6-178.1-72.8177.7-24.300111.6Y191 I275 F276 V281Y191-Q279 PolarHBondContact O-NE2 3.18Å; Y191-Q279 VanDerWaalsContact O-NE2 3.17Å; I275-Q279 WeakPolarHBondContact O-CA 3.33Å; I275-Q279 WeakPolarHBondContact O-CG 3.4Å; I275-Q279 PolarHBondContact O-N 3.31Å; I275-Q279 VanDerWaalsContact O-N 3.1Å; F276-Q279 WeakPolarHBondContact O-CG 3.3Å; Q279-V281 VanDerWaalsContact C-N 3.33Å
280G86.2Confident94.2Very high35 Ų3551.4 Ų51.436%0.36129%0.291SS..THydrogen-bonded Turntrans82.70.1-175.400000115.2N2 N278N2-G280 WeakPolarHBondContact CB-O 3.13Å; N2-G280 PolarHBondContact ND2-O 2.95Å; N278-G280 PolarHBondContact O-N 3.1Å
281V90.7Very high94.2Very high44 Ų4448.1 Ų48.127%0.26727%0.271SS..  trans-63.4151.4169.577.30000110.7Y274 N278 Q279 F283Y274-V281 HydrophobicContact CE1-CG1 3.97Å; N278-V281 HydrophobicContact CB-CB 3.99Å; N278-V281 HydrophobicContact CB-CG1 3.8Å; N278-V281 WeakPolarHBondContact O-CB 3.16Å; N278-V281 WeakPolarHBondContact O-CG1 3.46Å; N278-V281 PolarHBondContact O-N 2.83Å; Q279-V281 VanDerWaalsContact C-N 3.33Å; V281-F283 HydrophobicContact CG1-CD1 3.75Å; V281-F283 HydrophobicContact CG1-CE1 4.25Å; V281-F283 WeakPolarHBondContact O-CD1 3.47Å; V281-F283 WeakPolarHBondContact O-CE1 3.28Å
282E89.7Confident94.2Very high155 Ų15547.5 Ų47.572%0.72427%0.267SS*.  trans-77.6126.4174.4-170.7175-178.400110.3N2N2-E282 HydrophobicContact CB-CB 4.03Å
283F91.6Very high94.2Very high23 Ų2347.9 Ų47.910%0.10127%0.268CS..  trans-150.8147.5171.255.1-89.9000109.1Y10 P12 Y192 I275 V281 F287Y10-F283 AromaticContact CE1-CZ 4Å; Y10-F283 HydrophobicContact CE1-CZ 4Å; P12-F283 HydrophobicContact CB-CD2 3.94Å; P12-F283 HydrophobicContact CB-CE2 3.43Å; P12-F283 VanDerWaalsContact CB-CE2 3.43Å; P12-F283 HydrophobicContact CB-CZ 4.04Å; P12-F283 HydrophobicContact CG-CE2 4.38Å; Y192-F283 HydrophobicContact CD1-CE2 4.46Å; Y192-F283 AromaticContact CD1-CZ 3.81Å; Y192-F283 HydrophobicContact CD1-CZ 3.81Å; Y192-F283 AromaticContact CE1-CE2 3.8Å; Y192-F283 HydrophobicContact CE1-CE2 3.8Å; Y192-F283 AromaticContact CE1-CZ 3.6Å; Y192-F283 HydrophobicContact CE1-CZ 3.6Å; I275-F283 HydrophobicContact CD1-CD2 4.49Å; I275-F283 HydrophobicContact CD1-CE2 4.02Å; I275-F283 HydrophobicContact CD1-CZ 4.07Å; I275-F283 HydrophobicContact CG1-CD1 4.48Å; I275-F283 HydrophobicContact CG1-CE1 4.14Å; I275-F283 HydrophobicContact CG1-CE2 4.44Å; I275-F283 HydrophobicContact CG1-CZ 4.12Å; I275-F283 HydrophobicContact CG2-CE1 4.18Å; I275-F283 HydrophobicContact CG2-CZ 4.08Å; V281-F283 HydrophobicContact CG1-CD1 3.75Å; V281-F283 HydrophobicContact CG1-CE1 4.25Å; V281-F283 WeakPolarHBondContact O-CD1 3.47Å; V281-F283 WeakPolarHBondContact O-CE1 3.28Å; F283-F287 HydrophobicContact CB-CB 4.45Å; F283-F287 HydrophobicContact CB-CD1 3.85Å; F283-F287 HydrophobicContact CB-CE1 4.48Å; F283-F287 HydrophobicContact CB-CG 4.37Å; F283-F287 HydrophobicContact CD2-CD1 4.15Å; F283-F287 HydrophobicContact CG-CD1 4.13Å
284G89.5Confident94.2Very high41 Ų4146.6 Ų46.642%0.42327%0.266SS..  trans-76.5160.1178.400000112.8V286 F287G284-V286 VanDerWaalsContact C-N 3.27Å; G284-V286 PolarHBondContact O-N 3.01Å; G284-F287 WeakPolarHBondContact O-CB 3.34Å; G284-F287 PolarHBondContact O-N 3.2Å; G284-F287 VanDerWaalsContact O-N 3.13Å
285P91.2Very high94.1Very high18 Ų1842.2 Ų42.212%0.11725%0.25CS..THydrogen-bonded Turntrans-62.2-31.9-179.124.1-33.8000113.1P12 L31 G182 M183 F287 T289P12-P285 HydrophobicContact CG-CB 4.16Å; L31-P285 HydrophobicContact CB-CB 4.22Å; L31-P285 HydrophobicContact CB-CG 3.99Å; L31-P285 HydrophobicContact CD1-CB 4.47Å; L31-P285 VanDerWaalsContact O-CG 3.28Å; L31-P285 WeakPolarHBondContact O-CG 3.31Å; G182-P285 CarbonylContact C-O 3.16Å; G182-P285 WeakPolarHBondContact CA-O 3.48Å; G182-P285 WeakPolarHBondContact O-CB 3.45Å; M183-P285 HydrophobicContact CG-CB 4.03Å; P285-F287 PolarHBondContact O-N 2.88Å; P285-T289 PolarHBondContact O-N 3.4Å; P285-T289 PolarHBondContact O-OG1 3.36Å
286V93.5Very high94Very high77 Ų7742.7 Ų42.747%0.46725%0.252SS..Hα-helixtrans-65.1-26.4179.2179.60000112.4G284 M288 T289 A290G284-V286 VanDerWaalsContact C-N 3.27Å; G284-V286 PolarHBondContact O-N 3.01Å; V286-M288 VanDerWaalsContact C-N 3.29Å; V286-M288 PolarHBondContact O-N 3.32Å; V286-T289 PolarHBondContact O-N 3.45Å; V286-A290 PolarHBondContact O-N 3.23Å
287F95.2Very high93.9Very high83 Ų8342.1 Ų42.136%0.36425%0.252SS..Hα-helixtrans-57.5-40.4-175.9-176.3-122.3000112.7V271 Y274 I275 F283 G284 P285 P291V271-F287 HydrophobicContact CG1-CD1 3.74Å; V271-F287 HydrophobicContact CG1-CE1 3.57Å; V271-F287 HydrophobicContact CG1-CG 4.33Å; V271-F287 HydrophobicContact CG1-CZ 4.02Å; V271-F287 HydrophobicContact CG2-CE1 4.45Å; V271-F287 HydrophobicContact CG2-CE2 4.2Å; V271-F287 HydrophobicContact CG2-CZ 4.05Å; Y274-F287 AromaticContact CD1-CE1 3.66Å; Y274-F287 HydrophobicContact CD1-CE1 3.66Å; Y274-F287 AromaticContact CD1-CZ 3.9Å; Y274-F287 HydrophobicContact CD1-CZ 3.9Å; Y274-F287 AromaticContact CE1-CE1 3.99Å; Y274-F287 HydrophobicContact CE1-CE1 3.99Å; Y274-F287 HydrophobicContact CE1-CZ 4.2Å; Y274-F287 HydrophobicContact CG-CZ 4.49Å; I275-F287 HydrophobicContact CD1-CD1 4.47Å; I275-F287 HydrophobicContact CG1-CE1 4.36Å; F283-F287 HydrophobicContact CB-CB 4.45Å; F283-F287 HydrophobicContact CB-CD1 3.85Å; F283-F287 HydrophobicContact CB-CE1 4.48Å; F283-F287 HydrophobicContact CB-CG 4.37Å; F283-F287 HydrophobicContact CD2-CD1 4.15Å; F283-F287 HydrophobicContact CG-CD1 4.13Å; G284-F287 WeakPolarHBondContact O-CB 3.34Å; G284-F287 PolarHBondContact O-N 3.2Å; G284-F287 VanDerWaalsContact O-N 3.13Å; P285-F287 PolarHBondContact O-N 2.88Å; F287-P291 WeakPolarHBondContact O-CD 3.48Å; F287-P291 WeakPolarHBondContact O-CG 3.28Å
288M96.1Very high93.7Very high1 Ų139.4 Ų39.41%0.00523%0.229CC..Hα-helixtrans-93.3-31173.2-177.5519100113E181 Y191 Y268 V271 A272 I275 V286 A290 P291 A292E181-M288 HydrophobicContact CB-CG 4Å; E181-M288 HydrophobicContact CG-CG 4.42Å; Y191-M288 HydrophobicContact CD2-CE 4.48Å; Y191-M288 HydrophobicContact CE1-CE 4.12Å; Y191-M288 HydrophobicContact CE2-CE 3.46Å; Y191-M288 VanDerWaalsContact CE2-CE 3.46Å; Y191-M288 WeakPolarHBondContact OH-CE 3.41Å; Y191-M288 VanDerWaalsContact OH-CG 3.31Å; Y191-M288 WeakPolarHBondContact OH-CG 3.28Å; Y268-M288 HydrophobicContact CD2-CE 4.49Å; Y268-M288 HydrophobicContact CD2-SD 3.76Å; Y268-M288 HydrophobicContact CE2-CE 4.2Å; Y268-M288 HydrophobicContact CE2-SD 3.59Å; Y268-M288 VanDerWaalsContact CE2-SD 3.59Å; V271-M288 HydrophobicContact CB-CE 4.04Å; V271-M288 HydrophobicContact CB-SD 4.48Å; V271-M288 HydrophobicContact CG1-CB 4.35Å; V271-M288 HydrophobicContact CG1-CE 3.55Å; V271-M288 HydrophobicContact CG1-SD 3.97Å; A272-M288 HydrophobicContact CB-CE 3.9Å; I275-M288 HydrophobicContact CD1-CB 4.44Å; I275-M288 HydrophobicContact CD1-CE 3.96Å; V286-M288 VanDerWaalsContact C-N 3.29Å; V286-M288 PolarHBondContact O-N 3.32Å; M288-A290 VanDerWaalsContact C-N 3.34Å; M288-A290 PolarHBondContact O-N 3.31Å; M288-P291 VanDerWaalsContact O-CD 3.29Å; M288-P291 WeakPolarHBondContact O-CD 3.41Å; M288-P291 WeakPolarHBondContact O-CG 3.4Å; M288-P291 HydrophobicContact SD-CG 4.14Å; M288-A292 WeakPolarHBondContact O-CB 3.35Å; M288-A292 PolarHBondContact O-N 2.91Å; M288-A292 VanDerWaalsContact O-N 3.07Å; M288-A292 HydrophobicContact SD-CB 4.4Å
289T97.3Very high93.6Very high10 Ų1036.1 Ų36.16%0.06121%0.211CC..Hα-helixtrans-56.7-46.3178-57.40000112.1L40 G182 M183 P285 V286 A292 F293L40-T289 HydrophobicContact CD1-CG2 3.9Å; L40-T289 HydrophobicContact CD2-CG2 3.95Å; G182-T289 WeakPolarHBondContact CA-OG1 3.43Å; M183-T289 HydrophobicContact CB-CG2 4.47Å; M183-T289 HydrophobicContact CG-CG2 4.36Å; M183-T289 WeakPolarHBondContact CG-OG1 3.15Å; M183-T289 PolarHBondContact N-OG1 2.92Å; M183-T289 HydrophobicContact SD-CG2 4.02Å; P285-T289 PolarHBondContact O-N 3.4Å; P285-T289 PolarHBondContact O-OG1 3.36Å; V286-T289 PolarHBondContact O-N 3.45Å; T289-A292 PolarHBondContact O-N 3.28Å; T289-F293 HydrophobicContact CG2-CD2 3.67Å; T289-F293 HydrophobicContact CG2-CE2 3.87Å; T289-F293 WeakPolarHBondContact O-CB 3.41Å; T289-F293 VanDerWaalsContact O-CD2 3.28Å; T289-F293 WeakPolarHBondContact O-CD2 3.42Å; T289-F293 PolarHBondContact O-N 3.29Å
290A96.9Very high93.6Very high58 Ų5834.8 Ų34.848%0.47921%0.206SC..Hα-helixtrans-59.5-55.8-175.600000113.1V286 M288 F294V286-A290 PolarHBondContact O-N 3.23Å; M288-A290 VanDerWaalsContact C-N 3.34Å; M288-A290 PolarHBondContact O-N 3.31Å; A290-F294 VanDerWaalsContact O-CB 3.24Å; A290-F294 WeakPolarHBondContact O-CB 3.4Å; A290-F294 PolarHBondContact O-N 3.4Å
291P97.3Very high93.6Very high13 Ų1335.4 Ų35.48%0.08420%0.198CC..Hα-helixtrans-68.5-33.6178.227.8-36.7000113.3P267 V271 F287 M288 F294 A295P267-P291 HydrophobicContact CB-CB 4Å; V271-P291 HydrophobicContact CB-CG 4.24Å; V271-P291 HydrophobicContact CG1-CG 4.46Å; V271-P291 HydrophobicContact CG2-CG 4.05Å; F287-P291 WeakPolarHBondContact O-CD 3.48Å; F287-P291 WeakPolarHBondContact O-CG 3.28Å; M288-P291 VanDerWaalsContact O-CD 3.29Å; M288-P291 WeakPolarHBondContact O-CD 3.41Å; M288-P291 WeakPolarHBondContact O-CG 3.4Å; M288-P291 HydrophobicContact SD-CG 4.14Å; P291-F294 PolarHBondContact O-N 2.89Å; P291-A295 WeakPolarHBondContact O-CB 3.36Å; P291-A295 PolarHBondContact O-N 3.47Å
292A96.7Very high93.3Very high4 Ų433.9 Ų33.93%0.03319%0.188CC..Hα-helixtrans-62.9-47.8178.300000111.9E181 Y268 M288 T289 A295 K296E181-A292 WeakPolarHBondContact OE1-CB 3.4Å; Y268-A292 HydrophobicContact CD2-CB 3.99Å; Y268-A292 HydrophobicContact CE2-CB 3.85Å; M288-A292 WeakPolarHBondContact O-CB 3.35Å; M288-A292 PolarHBondContact O-N 2.91Å; M288-A292 VanDerWaalsContact O-N 3.07Å; M288-A292 HydrophobicContact SD-CB 4.4Å; T289-A292 PolarHBondContact O-N 3.28Å; A292-A295 PolarHBondContact O-N 2.92Å; A292-K296 WeakPolarHBondContact O-CG 3.46Å; A292-K296 PolarHBondContact O-N 3.46Å
293F96.9Very high93Very high11 Ų1126.7 Ų26.75%0.04816%0.155CC..Hα-helixtrans-73.1-32.9177.4-79.6-101.5000112L40 Y43 M44 T94 C185 T289 A295 K296L40-F293 HydrophobicContact CB-CE1 4.12Å; L40-F293 HydrophobicContact CB-CZ 4.38Å; L40-F293 HydrophobicContact CD1-CE1 4.42Å; L40-F293 HydrophobicContact CD1-CE2 4.16Å; L40-F293 HydrophobicContact CD1-CZ 3.95Å; L40-F293 HydrophobicContact CD2-CD1 3.78Å; L40-F293 HydrophobicContact CD2-CD2 4.14Å; L40-F293 HydrophobicContact CD2-CE1 3.86Å; L40-F293 HydrophobicContact CD2-CE2 4.22Å; L40-F293 HydrophobicContact CD2-CG 3.91Å; L40-F293 HydrophobicContact CD2-CZ 4.09Å; L40-F293 HydrophobicContact CG-CE1 4.35Å; L40-F293 HydrophobicContact CG-CZ 4.37Å; Y43-F293 HydrophobicContact CD1-CB 4.48Å; Y43-F293 AromaticContact CD1-CD1 3.96Å; Y43-F293 HydrophobicContact CD1-CD1 3.96Å; Y43-F293 HydrophobicContact CE1-CB 4.05Å; Y43-F293 HydrophobicContact CE1-CD1 4.16Å; Y43-F293 PolarHBondContact OH-O 3.46Å; Y43-F293 VanDerWaalsContact OH-O 3.1Å; M44-F293 HydrophobicContact CG-CD1 4.22Å; M44-F293 HydrophobicContact CG-CE1 3.75Å; M44-F293 HydrophobicContact SD-CD1 3.61Å; M44-F293 HydrophobicContact SD-CE1 3.63Å; T94-F293 HydrophobicContact CG2-CE1 3.66Å; T94-F293 HydrophobicContact CG2-CZ 3.73Å; C185-F293 HydrophobicContact CB-CZ 4.11Å; T289-F293 HydrophobicContact CG2-CD2 3.67Å; T289-F293 HydrophobicContact CG2-CE2 3.87Å; T289-F293 WeakPolarHBondContact O-CB 3.41Å; T289-F293 VanDerWaalsContact O-CD2 3.28Å; T289-F293 WeakPolarHBondContact O-CD2 3.42Å; T289-F293 PolarHBondContact O-N 3.29Å; F293-A295 VanDerWaalsContact C-N 3.32Å; F293-A295 PolarHBondContact O-N 2.76Å; F293-K296 WeakPolarHBondContact O-CB 3.32Å; F293-K296 PolarHBondContact O-N 2.97Å
294F96.1Very high92.7Very high89 Ų8928.2 Ų28.239%0.3917%0.166SC..Hα-helixtrans-61.1-41.6172.2-175.2-102.2000111.7V263 A290 P291 K296 S297V263-F294 HydrophobicContact CG1-CE1 3.8Å; V263-F294 HydrophobicContact CG1-CZ 3.79Å; V263-F294 VanDerWaalsContact O-CE1 3.27Å; V263-F294 WeakPolarHBondContact O-CE1 3.19Å; A290-F294 VanDerWaalsContact O-CB 3.24Å; A290-F294 WeakPolarHBondContact O-CB 3.4Å; A290-F294 PolarHBondContact O-N 3.4Å; P291-F294 PolarHBondContact O-N 2.89Å; F294-K296 VanDerWaalsContact C-N 3.26Å; F294-K296 PolarHBondContact O-N 2.68Å; F294-S297 VanDerWaalsContact O-CB 3.3Å; F294-S297 WeakPolarHBondContact O-CB 3.07Å; F294-S297 PolarHBondContact O-N 3.04Å; F294-S297 PolarHBondContact O-OG 3.43Å
295A94.8Very high92.4Very high5 Ų527.7 Ų27.74%0.04115%0.153CC..Hα-helixtrans-60.6-35.817700000112.4C264 W265 P291 A292 F293 S297 A298C264-A295 VanDerWaalsContact SG-CA 3.52Å; C264-A295 PolarHBondContact SG-O 2.97Å; C264-A295 VanDerWaalsContact SG-O 3.34Å; W265-A295 HydrophobicContact CE3-CB 4.29Å; W265-A295 HydrophobicContact CZ3-CB 4.24Å; P291-A295 WeakPolarHBondContact O-CB 3.36Å; P291-A295 PolarHBondContact O-N 3.47Å; A292-A295 PolarHBondContact O-N 2.92Å; F293-A295 VanDerWaalsContact C-N 3.32Å; F293-A295 PolarHBondContact O-N 2.76Å; A295-S297 PolarHBondContact O-N 3.46Å; A295-A298 WeakPolarHBondContact O-CB 3.42Å; A295-A298 PolarHBondContact O-N 3.34Å
296K95.3Very high91.6Very high11 Ų1127.5 Ų27.55%0.04815%0.15CC..Hα-helixtrans-61.8-23.3175.5-63.2-179-160.8-720113M44 L47 F91 E113 S186 A292 F293 F294 A298 A299M44-K296 HydrophobicContact CE-CD 3.78Å; M44-K296 HydrophobicContact SD-CD 3.98Å; L47-K296 HydrophobicContact CD1-CB 4.06Å; F91-K296 HydrophobicContact CD1-CD 4.24Å; F91-K296 HydrophobicContact CE1-CB 3.62Å; F91-K296 HydrophobicContact CE1-CD 3.95Å; F91-K296 HydrophobicContact CE1-CG 3.74Å; F91-K296 HydrophobicContact CZ-CB 3.73Å; F91-K296 HydrophobicContact CZ-CG 4.35Å; F91-K296 WeakPolarHBondContact CZ-O 3.47Å; E113-K296 IonicContact OE1-NZ 2.64Å; E113-K296 PolarHBondContact OE1-NZ 3.44Å; S186-K296 WeakPolarHBondContact OG-CE 3.29Å; S186-K296 PolarHBondContact OG-NZ 3.48Å; A292-K296 WeakPolarHBondContact O-CG 3.46Å; A292-K296 PolarHBondContact O-N 3.46Å; F293-K296 WeakPolarHBondContact O-CB 3.32Å; F293-K296 PolarHBondContact O-N 2.97Å; F294-K296 VanDerWaalsContact C-N 3.26Å; F294-K296 PolarHBondContact O-N 2.68Å; K296-A298 PolarHBondContact O-N 3.25Å; K296-A298 VanDerWaalsContact O-N 3.1Å; K296-A299 PolarHBondContact O-N 2.87Å
297S94.1Very high90.9Very high16 Ų1624.7 Ų24.711%0.11213%0.133CC..THydrogen-bonded Turntrans-62.9-15.2173.772.10000114Y43 F294 A295 A299 L300 Y301Y43-S297 WeakPolarHBondContact OH-CB 3.4Å; F294-S297 VanDerWaalsContact O-CB 3.3Å; F294-S297 WeakPolarHBondContact O-CB 3.07Å; F294-S297 PolarHBondContact O-N 3.04Å; F294-S297 PolarHBondContact O-OG 3.43Å; A295-S297 PolarHBondContact O-N 3.46Å; S297-A299 PolarHBondContact O-N 2.73Å; S297-L300 PolarHBondContact O-N 3.35Å; S297-Y301 VanDerWaalsContact C-CD1 3.45Å; S297-Y301 VanDerWaalsContact C-CE1 3.42Å; S297-Y301 WeakPolarHBondContact O-CD1 3.4Å; S297-Y301 PolarHBondContact O-N 3.35Å; S297-Y301 VanDerWaalsContact O-N 3.12Å; S297-Y301 WeakPolarHBondContact OG-CD1 3.43Å; S297-Y301 VanDerWaalsContact OG-CE1 3.31Å; S297-Y301 WeakPolarHBondContact OG-CE1 3.25Å
298A91.8Very high90.1Very high3 Ų325.7 Ų25.73%0.02514%0.141CC..Hα-helixtrans-50.6-43174.800000113.4A295 K296 L300 Y301 N302A295-A298 WeakPolarHBondContact O-CB 3.42Å; A295-A298 PolarHBondContact O-N 3.34Å; K296-A298 PolarHBondContact O-N 3.25Å; K296-A298 VanDerWaalsContact O-N 3.1Å; A298-L300 PolarHBondContact O-N 2.9Å; A298-L300 VanDerWaalsContact O-N 3.08Å; A298-Y301 WeakPolarHBondContact CA-OH 3.43Å; A298-Y301 HydrophobicContact CB-CE1 4.11Å; A298-Y301 VanDerWaalsContact CB-OH 3.27Å; A298-Y301 WeakPolarHBondContact CB-OH 3.34Å; A298-Y301 VanDerWaalsContact N-CE1 3.25Å; A298-Y301 PolarHBondContact O-N 3.47Å; A298-N302 WeakPolarHBondContact O-CB 3.23Å; A298-N302 VanDerWaalsContact O-CG 3.25Å; A298-N302 PolarHBondContact O-N 3.33Å; A298-N302 PolarHBondContact O-ND2 3.23Å
299A92.3Very high89.1Confident0 Ų027.5 Ų27.50%015%0.151CC..Hα-helixtrans-60.9-21.9179.700000113.4A51 N55 D83 M86 I87 F91 K296 S297A51-A299 HydrophobicContact CB-CB 4.25Å; N55-A299 PolarHBondContact ND2-O 3.29Å; D83-A299 HydrophobicContact CB-CB 4.01Å; M86-A299 HydrophobicContact CE-CB 3.5Å; I87-A299 HydrophobicContact CD1-CB 4.36Å; I87-A299 HydrophobicContact CG1-CB 4.3Å; F91-A299 HydrophobicContact CE2-CB 3.88Å; F91-A299 HydrophobicContact CZ-CB 3.95Å; K296-A299 PolarHBondContact O-N 2.87Å; S297-A299 PolarHBondContact O-N 2.73Å
300L92.1Very high88.2Confident34 Ų3428.3 Ų28.318%0.17816%0.155CC..Hα-helixtrans-92.4-57.2176.717959.2000111.7F46 L47 T50 A51 I54 S297 A298 N302 P303 V304F46-L300 HydrophobicContact CE1-CD2 3.76Å; F46-L300 HydrophobicContact CZ-CD2 3.87Å; L47-L300 HydrophobicContact CD2-CB 4.28Å; L47-L300 HydrophobicContact CD2-CD2 4.26Å; T50-L300 WeakPolarHBondContact OG1-CD2 3.38Å; A51-L300 HydrophobicContact CB-CB 4.15Å; A51-L300 HydrophobicContact CB-CD1 4.41Å; I54-L300 HydrophobicContact CG2-CD1 4.28Å; S297-L300 PolarHBondContact O-N 3.35Å; A298-L300 PolarHBondContact O-N 2.9Å; A298-L300 VanDerWaalsContact O-N 3.08Å; L300-N302 VanDerWaalsContact C-N 3.34Å; L300-N302 PolarHBondContact O-N 2.02Å; L300-P303 WeakPolarHBondContact O-CD 3.39Å; L300-V304 WeakPolarHBondContact O-CG2 2.98Å
301Y85.8Confident87.3Confident48 Ų4830.2 Ų30.219%0.18815%0.149CC..Hα-helixtrans-74.9-24.7-169.170.6-108.5000112.4C264 S297 A298 V304 I305C264-Y301 WeakPolarHBondContact CB-OH 3.36Å; C264-Y301 PolarHBondContact SG-OH 3.43Å; S297-Y301 VanDerWaalsContact C-CD1 3.45Å; S297-Y301 VanDerWaalsContact C-CE1 3.42Å; S297-Y301 WeakPolarHBondContact O-CD1 3.4Å; S297-Y301 PolarHBondContact O-N 3.35Å; S297-Y301 VanDerWaalsContact O-N 3.12Å; S297-Y301 WeakPolarHBondContact OG-CD1 3.43Å; S297-Y301 VanDerWaalsContact OG-CE1 3.31Å; S297-Y301 WeakPolarHBondContact OG-CE1 3.25Å; A298-Y301 WeakPolarHBondContact CA-OH 3.43Å; A298-Y301 HydrophobicContact CB-CE1 4.11Å; A298-Y301 VanDerWaalsContact CB-OH 3.27Å; A298-Y301 WeakPolarHBondContact CB-OH 3.34Å; A298-Y301 VanDerWaalsContact N-CE1 3.25Å; A298-Y301 PolarHBondContact O-N 3.47Å; Y301-V304 PolarHBondContact O-N 3.21Å; Y301-I305 HydrophobicContact CD2-CD1 3.75Å; Y301-I305 HydrophobicContact CE2-CD1 4.38Å; Y301-I305 WeakPolarHBondContact O-CB 3.36Å; Y301-I305 VanDerWaalsContact O-CG1 3.3Å; Y301-I305 WeakPolarHBondContact O-CG1 3.19Å; Y301-I305 PolarHBondContact O-N 2.96Å
302N84.4Confident86.5Confident11 Ų1133.8 Ų33.86%0.05917%0.165CC..Hα-helixtrans-57.9-60.7177.9-81.9-22.8000110.6L79 A298 L300 V304 I305 Y306L79-N302 HydrophobicContact CD2-CB 3.88Å; A298-N302 WeakPolarHBondContact O-CB 3.23Å; A298-N302 VanDerWaalsContact O-CG 3.25Å; A298-N302 PolarHBondContact O-N 3.33Å; A298-N302 PolarHBondContact O-ND2 3.23Å; L300-N302 VanDerWaalsContact C-N 3.34Å; L300-N302 PolarHBondContact O-N 2.02Å; N302-V304 VanDerWaalsContact C-N 3.27Å; N302-V304 PolarHBondContact O-N 3.09Å; N302-I305 WeakPolarHBondContact O-CB 3.26Å; N302-I305 PolarHBondContact O-N 3.41Å; N302-I305 VanDerWaalsContact O-N 3.15Å; N302-Y306 VanDerWaalsContact C-CD2 3.47Å; N302-Y306 HydrophobicContact CB-CE2 4.06Å; N302-Y306 WeakPolarHBondContact O-CD2 3.5Å; N302-Y306 WeakPolarHBondContact O-CE2 3.43Å; N302-Y306 PolarHBondContact O-N 2.93Å; N302-Y306 VanDerWaalsContact O-N 3.13Å
303P83.8Confident85.9Confident5 Ų533.7 Ų33.73%0.03216%0.164CC..Hα-helixtrans-51.9-42.4174-28.633.4000113.9I54 N55 L300 I305 Y306 I307I54-P303 HydrophobicContact CD1-CB 4.07Å; I54-P303 HydrophobicContact CG1-CB 3.91Å; I54-P303 HydrophobicContact CG2-CB 4.19Å; I54-P303 HydrophobicContact CG2-CG 4.34Å; N55-P303 WeakPolarHBondContact OD1-CG 3.38Å; L300-P303 WeakPolarHBondContact O-CD 3.39Å; P303-I305 PolarHBondContact O-N 2.9Å; P303-Y306 PolarHBondContact O-N 2.93Å; P303-I307 HydrophobicContact CB-CD1 4.34Å; P303-I307 WeakPolarHBondContact O-CB 3.4Å; P303-I307 VanDerWaalsContact O-CD1 3.28Å; P303-I307 WeakPolarHBondContact O-CD1 3.29Å; P303-I307 WeakPolarHBondContact O-CG1 3.24Å; P303-I307 PolarHBondContact O-N 3.07Å
304V85.9Confident85.4Confident54 Ų5437.1 Ų37.133%0.32718%0.176SC..Hα-helixtrans-57.9-49.2179.1173.50000110.9I54 L300 Y301 N302 Y306 I307 L308I54-V304 HydrophobicContact CD1-CG2 3.5Å; L300-V304 WeakPolarHBondContact O-CG2 2.98Å; Y301-V304 PolarHBondContact O-N 3.21Å; N302-V304 VanDerWaalsContact C-N 3.27Å; N302-V304 PolarHBondContact O-N 3.09Å; V304-Y306 VanDerWaalsContact C-N 3.32Å; V304-Y306 PolarHBondContact O-N 2.62Å; V304-I307 PolarHBondContact O-N 2.91Å; V304-L308 HydrophobicContact CG1-CD1 3.74Å; V304-L308 HydrophobicContact CG1-CG 4.34Å; V304-L308 WeakPolarHBondContact O-CB 3.46Å; V304-L308 VanDerWaalsContact O-CG 3.24Å; V304-L308 WeakPolarHBondContact O-CG 3.41Å; V304-L308 PolarHBondContact O-N 3.26Å
305I82.6Confident84.9Confident30 Ų3034.9 Ų34.915%0.15417%0.168CC..Hα-helixtrans-55.6-49.4177-76173.7000110.2V256 S260 Y301 N302 P303 L308 L309V256-I305 HydrophobicContact CG1-CB 4.4Å; V256-I305 HydrophobicContact CG1-CD1 4Å; V256-I305 HydrophobicContact CG1-CG1 4.14Å; V256-I305 HydrophobicContact CG1-CG2 3.43Å; V256-I305 VanDerWaalsContact CG1-CG2 3.43Å; S260-I305 VanDerWaalsContact CB-CD1 3.49Å; Y301-I305 HydrophobicContact CD2-CD1 3.75Å; Y301-I305 HydrophobicContact CE2-CD1 4.38Å; Y301-I305 WeakPolarHBondContact O-CB 3.36Å; Y301-I305 VanDerWaalsContact O-CG1 3.3Å; Y301-I305 WeakPolarHBondContact O-CG1 3.19Å; Y301-I305 PolarHBondContact O-N 2.96Å; N302-I305 WeakPolarHBondContact O-CB 3.26Å; N302-I305 PolarHBondContact O-N 3.41Å; N302-I305 VanDerWaalsContact O-N 3.15Å; P303-I305 PolarHBondContact O-N 2.9Å; I305-L308 PolarHBondContact O-N 3.01Å; I305-L309 HydrophobicContact CG2-CD1 3.58Å; I305-L309 HydrophobicContact CG2-CG 4.42Å; I305-L309 VanDerWaalsContact O-CB 3.32Å; I305-L309 WeakPolarHBondContact O-CB 3.5Å; I305-L309 WeakPolarHBondContact O-CG 3.45Å; I305-L309 PolarHBondContact O-N 3.33Å
306Y74Confident84.4Confident14 Ų1435.4 Ų35.46%0.05517%0.171CC..Hα-helixtrans-68.3-39.8-176.4-63-62.6000113.3L76 L79 M257 N302 P303 V304 L308 L309 N310L76-Y306 VanDerWaalsContact CD2-CB 3.5Å; L76-Y306 HydrophobicContact CD2-CD1 3.33Å; L76-Y306 HydrophobicContact CD2-CD2 3.48Å; L76-Y306 VanDerWaalsContact CD2-CD2 3.48Å; L76-Y306 HydrophobicContact CD2-CE1 3.82Å; L76-Y306 HydrophobicContact CD2-CE2 4.04Å; L76-Y306 HydrophobicContact CD2-CG 3.13Å; L76-Y306 HydrophobicContact CG-CG 4.44Å; L79-Y306 HydrophobicContact CD2-CD2 4.08Å; L79-Y306 HydrophobicContact CD2-CE2 3.31Å; M257-Y306 HydrophobicContact CE-CE1 3.54Å; M257-Y306 VanDerWaalsContact CE-OH 3.3Å; M257-Y306 WeakPolarHBondContact CE-OH 3.48Å; M257-Y306 HydrophobicContact CG-CE1 3.74Å; M257-Y306 HydrophobicContact SD-CE1 3.73Å; N302-Y306 VanDerWaalsContact C-CD2 3.47Å; N302-Y306 HydrophobicContact CB-CE2 4.06Å; N302-Y306 WeakPolarHBondContact O-CD2 3.5Å; N302-Y306 WeakPolarHBondContact O-CE2 3.43Å; N302-Y306 PolarHBondContact O-N 2.93Å; N302-Y306 VanDerWaalsContact O-N 3.13Å; P303-Y306 PolarHBondContact O-N 2.93Å; V304-Y306 VanDerWaalsContact C-N 3.32Å; V304-Y306 PolarHBondContact O-N 2.62Å; Y306-L308 VanDerWaalsContact C-N 3.34Å; Y306-L309 PolarHBondContact O-N 3.23Å; Y306-N310 WeakPolarHBondContact O-CB 3.41Å; Y306-N310 PolarHBondContact O-N 3.44Å
307I79Confident84Confident19 Ų1935.8 Ų35.810%0.09717%0.174CC..Hα-helixtrans-62.5-43.4176-68.8157.8000110.5I54 P303 V304 F313 M317I54-I307 HydrophobicContact CD1-CD1 3.73Å; I54-I307 HydrophobicContact CG1-CD1 3.62Å; P303-I307 HydrophobicContact CB-CD1 4.34Å; P303-I307 WeakPolarHBondContact O-CB 3.4Å; P303-I307 VanDerWaalsContact O-CD1 3.28Å; P303-I307 WeakPolarHBondContact O-CD1 3.29Å; P303-I307 WeakPolarHBondContact O-CG1 3.24Å; P303-I307 PolarHBondContact O-N 3.07Å; V304-I307 PolarHBondContact O-N 2.91Å; I307-F313 HydrophobicContact CB-CD1 4.44Å; I307-F313 HydrophobicContact CG1-CD1 3.78Å; I307-F313 HydrophobicContact CG1-CE1 3.66Å; I307-M317 HydrophobicContact CD1-CE 3.6Å; I307-M317 HydrophobicContact CD1-SD 3.82Å; I307-M317 HydrophobicContact CG1-CE 3.88Å; I307-M317 HydrophobicContact CG1-SD 4.04Å; I307-M317 HydrophobicContact CG2-SD 3.94Å
308L79.4Confident83.7Confident104 Ų10436.9 Ų36.955%0.54518%0.178SC..Hα-helixtrans-71.4-35.2-178.7-68.8177000112.4V304 I305 Y306V304-L308 HydrophobicContact CG1-CD1 3.74Å; V304-L308 HydrophobicContact CG1-CG 4.34Å; V304-L308 WeakPolarHBondContact O-CB 3.46Å; V304-L308 VanDerWaalsContact O-CG 3.24Å; V304-L308 WeakPolarHBondContact O-CG 3.41Å; V304-L308 PolarHBondContact O-N 3.26Å; I305-L308 PolarHBondContact O-N 3.01Å; Y306-L308 VanDerWaalsContact C-N 3.34Å
309L75.7Confident83.5Confident39 Ų3938.4 Ų38.420%0.20419%0.187CC..Hα-helixtrans-81.7-30.1-178.7-68175.3000113.4R252 V256 I305 Y306R252-L309 HydrophobicContact CG-CD2 4.18Å; V256-L309 HydrophobicContact CB-CD1 3.89Å; V256-L309 HydrophobicContact CG1-CD1 3.88Å; V256-L309 HydrophobicContact CG2-CD1 4.35Å; I305-L309 HydrophobicContact CG2-CD1 3.58Å; I305-L309 HydrophobicContact CG2-CG 4.42Å; I305-L309 VanDerWaalsContact O-CB 3.32Å; I305-L309 WeakPolarHBondContact O-CB 3.5Å; I305-L309 WeakPolarHBondContact O-CG 3.45Å; I305-L309 PolarHBondContact O-N 3.33Å; Y306-L309 PolarHBondContact O-N 3.23Å
310N77.4Confident83.2Confident27 Ų2739.2 Ų39.214%0.14419%0.192CC..  trans-98.293.3-178.3-171.2-25000111.3N73 Y306 Q312 F313 R314N73-N310 PolarHBondContact OD1-ND2 3.4Å; N73-N310 VanDerWaalsContact OD1-ND2 3.13Å; Y306-N310 WeakPolarHBondContact O-CB 3.41Å; Y306-N310 PolarHBondContact O-N 3.44Å; N310-Q312 VanDerWaalsContact C-N 3.28Å; N310-Q312 PolarHBondContact O-N 3.46Å; N310-Q312 WeakPolarHBondContact OD1-CB 3.38Å; N310-Q312 PolarHBondContact OD1-N 2.87Å; N310-F313 HydrophobicContact CB-CB 3.73Å; N310-F313 VanDerWaalsContact CG-CB 3.47Å; N310-F313 WeakPolarHBondContact O-CB 3.39Å; N310-F313 PolarHBondContact O-N 2.65Å; N310-F313 VanDerWaalsContact O-N 3.08Å; N310-F313 PolarHBondContact OD1-N 3.3Å; N310-R314 PolarHBondContact O-N 2.73Å
311R78.4Confident83Confident98 Ų9841.9 Ų41.937%0.3721%0.209SC..Hα-helixtrans-58-37.9-179.5-175.6169.7170.1-145.4-7.4112.8R314 N315 E332R311-R314 PolarHBondContact O-N 2.84Å; R311-N315 PolarHBondContact O-N 2.91Å; R311-N315 VanDerWaalsContact O-N 3.07Å; R311-N315 PolarHBondContact O-OD1 2.89Å; R311-E332 VanDerWaalsContact CZ-CD 3.49Å; R311-E332 IonicContact CZ-OE1 3.38Å; R311-E332 IonicContact CZ-OE2 2.7Å; R311-E332 IonicContact NE-OE1 3.05Å; R311-E332 PolarHBondContact NE-OE1 3.34Å; R311-E332 IonicContact NE-OE2 3.85Å; R311-E332 PolarHBondContact NE-OE2 3.31Å; R311-E332 IonicContact NH1-OE1 3.07Å; R311-E332 IonicContact NH2-OE1 3.22Å; R311-E332 PolarHBondContact NH2-OE1 3.14Å; R311-E332 IonicContact NH2-OE2 2.88Å; R311-E332 PolarHBondContact NH2-OE2 2.89Å
312Q80.8Confident83.1Confident88 Ų8842 Ų4241%0.41122%0.217SC..Hα-helixtrans-62.8-45.5176.5-174.1-171.8-12.400110.7K67 L68 N310 N315 C316K67-Q312 PolarHBondContact O-NE2 3.32Å; L68-Q312 HydrophobicContact CD2-CG 3.91Å; N310-Q312 VanDerWaalsContact C-N 3.28Å; N310-Q312 PolarHBondContact O-N 3.46Å; N310-Q312 WeakPolarHBondContact OD1-CB 3.38Å; N310-Q312 PolarHBondContact OD1-N 2.87Å; Q312-N315 PolarHBondContact O-N 3.14Å; Q312-C316 PolarHBondContact O-N 3.5Å
313F82.9Confident83.2Confident1 Ų147.3 Ų47.30%0.00425%0.253CS..Hα-helixtrans-62.1-48.4177.5-166.6-95.7000112T58 V61 T62 L68 I307 N310 N315 C316 M317T58-F313 HydrophobicContact CG2-CE1 4.27Å; T58-F313 HydrophobicContact CG2-CZ 3.7Å; V61-F313 HydrophobicContact CB-CZ 4.37Å; V61-F313 HydrophobicContact CG1-CE2 4.24Å; V61-F313 HydrophobicContact CG1-CZ 4.24Å; T62-F313 WeakPolarHBondContact OG1-CE2 3.19Å; L68-F313 HydrophobicContact CD1-CD2 3.68Å; L68-F313 HydrophobicContact CD1-CE2 3.87Å; L68-F313 HydrophobicContact CD2-CD2 4.17Å; L68-F313 HydrophobicContact CG-CD2 4.49Å; I307-F313 HydrophobicContact CB-CD1 4.44Å; I307-F313 HydrophobicContact CG1-CD1 3.78Å; I307-F313 HydrophobicContact CG1-CE1 3.66Å; N310-F313 HydrophobicContact CB-CB 3.73Å; N310-F313 VanDerWaalsContact CG-CB 3.47Å; N310-F313 WeakPolarHBondContact O-CB 3.39Å; N310-F313 PolarHBondContact O-N 2.65Å; N310-F313 VanDerWaalsContact O-N 3.08Å; N310-F313 PolarHBondContact OD1-N 3.3Å; F313-N315 VanDerWaalsContact C-N 3.32Å; F313-N315 PolarHBondContact O-N 3.49Å; F313-C316 PolarHBondContact O-N 2.92Å; F313-M317 HydrophobicContact CD1-CE 4.36Å; F313-M317 HydrophobicContact CE1-CE 3.47Å; F313-M317 VanDerWaalsContact CE1-CE 3.47Å; F313-M317 HydrophobicContact CE1-SD 4.47Å; F313-M317 HydrophobicContact CZ-CE 4.15Å; F313-M317 WeakPolarHBondContact O-CB 3.49Å; F313-M317 PolarHBondContact O-N 3.11Å
314R86.4Confident82.7Confident84 Ų8449.8 Ų49.832%0.31728%0.279SS..Hα-helixtrans-54.2-46.8177.8-170.6174.567-161.57112.2N310 R311 M317 I318N310-R314 PolarHBondContact O-N 2.73Å; R311-R314 PolarHBondContact O-N 2.84Å; R314-M317 PolarHBondContact O-N 2.86Å; R314-I318 HydrophobicContact CG-CD1 4.07Å; R314-I318 WeakPolarHBondContact O-CG1 3.32Å; R314-I318 PolarHBondContact O-N 3.38Å
315N85.5Confident82.1Confident41 Ų4154.9 Ų54.922%0.21930%0.297CS..Hα-helixtrans-65.5-41.5-179.7-67.9-3.2000111.8R311 Q312 F313 M317 T319R311-N315 PolarHBondContact O-N 2.91Å; R311-N315 VanDerWaalsContact O-N 3.07Å; R311-N315 PolarHBondContact O-OD1 2.89Å; Q312-N315 PolarHBondContact O-N 3.14Å; F313-N315 VanDerWaalsContact C-N 3.32Å; F313-N315 PolarHBondContact O-N 3.49Å; N315-M317 VanDerWaalsContact C-N 3.34Å; N315-T319 WeakPolarHBondContact O-CB 3.33Å; N315-T319 PolarHBondContact O-N 2.93Å; N315-T319 PolarHBondContact O-OG1 3.5Å
316C85.6Confident81.6Confident16 Ų1655.2 Ų55.211%0.10830%0.299CS..Hα-helixtrans-64.9-36.8174.2-76.40000112.4V61 H65 L68 Q312 F313 T320V61-C316 HydrophobicContact CG1-CB 3.99Å; H65-C316 HydrophobicContact CB-CB 4.49Å; H65-C316 PolarHBondContact NE2-O 3.23Å; L68-C316 HydrophobicContact CD1-CB 3.83Å; L68-C316 HydrophobicContact CG-CB 4.42Å; Q312-C316 PolarHBondContact O-N 3.5Å; F313-C316 PolarHBondContact O-N 2.92Å; C316-T320 WeakPolarHBondContact O-CB 3.27Å; C316-T320 PolarHBondContact O-N 2.82Å; C316-T320 PolarHBondContact O-OG1 3.39Å
317M86.8Confident80.9Confident20 Ų2058 Ų5810%0.09932%0.319CS..Hα-helixtrans-66.3-49.5176.7-178.7174.2-87.400111.2L57 V61 I307 F313 R314 N315 T319 T320 V321L57-M317 HydrophobicContact CB-CE 4.35Å; L57-M317 HydrophobicContact CD2-CE 3.81Å; L57-M317 HydrophobicContact CD2-CG 3.75Å; L57-M317 HydrophobicContact CD2-SD 3.88Å; L57-M317 HydrophobicContact CG-CE 3.81Å; L57-M317 HydrophobicContact CG-CG 4.23Å; L57-M317 HydrophobicContact CG-SD 4.48Å; V61-M317 HydrophobicContact CG1-CB 4.38Å; V61-M317 HydrophobicContact CG2-CB 4.29Å; V61-M317 HydrophobicContact CG2-CG 4.34Å; I307-M317 HydrophobicContact CD1-CE 3.6Å; I307-M317 HydrophobicContact CD1-SD 3.82Å; I307-M317 HydrophobicContact CG1-CE 3.88Å; I307-M317 HydrophobicContact CG1-SD 4.04Å; I307-M317 HydrophobicContact CG2-SD 3.94Å; F313-M317 HydrophobicContact CD1-CE 4.36Å; F313-M317 HydrophobicContact CE1-CE 3.47Å; F313-M317 VanDerWaalsContact CE1-CE 3.47Å; F313-M317 HydrophobicContact CE1-SD 4.47Å; F313-M317 HydrophobicContact CZ-CE 4.15Å; F313-M317 WeakPolarHBondContact O-CB 3.49Å; F313-M317 PolarHBondContact O-N 3.11Å; R314-M317 PolarHBondContact O-N 2.86Å; N315-M317 VanDerWaalsContact C-N 3.34Å; M317-T319 VanDerWaalsContact C-N 3.32Å; M317-T319 PolarHBondContact O-N 3.25Å; M317-T320 WeakPolarHBondContact O-CA 3.29Å; M317-T320 WeakPolarHBondContact O-CB 3.49Å; M317-T320 PolarHBondContact O-N 3.4Å; M317-V321 WeakPolarHBondContact O-CG2 3.38Å; M317-V321 PolarHBondContact O-N 3.5Å
318I86.8Confident80.2Confident39 Ų3963.4 Ų63.420%0.234%0.342CS..Hα-helixtrans-56.5-48.1175-67.8166.5000110.4R314 T320 V321 C322 N326 F328R314-I318 HydrophobicContact CG-CD1 4.07Å; R314-I318 WeakPolarHBondContact O-CG1 3.32Å; R314-I318 PolarHBondContact O-N 3.38Å; I318-T320 PolarHBondContact O-N 2.99Å; I318-T320 VanDerWaalsContact O-N 3.17Å; I318-V321 PolarHBondContact O-N 3.38Å; I318-C322 VanDerWaalsContact O-CB 3.3Å; I318-C322 WeakPolarHBondContact O-CB 3.37Å; I318-C322 PolarHBondContact O-N 3.45Å; I318-N326 VanDerWaalsContact CG2-OD1 3.27Å; I318-N326 WeakPolarHBondContact CG2-OD1 3.41Å; I318-F328 HydrophobicContact CD1-CD2 4.25Å; I318-F328 HydrophobicContact CG2-CD2 4.14Å
319T86.9Confident79.2Confident34 Ų3459.5 Ų59.521%0.20933%0.327CS..Hα-helixtrans-56.3-35.4176.9-54.70000112N315 M317 G324N315-T319 WeakPolarHBondContact O-CB 3.33Å; N315-T319 PolarHBondContact O-N 2.93Å; N315-T319 PolarHBondContact O-OG1 3.5Å; M317-T319 VanDerWaalsContact C-N 3.32Å; M317-T319 PolarHBondContact O-N 3.25Å; T319-G324 WeakPolarHBondContact O-CA 3.49Å; T319-G324 PolarHBondContact O-N 2.98Å
320T87.1Confident78Confident18 Ų1863.6 Ų63.611%0.1135%0.349CS..Hα-helixtrans-75.2-43.2179.8-56.20000111.9V61 K64 H65 C316 M317 I318 C323V61-T320 HydrophobicContact CG2-CG2 4.02Å; K64-T320 HydrophobicContact CD-CG2 4.21Å; H65-T320 PolarHBondContact NE2-OG1 2.9Å; C316-T320 WeakPolarHBondContact O-CB 3.27Å; C316-T320 PolarHBondContact O-N 2.82Å; C316-T320 PolarHBondContact O-OG1 3.39Å; M317-T320 WeakPolarHBondContact O-CA 3.29Å; M317-T320 WeakPolarHBondContact O-CB 3.49Å; M317-T320 PolarHBondContact O-N 3.4Å; I318-T320 PolarHBondContact O-N 2.99Å; I318-T320 VanDerWaalsContact O-N 3.17Å; T320-C323 PolarHBondContact O-N 3.05Å
321V88.3Confident76.7Confident90 Ų9067.9 Ų67.955%0.54537%0.372SS..Hα-helixtrans-68.1-36.3178.2174.20000111.4L57 M317 I318 C323L57-V321 HydrophobicContact CD1-CG2 4.28Å; L57-V321 HydrophobicContact CD2-CG2 3.81Å; M317-V321 WeakPolarHBondContact O-CG2 3.38Å; M317-V321 PolarHBondContact O-N 3.5Å; I318-V321 PolarHBondContact O-N 3.38Å; V321-C323 VanDerWaalsContact C-N 3.27Å; V321-C323 PolarHBondContact O-N 2.9Å
322C88.2Confident75.3Confident50 Ų5067 Ų6734%0.33837%0.372SS..THydrogen-bonded Turntrans-90.827179-64.20000113.3I318 G324 K325I318-C322 VanDerWaalsContact O-CB 3.3Å; I318-C322 WeakPolarHBondContact O-CB 3.37Å; I318-C322 PolarHBondContact O-N 3.45Å; C322-G324 VanDerWaalsContact C-N 3.29Å; C322-G324 PolarHBondContact O-N 2.91Å; C322-G324 VanDerWaalsContact O-N 3.15Å; C322-K325 WeakPolarHBondContact CB-O 3.2Å; C322-K325 PolarHBondContact O-N 3.08Å; C322-K325 VanDerWaalsContact O-N 3.09Å
323C84.8Confident73.6Confident123 Ų12365.5 Ų65.583%0.83137%0.374SS*.THydrogen-bonded Turntrans51.140.7172.8-61.90000115T320 V321T320-C323 PolarHBondContact O-N 3.05Å; V321-C323 VanDerWaalsContact C-N 3.27Å; V321-C323 PolarHBondContact O-N 2.9Å
324G74.8Confident71.5Confident56 Ų5668.3 Ų68.358%0.57740%0.398SS*.THydrogen-bonded Turntrans97.7-4.8177.200000115.1T319 C322T319-G324 WeakPolarHBondContact O-CA 3.49Å; T319-G324 PolarHBondContact O-N 2.98Å; C322-G324 VanDerWaalsContact C-N 3.29Å; C322-G324 PolarHBondContact O-N 2.91Å; C322-G324 VanDerWaalsContact O-N 3.15Å
325K73.6Confident69.5Low161 Ų16166.7 Ų66.770%0.740%0.402SS*.  trans-96.9138.3174-60.3-179.6-177.9178.10109.7C322 P327C322-K325 WeakPolarHBondContact CB-O 3.2Å; C322-K325 PolarHBondContact O-N 3.08Å; C322-K325 VanDerWaalsContact O-N 3.09Å; K325-P327 VanDerWaalsContact O-CD 3.3Å; K325-P327 WeakPolarHBondContact O-CD 3.36Å
326N70.6Confident67.6Low37 Ų3767.4 Ų67.420%0.19841%0.414CS..  trans-111.685168.5-168.910.2000109.3I318 F328 G329I318-N326 VanDerWaalsContact CG2-OD1 3.27Å; I318-N326 WeakPolarHBondContact CG2-OD1 3.41Å; N326-F328 PolarHBondContact O-N 3.21Å; N326-G329 WeakPolarHBondContact ND2-CA 3.24Å; N326-G329 PolarHBondContact O-N 2.87Å
327P60.6Low65.6Low72 Ų7270.8 Ų70.847%0.46843%0.434SS..THydrogen-bonded Turntrans-61.9-12.8-174.723.4-32.3000114.1K325K325-P327 VanDerWaalsContact O-CD 3.3Å; K325-P327 WeakPolarHBondContact O-CD 3.36Å
328F64.4Low63.4Low134 Ų13473.1 Ų73.159%0.58845%0.452SS*.THydrogen-bonded Turntrans-109.92.5178-54.9-73.6000113.4I318 N326I318-F328 HydrophobicContact CD1-CD2 4.25Å; I318-F328 HydrophobicContact CG2-CD2 4.14Å; N326-F328 PolarHBondContact O-N 3.21Å
329G56.8Low61.4Low21 Ų2178.8 Ų78.822%0.21648%0.475CS..THydrogen-bonded Turntrans-81.6-28.6-178.600000113.9N326N326-G329 WeakPolarHBondContact ND2-CA 3.24Å; N326-G329 PolarHBondContact O-N 2.87Å
330D52Low59.3Low125 Ų12581.8 Ų81.867%0.66849%0.494SS*.Hα-helixtrans-79.5-28.1-172.9-65.3-25000112.5E332 A333 A334D330-E332 PolarHBondContact O-N 3.35Å; D330-A333 PolarHBondContact O-N 3.34Å; D330-A334 WeakPolarHBondContact O-CB 3.41Å; D330-A334 PolarHBondContact O-N 3.45Å
331D49.5Very low57Low117 Ų11786.9 Ų86.963%0.62652%0.516SS*.Hα-helixtrans-68.4-33.9179.6-71.4-28000113.2A335D331-A335 WeakPolarHBondContact O-CB 3.12Å; D331-A335 PolarHBondContact O-N 3.24Å
332E49.2Very low54.6Low81 Ų8187.1 Ų87.138%0.37952%0.518SS..Hα-helixtrans-82.9-28.1178.5-76.9-176.1126.400112.9R311 D330 A335 A336R311-E332 VanDerWaalsContact CZ-CD 3.49Å; R311-E332 IonicContact CZ-OE1 3.38Å; R311-E332 IonicContact CZ-OE2 2.7Å; R311-E332 IonicContact NE-OE1 3.05Å; R311-E332 PolarHBondContact NE-OE1 3.34Å; R311-E332 IonicContact NE-OE2 3.85Å; R311-E332 PolarHBondContact NE-OE2 3.31Å; R311-E332 IonicContact NH1-OE1 3.07Å; R311-E332 IonicContact NH2-OE1 3.22Å; R311-E332 PolarHBondContact NH2-OE1 3.14Å; R311-E332 IonicContact NH2-OE2 2.88Å; R311-E332 PolarHBondContact NH2-OE2 2.89Å; D330-E332 PolarHBondContact O-N 3.35Å; E332-A335 PolarHBondContact O-N 3.42Å; E332-A336 WeakPolarHBondContact O-CB 3.48Å; E332-A336 PolarHBondContact O-N 3.14Å
333A44.1Very low52.2Low56 Ų5688.4 Ų88.446%0.46353%0.528SS..Hα-helixtrans-68.5-40.917000000110.7D330 A336 V337D330-A333 PolarHBondContact O-N 3.34Å; A333-A336 PolarHBondContact O-N 3.35Å; A333-V337 VanDerWaalsContact O-CG2 3.29Å; A333-V337 WeakPolarHBondContact O-CG2 3.5Å; A333-V337 PolarHBondContact O-N 2.72Å
334A38.9Very low50Low60 Ų6086 Ų8650%0.49651%0.512SS..Hα-helixtrans-61.9-40.7172.100000112.2D330 A336 V337 S338D330-A334 WeakPolarHBondContact O-CB 3.41Å; D330-A334 PolarHBondContact O-N 3.45Å; A334-A336 PolarHBondContact O-N 2.95Å; A334-V337 PolarHBondContact O-N 3.41Å; A334-S338 WeakPolarHBondContact O-CB 3.41Å; A334-S338 PolarHBondContact O-N 3.23Å
335A46Very low48.4Very low50 Ų5088.6 Ų88.641%0.41352%0.517SS..Hα-helixtrans-67-33.5175.300000113.5D331 E332 K339D331-A335 WeakPolarHBondContact O-CB 3.12Å; D331-A335 PolarHBondContact O-N 3.24Å; E332-A335 PolarHBondContact O-N 3.42Å; A335-K339 WeakPolarHBondContact O-CG 3.39Å; A335-K339 PolarHBondContact O-N 3.48Å
336A44.5Very low46.8Very low56 Ų5686.2 Ų86.246%0.46352%0.52SS..Hα-helixtrans-71.9-40.6174.400000112.1E332 A333 A334 K339 T340E332-A336 WeakPolarHBondContact O-CB 3.48Å; E332-A336 PolarHBondContact O-N 3.14Å; A333-A336 PolarHBondContact O-N 3.35Å; A334-A336 PolarHBondContact O-N 2.95Å; A336-K339 PolarHBondContact O-N 3.19Å; A336-T340 PolarHBondContact O-N 3.16Å; A336-T340 PolarHBondContact O-OG1 2.8Å
337V44.4Very low45.3Very low87 Ų8789 Ų8953%0.52754%0.543SS..Hα-helixtrans-66.3-38.2175.6173.30000111.4A333 A334 K339 T340 Q341A333-V337 VanDerWaalsContact O-CG2 3.29Å; A333-V337 WeakPolarHBondContact O-CG2 3.5Å; A333-V337 PolarHBondContact O-N 2.72Å; A334-V337 PolarHBondContact O-N 3.41Å; V337-K339 PolarHBondContact O-N 3.07Å; V337-T340 PolarHBondContact O-N 3.12Å; V337-Q341 PolarHBondContact O-N 3.36Å; V337-Q341 VanDerWaalsContact O-N 3.12Å
338S39.2Very low44.4Very low69 Ų6989.8 Ų89.848%0.48355%0.55SS..Hα-helixtrans-64.3-36.1176-177.10000113.1A334 T342A334-S338 WeakPolarHBondContact O-CB 3.41Å; A334-S338 PolarHBondContact O-N 3.23Å; S338-T342 PolarHBondContact O-N 3.36Å; S338-T342 PolarHBondContact O-OG1 2.88Å
339K45.5Very low43.6Very low158 Ų15892.3 Ų92.369%0.68756%0.563SS**Hα-helixtrans-71.2-32.2175.6-76.8-174.6177.2-169.50113.6A335 A336 V337 T342 S343A335-K339 WeakPolarHBondContact O-CG 3.39Å; A335-K339 PolarHBondContact O-N 3.48Å; A336-K339 PolarHBondContact O-N 3.19Å; V337-K339 PolarHBondContact O-N 3.07Å; K339-T342 WeakPolarHBondContact CA-OG1 3.31Å; K339-T342 PolarHBondContact O-OG1 3.17Å; K339-S343 PolarHBondContact O-N 2.79Å; K339-S343 PolarHBondContact O-OG 3.18Å
340T42.8Very low42.7Very low96 Ų9697.9 Ų97.959%0.58959%0.593SS**Hα-helixtrans-73.6-35175.6-45.20000111.7A336 V337 S343 S344A336-T340 PolarHBondContact O-N 3.16Å; A336-T340 PolarHBondContact O-OG1 2.8Å; V337-T340 PolarHBondContact O-N 3.12Å; T340-S343 PolarHBondContact O-OG 3.37Å; T340-S344 PolarHBondContact O-N 2.99Å; T340-S344 PolarHBondContact O-OG 3.25Å
341Q38.1Very low41.9Very low126 Ų12696.8 Ų96.859%0.58960%0.601SS**Hα-helixtrans-69.7-36.8176.1-79.5-176.5-1400113.1V337 S344 V345V337-Q341 PolarHBondContact O-N 3.36Å; V337-Q341 VanDerWaalsContact O-N 3.12Å; Q341-S344 PolarHBondContact O-N 3.43Å; Q341-S344 PolarHBondContact O-OG 3.42Å; Q341-V345 VanDerWaalsContact O-CG2 3.3Å; Q341-V345 WeakPolarHBondContact O-CG2 3.06Å; Q341-V345 PolarHBondContact O-N 3.39Å
342T37.7Very low41.8Very low94 Ų9496.7 Ų96.758%0.57761%0.607SS**Hα-helixtrans-71-29.1178.531.70000113.2S338 K339S338-T342 PolarHBondContact O-N 3.36Å; S338-T342 PolarHBondContact O-OG1 2.88Å; K339-T342 WeakPolarHBondContact CA-OG1 3.31Å; K339-T342 PolarHBondContact O-OG1 3.17Å
343S38.8Very low41.3Very low78 Ų78101.2 Ų101.255%0.54566%0.658SS.*Hα-helixtrans-79-28.5175.235.10000113.2K339 T340K339-S343 PolarHBondContact O-N 2.79Å; K339-S343 PolarHBondContact O-OG 3.18Å; T340-S343 PolarHBondContact O-OG 3.37Å
344S38.4Very low41.1Very low71 Ų71103.5 Ų103.550%0.49767%0.668SS.*Hα-helixtrans-76.1-16.3174.156.60000115.2T340 Q341T340-S344 PolarHBondContact O-N 2.99Å; T340-S344 PolarHBondContact O-OG 3.25Å; Q341-S344 PolarHBondContact O-N 3.43Å; Q341-S344 PolarHBondContact O-OG 3.42Å
345V41.4Very low41.2Very low112 Ų112105.8 Ų105.868%0.67968%0.677SS**Hα-helixtrans-91.4-18.8-178176.90000112.4Q341Q341-V345 VanDerWaalsContact O-CG2 3.3Å; Q341-V345 WeakPolarHBondContact O-CG2 3.06Å; Q341-V345 PolarHBondContact O-N 3.39Å
346S39.1Very low41Very low110 Ų110108.9 Ų108.977%0.76969%0.692SS**THydrogen-bonded Turntrans-86.1-5-179.2-70.30000115.4
347S40.6Very low40.8Very low97 Ų97112 Ų11268%0.67871%0.705SS**THydrogen-bonded Turntrans-98.47.5-178.356.40000114.9
348S40.9Very low40.5Very low88 Ų88113.6 Ų113.662%0.61572%0.716SS**SBendtrans-125.661-171.7-550000112
349Q46.7Very low40.6Very low187 Ų187116.5 Ų116.587%0.87473%0.732SS**  trans-178104.6155.7-104.5165.734.100108.6
350V38Very low40.3Very low138 Ų138113.6 Ų113.684%0.83674%0.735SS**  -174.3109.7126.6175.80000106.3P352V350-P352 HydrophobicContact CG1-CG 4.26Å
351A36.6Very low40.1Very low102 Ų102114.9 Ų114.984%0.84375%0.747SS**  trans-128.3123.6155.200000106.5
352P47.2Very low40.2Very low114 Ų114114 Ų11474%0.7476%0.76SS**  trans-103.7148.9162.7138.1000110.9V350V350-P352 HydrophobicContact CG1-CG 4.26Å
353A37.4Very low40.5Very low177 Ų177115.8 Ų115.8100%1.46378%0.776SS**  trans-66.4017800000114.2

Retrieved 353 of 353 residues in 69.5 ms (Link to these results)

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